A0A5K4F3X4_SCHMA Loading...

Transcription factor 25 AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F3X4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 626 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	46.9	Very low	55.2	Low	200 Å²	200	148.5 Å²	148.5	99%	0.985	71%	0.705	S	S	*	*				0	131.6	0	-69.7	175.6	74.3	0	0	109.3	V5	M1-V5 HydrophobicContact CE-CB 4.19Å; M1-V5 HydrophobicContact CE-CG1 3.49Å; M1-V5 VanDerWaalsContact CE-CG1 3.49Å
2	S	61.2	Low	53.2	Low	78 Å²	78	141.8 Å²	141.8	55%	0.545	70%	0.704	S	S	.	*			trans	-73.1	146.7	-178.2	168	0	0	0	0	112	R4 V5	S2-R4 PolarHBondContact O-N 2.94Å; S2-V5 PolarHBondContact O-N 3.23Å
3	S	61.4	Low	51.7	Low	85 Å²	85	138.7 Å²	138.7	59%	0.594	71%	0.705	S	S	*	*	H	α-helix	trans	-52.8	-20	-176.9	60.5	0	0	0	0	114.9	V5 R7	S3-V5 VanDerWaalsContact C-N 3.33Å; S3-V5 PolarHBondContact O-N 3.46Å; S3-R7 PolarHBondContact O-N 3.06Å
4	R	68.1	Low	49.9	Very low	210 Å²	210	140.4 Å²	140.4	79%	0.792	71%	0.709	S	S	*	*	H	α-helix	trans	-65	-33	174	-122.3	178	-179	-177.7	0.5	113.2	S2	S2-R4 PolarHBondContact O-N 2.94Å
5	V	61.8	Low	48.4	Very low	65 Å²	65	141.2 Å²	141.2	39%	0.394	72%	0.716	S	S	.	*	H	α-helix	trans	-73.9	-37.9	-178.7	-175.7	0	0	0	0	111.2	M1 S2 S3 R7 K8 L9	M1-V5 HydrophobicContact CE-CB 4.19Å; M1-V5 HydrophobicContact CE-CG1 3.49Å; M1-V5 VanDerWaalsContact CE-CG1 3.49Å; S2-V5 PolarHBondContact O-N 3.23Å; S3-V5 VanDerWaalsContact C-N 3.33Å; S3-V5 PolarHBondContact O-N 3.46Å; V5-R7 PolarHBondContact O-N 2.88Å; V5-K8 PolarHBondContact O-N 3.46Å; V5-L9 PolarHBondContact O-N 3.49Å
6	L	57.7	Low	47.5	Very low	128 Å²	128	138.9 Å²	138.9	67%	0.67	71%	0.714	S	S	*	*	H	α-helix	trans	-64.1	-35.2	176.6	-94.3	157.5	0	0	0	113.3	K8 L9 K10	L6-K8 VanDerWaalsContact C-N 3.33Å; L6-K8 PolarHBondContact O-N 3.04Å; L6-L9 PolarHBondContact O-N 2.76Å; L6-K10 PolarHBondContact O-N 3.02Å
7	R	59.9	Low	46.3	Very low	196 Å²	196	139.5 Å²	139.5	74%	0.74	72%	0.718	S	S	*	*	H	α-helix	trans	-70.4	-28.5	175.6	-72.5	-172.2	-165.7	170.9	4.5	113.3	S3 V5	S3-R7 PolarHBondContact O-N 3.06Å; V5-R7 PolarHBondContact O-N 2.88Å
8	K	54.2	Low	45.2	Very low	180 Å²	180	139.6 Å²	139.6	78%	0.783	72%	0.719	S	S	*	*	H	α-helix	trans	-73.6	-35.9	176.7	-103.7	-172.8	173.1	-172.4	0	111.9	V5 L6	V5-K8 PolarHBondContact O-N 3.46Å; L6-K8 VanDerWaalsContact C-N 3.33Å; L6-K8 PolarHBondContact O-N 3.04Å
9	L	49.5	Very low	44.1	Very low	128 Å²	128	139.3 Å²	139.3	67%	0.67	72%	0.719	S	S	*	*	H	α-helix	trans	-69.7	-35.4	175.1	-84.8	156.4	0	0	0	112.6	V5 L6 K11 G12	V5-L9 PolarHBondContact O-N 3.49Å; L6-L9 PolarHBondContact O-N 2.76Å; L9-K11 VanDerWaalsContact C-N 3.29Å; L9-K11 PolarHBondContact O-N 2.87Å; L9-G12 PolarHBondContact O-N 2.91Å
10	K	50	Low	43.3	Very low	175 Å²	175	140.6 Å²	140.6	76%	0.761	73%	0.727	S	S	*	*	H	α-helix	trans	-71.5	-19	178.9	-163.2	171.7	-179	-179.7	0	114.2	L6	L6-K10 PolarHBondContact O-N 3.02Å
11	K	35.9	Very low	42.4	Very low	188 Å²	188	140 Å²	140	82%	0.817	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-0.3	177.3	-80.4	-169	170.8	-165.2	0	114.1	L9	L9-K11 VanDerWaalsContact C-N 3.29Å; L9-K11 PolarHBondContact O-N 2.87Å
12	G	32.3	Very low	41.5	Very low	68 Å²	68	138.3 Å²	138.3	70%	0.701	72%	0.721	S	S	*	*	S	Bend	trans	-95.3	2	-174.2	0	0	0	0	0	115.7	L9	L9-G12 PolarHBondContact O-N 2.91Å
13	S	33.3	Very low	39.5	Very low	102 Å²	102	143.7 Å²	143.7	71%	0.713	74%	0.735	S	S	*	*			trans	-139.3	64.6	-177.6	68.8	0	0	0	0	111.5
14	E	27	Very low	37.9	Very low	163 Å²	163	144.9 Å²	144.9	76%	0.762	74%	0.743	S	S	*	*			trans	-126.2	112.7	163.6	-79.3	-177.6	171.6	0	0	109
15	N	26.1	Very low	35.8	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	74%	0.74	S	S	*	*			trans	73.1	159.7	149.2	-61.9	-12.6	0	0	0	119.3
16	P	35.4	Very low	34.3	Very low	104 Å²	104	146.1 Å²	146.1	68%	0.675	76%	0.763	S	S	*	*			cis	-141	-179.9	9.4	34.1	-11.1	0	0	0	117.1
17	L	25.8	Very low	32.8	Very low	150 Å²	150	147.4 Å²	147.4	79%	0.785	77%	0.77	S	S	*	*			trans	84.8	135.2	157.4	-48.5	-179.1	0	0	0	115.9
18	D	27.4	Very low	31.4	Very low	140 Å²	140	146.7 Å²	146.7	75%	0.749	78%	0.776	S	S	*	*			cis	-151.1	164.9	26.7	-104.2	-30.5	0	0	0	112.7
19	D	24.1	Very low	30.3	Very low	134 Å²	134	143 Å²	143	72%	0.717	77%	0.77	S	S	*	*			trans	-58.3	148.8	-175	-59.4	-50	0	0	0	117.1
20	N	28.9	Very low	29.3	Very low	165 Å²	165	143.7 Å²	143.7	88%	0.882	78%	0.779	S	S	*	*				-169.7	126.3	124.5	-98.4	-43	0	0	0	112.1
21	D	23	Very low	28.5	Very low	129 Å²	129	141.9 Å²	141.9	69%	0.69	78%	0.783	S	S	*	*			trans	-63.7	143.6	177.8	-62.9	-58.9	0	0	0	113.8
22	N	28.1	Very low	28.2	Very low	165 Å²	165	136.6 Å²	136.6	88%	0.882	78%	0.782	S	S	*	*				-176.3	128.8	115.6	-96.4	-39.2	0	0	0	112.4
23	F	19.8	Very low	28	Very low	191 Å²	191	136.6 Å²	136.6	84%	0.838	78%	0.782	S	S	*	*			trans	-70.9	141.6	171	-84.2	-102.8	0	0	0	112
24	S	28.1	Very low	28	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	78%	0.776	S	S	*	*			trans	-163.6	115.7	134.1	-169.6	0	0	0	0	110.3
25	D	22.9	Very low	28.5	Very low	137 Å²	137	134.3 Å²	134.3	73%	0.733	78%	0.778	S	S	*	*			trans	-64.4	137.4	163.3	-73.7	-46.4	0	0	0	110.5
26	N	31	Very low	28.6	Very low	163 Å²	163	136.5 Å²	136.5	87%	0.872	78%	0.781	S	S	*	*			trans	-162.7	115.2	145.1	-92.1	-37	0	0	0	109.5
27	D	25.1	Very low	28.6	Very low	155 Å²	155	136.6 Å²	136.6	83%	0.829	78%	0.784	S	S	*	*			trans	-71.3	165.4	170.1	-75.8	-54.7	0	0	0	112.7
28	E	30.9	Very low	28.9	Very low	181 Å²	181	137.6 Å²	137.6	85%	0.846	78%	0.784	S	S	*	*			trans	97.6	146	165.4	-68.7	-103.4	153.7	0	0	118
29	P	32.1	Very low	28.9	Very low	102 Å²	102	140.9 Å²	140.9	66%	0.662	79%	0.792	S	S	*	*				-119.4	155.7	-88.8	24.7	-3.9	0	0	0	114.4	T31	P29-T31 PolarHBondContact O-N 3.33Å; P29-T31 VanDerWaalsContact O-N 3.12Å
30	V	28.3	Very low	29.2	Very low	144 Å²	144	139.8 Å²	139.8	87%	0.873	80%	0.795	S	S	*	*			trans	-63.1	104	175.6	179	0	0	0	0	111.3	G32	V30-G32 PolarHBondContact O-N 3.19Å
31	T	32.9	Very low	29.1	Very low	137 Å²	137	139.9 Å²	139.9	84%	0.84	80%	0.796	S	S	*	*			trans	-76.6	96.2	157.9	48.5	0	0	0	0	108.5	P29 G33	P29-T31 PolarHBondContact O-N 3.33Å; P29-T31 VanDerWaalsContact O-N 3.12Å; T31-G33 VanDerWaalsContact C-N 3.32Å; T31-G33 PolarHBondContact O-N 3.3Å
32	G	28.9	Very low	29.2	Very low	77 Å²	77	139.4 Å²	139.4	79%	0.794	80%	0.801	S	S	*	*			trans	-66.6	88.2	171.6	0	0	0	0	0	111	V30	V30-G32 PolarHBondContact O-N 3.19Å
33	G	29.5	Very low	29.1	Very low	68 Å²	68	141.9 Å²	141.9	70%	0.701	81%	0.805	S	S	*	*			trans	-73.5	130	163	0	0	0	0	0	109.9	T31	T31-G33 VanDerWaalsContact C-N 3.32Å; T31-G33 PolarHBondContact O-N 3.3Å
34	S	32.6	Very low	29.4	Very low	83 Å²	83	138.6 Å²	138.6	58%	0.58	81%	0.805	S	S	*	*			trans	-59.2	131	-178.2	178.3	0	0	0	0	112.7	F36 S37	S34-F36 PolarHBondContact O-N 3.44Å; S34-S37 PolarHBondContact O-OG 3.2Å
35	V	36.7	Very low	29.5	Very low	133 Å²	133	138.1 Å²	138.1	81%	0.806	81%	0.808	S	S	*	*	G	3₁₀ helix	trans	-64.3	3.2	178.9	178.4	0	0	0	0	113.6	S37	V35-S37 PolarHBondContact O-N 3.21Å
36	F	29.4	Very low	29.6	Very low	199 Å²	199	139.7 Å²	139.7	87%	0.873	81%	0.81	S	S	*	*	G	3₁₀ helix	trans	-93.4	20.8	178.8	-76.8	-78.1	0	0	0	114.8	S34	S34-F36 PolarHBondContact O-N 3.44Å
37	S	36	Very low	29.1	Very low	105 Å²	105	136.9 Å²	136.9	73%	0.734	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-109.7	10.1	178.6	42.9	0	0	0	0	115.7	S34 V35	S34-S37 PolarHBondContact O-OG 3.2Å; V35-S37 PolarHBondContact O-N 3.21Å
38	E	30.3	Very low	29.2	Very low	171 Å²	171	137.6 Å²	137.6	80%	0.799	81%	0.806	S	S	*	*	S	Bend	trans	-119.9	18.8	-173.8	-92.2	-176.4	170.8	0	0	117.5
39	F	28.9	Very low	28.6	Very low	210 Å²	210	134.8 Å²	134.8	92%	0.921	80%	0.801	S	S	*	*			trans	-127.9	33.8	174.4	-79.5	-78.2	0	0	0	115.5
40	S	29.2	Very low	28.3	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	81%	0.809	S	S	*	*			trans	-113.7	85.7	158.5	-65.4	0	0	0	0	108.5
41	N	27.9	Very low	28.3	Very low	167 Å²	167	136.2 Å²	136.2	89%	0.893	80%	0.803	S	S	*	*			trans	175.2	79.2	153.8	-89.2	-18.4	0	0	0	110.1
42	C	24.2	Very low	28	Very low	119 Å²	119	134.9 Å²	134.9	80%	0.804	80%	0.799	S	S	*	*			trans	-148.4	56.3	159.8	-148.5	0	0	0	0	110.9
43	F	27.1	Very low	27.7	Very low	217 Å²	217	135.7 Å²	135.7	95%	0.952	79%	0.792	S	S	*	*			trans	-148.1	81.1	155.3	-85.1	-72.5	0	0	0	108	A45	F43-A45 PolarHBondContact O-N 2.73Å
44	S	25	Very low	27.5	Very low	121 Å²	121	139.6 Å²	139.6	85%	0.846	80%	0.797	S	S	*	*			trans	-79.7	104.1	160.1	-72.7	0	0	0	0	108.6
45	A	30.5	Very low	27.2	Very low	100 Å²	100	142 Å²	142	83%	0.826	80%	0.803	S	S	*	*			trans	-106.4	123.3	152.2	0	0	0	0	0	107.1	F43	F43-A45 PolarHBondContact O-N 2.73Å
46	H	24.5	Very low	26.6	Very low	171 Å²	171	142 Å²	142	79%	0.792	80%	0.799	S	S	*	*			trans	-64	145.9	-176.4	-90.9	24	0	0	0	113.5
47	S	21.9	Very low	26.6	Very low	104 Å²	104	138.3 Å²	138.3	73%	0.727	80%	0.798	S	S	*	*			trans	61.7	113.4	144.6	60.8	0	0	0	0	119.5
48	I	26.3	Very low	26	Very low	170 Å²	170	140 Å²	140	87%	0.872	79%	0.793	S	S	*	*				-156.3	127	100.2	-84.9	149	0	0	0	109
49	T	19	Very low	25.9	Very low	122 Å²	122	140 Å²	140	75%	0.748	80%	0.799	S	S	*	*			trans	-76.4	148.6	171.8	-34.4	0	0	0	0	110.4
50	I	26	Very low	25.4	Very low	162 Å²	162	137.1 Å²	137.1	83%	0.831	79%	0.789	S	S	*	*				-175.6	143.7	126	-65.9	-146.7	0	0	0	108.6
51	P	28.1	Very low	25.1	Very low	114 Å²	114	137.2 Å²	137.2	74%	0.74	79%	0.788	S	S	*	*			trans	-112.6	162.9	-162.4	39.9	-26.9	0	0	0	116.1
52	S	26.9	Very low	24.8	Very low	109 Å²	109	137.4 Å²	137.4	76%	0.762	78%	0.783	S	S	*	*			trans	-171.6	108.9	150.7	-171.9	0	0	0	0	106.3
53	S	22.2	Very low	24.6	Very low	93 Å²	93	136 Å²	136	65%	0.65	78%	0.775	S	S	*	*				60.4	112.6	77.4	-62	0	0	0	0	113.8
54	D	23.9	Very low	24.6	Very low	150 Å²	150	136 Å²	136	80%	0.802	78%	0.775	S	S	*	*			trans	111.8	133.7	139.4	-59.2	-18.8	0	0	0	121
55	D	27.3	Very low	24.3	Very low	134 Å²	134	139.3 Å²	139.3	72%	0.717	77%	0.774	S	S	*	*			trans	83.2	101.9	157.2	-65.8	-32	0	0	0	119.8
56	N	24	Very low	24	Very low	134 Å²	134	140.6 Å²	140.6	72%	0.717	78%	0.777	S	S	*	*				77.1	107.5	77.1	-87.1	-38.8	0	0	0	113.4
57	S	29.5	Very low	23.9	Very low	120 Å²	120	142 Å²	142	84%	0.839	78%	0.781	S	S	*	*				-165.5	119.3	127	56.7	0	0	0	0	110.6
58	H	23.2	Very low	24.1	Very low	140 Å²	140	147.4 Å²	147.4	65%	0.648	79%	0.792	S	S	*	*			trans	-49.3	145.7	165.3	-80.6	-105.5	0	0	0	113.5
59	D	27.8	Very low	23.8	Very low	172 Å²	172	149.7 Å²	149.7	92%	0.92	79%	0.789	S	S	*	*				-145.7	120.9	126	-105.9	-25.8	0	0	0	109.5
60	Q	19.8	Very low	23.9	Very low	150 Å²	150	152.7 Å²	152.7	70%	0.701	79%	0.792	S	S	*	*			trans	-107.7	167	176.9	-82.5	-171.7	6.4	0	0	110
61	C	21.3	Very low	23.8	Very low	113 Å²	113	155.6 Å²	155.6	76%	0.764	80%	0.798	S	S	*	*			trans	86.6	144.6	163	-62.4	0	0	0	0	118.2
62	E	22.4	Very low	23.5	Very low	170 Å²	170	158.9 Å²	158.9	79%	0.794	80%	0.801	S	S	*	*			cis	-161.8	149.3	-39.7	-125.4	-174.2	172.8	0	0	105.5
63	S	19.9	Very low	23.1	Very low	90 Å²	90	162 Å²	162	63%	0.629	80%	0.801	S	S	*	*			trans	-16.3	134.6	164.4	51.9	0	0	0	0	120.3
64	F	26.8	Very low	23.2	Very low	216 Å²	216	163 Å²	163	95%	0.947	81%	0.808	S	S	*	*			trans	-126.6	121.6	137.9	-92.4	-82.7	0	0	0	111.4
65	K	20	Very low	23.2	Very low	191 Å²	191	164.8 Å²	164.8	83%	0.83	81%	0.808	S	S	*	*			trans	-82.7	139.6	168.6	-68.6	170.5	177.1	167	0	109.3
66	S	24.2	Very low	23	Very low	127 Å²	127	167.2 Å²	167.2	89%	0.888	82%	0.815	S	S	*	*				174	146.5	116.6	48.3	0	0	0	0	114.1
67	K	20.8	Very low	22.9	Very low	202 Å²	202	170.4 Å²	170.4	88%	0.878	82%	0.823	S	S	*	*			trans	-74.2	144.8	-171	-67.2	156.7	170.4	169.9	0	113.1
68	K	25.7	Very low	22.8	Very low	217 Å²	217	167.8 Å²	167.8	94%	0.943	82%	0.815	S	S	*	*			trans	-144.7	134.6	139.8	-111	176.4	-174.9	174.6	0	111.7
69	R	21.6	Very low	22.9	Very low	217 Å²	217	171.1 Å²	171.1	82%	0.819	83%	0.828	S	S	*	*			trans	-89.8	148.2	-166.8	-71.1	163.9	108.7	174.1	2.5	112.6
70	K	21.3	Very low	22.9	Very low	185 Å²	185	170.5 Å²	170.5	80%	0.804	82%	0.823	S	S	*	*			trans	58.3	112.2	141.2	-76.3	180	173.6	175.5	0	119.5
71	K	23.7	Very low	23.3	Very low	223 Å²	223	166.1 Å²	166.1	97%	0.97	82%	0.818	S	S	*	*				-134.9	149.7	127.3	-115	177.2	-177.6	175.9	0	110.2
72	K	20.4	Very low	23.9	Very low	184 Å²	184	165.9 Å²	165.9	80%	0.8	81%	0.807	S	S	*	*			trans	-111.4	137.8	-148.2	-167.4	-178	-171.8	-179.1	0	109.7
73	K	20.5	Very low	24.2	Very low	174 Å²	174	163.1 Å²	163.1	76%	0.757	80%	0.802	S	S	*	*			trans	57.4	109.8	153.4	-76.8	180	175.7	-178.3	0	119.1
74	S	23	Very low	25.3	Very low	113 Å²	113	160.6 Å²	160.6	79%	0.79	78%	0.779	S	S	*	*				-132.5	110.1	127	172.2	0	0	0	0	107.7	Q76	S74-Q76 PolarHBondContact O-N 2.91Å
75	K	23.6	Very low	26.2	Very low	188 Å²	188	154.7 Å²	154.7	82%	0.817	76%	0.755	S	S	*	*			trans	-74.8	92.4	172.1	-89.4	-178.4	168.9	-177.3	0	107.3	K77	K75-K77 PolarHBondContact O-N 3.19Å
76	Q	24	Very low	27.4	Very low	185 Å²	185	146.2 Å²	146.2	86%	0.864	72%	0.718	S	S	*	*			trans	-78.1	110.2	154.2	-90.4	-176.7	-11.5	0	0	107.1	S74 G78	S74-Q76 PolarHBondContact O-N 2.91Å; Q76-G78 PolarHBondContact O-N 3.48Å
77	K	22.6	Very low	28.4	Very low	201 Å²	201	143.2 Å²	143.2	87%	0.874	69%	0.692	S	S	*	*			trans	-50.5	112.6	169.5	-78.3	174.7	172.1	176.9	0	107.6	K75 K79	K75-K77 PolarHBondContact O-N 3.19Å; K77-K79 PolarHBondContact O-N 2.95Å
78	G	25.6	Very low	29.2	Very low	65 Å²	65	138.7 Å²	138.7	67%	0.67	68%	0.678	S	S	*	*			trans	-53.9	124.5	170.4	0	0	0	0	0	108.6	Q76 I80	Q76-G78 PolarHBondContact O-N 3.48Å; G78-I80 PolarHBondContact O-N 3.14Å
79	K	25.7	Very low	30.2	Very low	211 Å²	211	129.2 Å²	129.2	92%	0.917	64%	0.637	S	S	*	*			trans	-58.1	109.6	164.3	-76.4	176.7	176.5	176.2	0	105.8	K77 G81	K77-K79 PolarHBondContact O-N 2.95Å; K79-G81 PolarHBondContact O-N 3.28Å
80	I	27.6	Very low	30.9	Very low	159 Å²	159	125.6 Å²	125.6	82%	0.815	63%	0.627	S	S	*	*			trans	-64.9	93.8	168.6	-64.1	163.3	0	0	0	105	G78 I82	G78-I80 PolarHBondContact O-N 3.14Å; I80-I82 PolarHBondContact O-N 2.89Å
81	G	29	Very low	31.4	Very low	58 Å²	58	118.9 Å²	118.9	60%	0.598	60%	0.6	S	S	*	*			trans	-65.2	110.3	164.3	0	0	0	0	0	106.4	K79 T83	K79-G81 PolarHBondContact O-N 3.28Å; G81-T83 VanDerWaalsContact C-N 3.31Å; G81-T83 PolarHBondContact O-N 3.25Å
82	I	34	Very low	31.9	Very low	107 Å²	107	112.4 Å²	112.4	55%	0.549	58%	0.583	S	S	.	*			trans	-69.5	98.9	165.9	-59.8	172.7	0	0	0	104.9	I80 Y84	I80-I82 PolarHBondContact O-N 2.89Å; I82-Y84 HydrophobicContact CG2-CD1 4.49Å; I82-Y84 HydrophobicContact CG2-CE1 4.23Å; I82-Y84 WeakPolarHBondContact O-CD2 3.03Å; I82-Y84 PolarHBondContact O-N 3.22Å
83	T	29	Very low	32.4	Very low	112 Å²	112	110.7 Å²	110.7	69%	0.687	58%	0.582	S	S	*	*			trans	-73.9	113.3	170.3	-55.5	0	0	0	0	107.3	G81 Q85	G81-T83 VanDerWaalsContact C-N 3.31Å; G81-T83 PolarHBondContact O-N 3.25Å; T83-Q85 PolarHBondContact O-N 3.16Å
84	Y	42.3	Very low	33	Very low	38 Å²	38	109 Å²	109	15%	0.149	58%	0.577	C	S	.	*			trans	-77.1	121.2	175.9	-57.6	-91.4	0	0	0	108.2	I82 L86 D87 A482 F483 P484	I82-Y84 HydrophobicContact CG2-CD1 4.49Å; I82-Y84 HydrophobicContact CG2-CE1 4.23Å; I82-Y84 WeakPolarHBondContact O-CD2 3.03Å; I82-Y84 PolarHBondContact O-N 3.22Å; Y84-L86 PolarHBondContact O-N 3.15Å; Y84-D87 WeakPolarHBondContact CD2-OD2 3.15Å; Y84-D87 VanDerWaalsContact O-CB 3.28Å; Y84-D87 WeakPolarHBondContact O-CB 3.2Å; Y84-D87 PolarHBondContact O-N 3.19Å; Y84-A482 HydrophobicContact CE1-CB 3.87Å; Y84-F483 VanDerWaalsContact CE1-O 3.28Å; Y84-F483 WeakPolarHBondContact CE1-O 3.32Å; Y84-P484 HydrophobicContact CD1-CG 4.42Å; Y84-P484 HydrophobicContact CG-CG 4.41Å
85	Q	45.2	Very low	34.1	Very low	91 Å²	91	109.5 Å²	109.5	43%	0.425	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-65.5	-21.5	174.2	-71.1	-179.5	-4.1	0	0	111.8	T83 D87 N88 S478 L479	T83-Q85 PolarHBondContact O-N 3.16Å; Q85-D87 VanDerWaalsContact C-N 3.26Å; Q85-D87 PolarHBondContact O-N 3.26Å; Q85-N88 WeakPolarHBondContact O-CB 3.2Å; Q85-N88 PolarHBondContact O-N 2.73Å; Q85-N88 VanDerWaalsContact O-N 3.16Å; Q85-S478 PolarHBondContact OE1-OG 3.07Å; Q85-S478 VanDerWaalsContact OE1-OG 3.08Å; Q85-L479 HydrophobicContact CB-CD2 4.19Å
86	L	45.9	Very low	35.3	Very low	13 Å²	13	102.8 Å²	102.8	7%	0.068	56%	0.562	C	S	.	*	G	3₁₀ helix	trans	-71.3	-14.1	167.8	-70.3	162.4	0	0	0	113.7	Y84 N88 I89 L341 L479 Y480 P484	Y84-L86 PolarHBondContact O-N 3.15Å; L86-N88 VanDerWaalsContact C-N 3.27Å; L86-I89 HydrophobicContact CD2-CD1 4.38Å; L86-I89 WeakPolarHBondContact O-CD1 3.38Å; L86-I89 WeakPolarHBondContact O-CG1 3.4Å; L86-L341 HydrophobicContact CD2-CD2 4.45Å; L86-L479 WeakPolarHBondContact CD1-O 3.3Å; L86-Y480 HydrophobicContact CD1-CD1 4.24Å; L86-P484 HydrophobicContact CB-CG 3.48Å; L86-P484 VanDerWaalsContact CB-CG 3.48Å; L86-P484 HydrophobicContact CD1-CG 4.13Å; L86-P484 HydrophobicContact CG-CG 4.47Å
87	D	44.7	Very low	36.6	Very low	64 Å²	64	95.8 Å²	95.8	34%	0.342	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-77.3	-16.1	168.5	-73.4	-21.8	0	0	0	111.7	Y84 Q85 I89 P484	Y84-D87 WeakPolarHBondContact CD2-OD2 3.15Å; Y84-D87 VanDerWaalsContact O-CB 3.28Å; Y84-D87 WeakPolarHBondContact O-CB 3.2Å; Y84-D87 PolarHBondContact O-N 3.19Å; Q85-D87 VanDerWaalsContact C-N 3.26Å; Q85-D87 PolarHBondContact O-N 3.26Å; D87-I89 PolarHBondContact O-N 3.16Å; D87-I89 VanDerWaalsContact O-N 3.14Å; D87-P484 WeakPolarHBondContact OD1-CB 3.3Å
88	N	38.9	Very low	38.3	Very low	108 Å²	108	89.2 Å²	89.2	58%	0.578	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-76.3	11.4	174.5	-62.9	-18.3	0	0	0	112.8	Q85 L86 K90	Q85-N88 WeakPolarHBondContact O-CB 3.2Å; Q85-N88 PolarHBondContact O-N 2.73Å; Q85-N88 VanDerWaalsContact O-N 3.16Å; L86-N88 VanDerWaalsContact C-N 3.27Å; N88-K90 PolarHBondContact O-N 3.06Å
89	I	45.8	Very low	39.9	Very low	18 Å²	18	92 Å²	92	9%	0.092	51%	0.513	C	S	.	.			trans	-74.4	59.7	164	-54.4	169.2	0	0	0	108.2	L86 D87 R336	L86-I89 HydrophobicContact CD2-CD1 4.38Å; L86-I89 WeakPolarHBondContact O-CD1 3.38Å; L86-I89 WeakPolarHBondContact O-CG1 3.4Å; D87-I89 PolarHBondContact O-N 3.16Å; D87-I89 VanDerWaalsContact O-N 3.14Å; I89-R336 HydrophobicContact CG2-CB 3.67Å; I89-R336 HydrophobicContact CG2-CG 3.71Å
90	K	36.3	Very low	41.8	Very low	140 Å²	140	86.1 Å²	86.1	61%	0.609	49%	0.489	S	S	*	.	S	Bend	trans	-120	142.2	170.6	-74.1	-174.3	177	-176	0	107.6	N88 S92	N88-K90 PolarHBondContact O-N 3.06Å; K90-S92 PolarHBondContact O-N 3.45Å; K90-S92 VanDerWaalsContact O-N 3.14Å
91	L	32.7	Very low	44.2	Very low	44 Å²	44	79.8 Å²	79.8	23%	0.23	46%	0.459	C	S	.	.			trans	-51.8	119.8	169.7	-107.1	70.4	0	0	0	109.7	I97 E302	L91-I97 HydrophobicContact CD2-CD1 4.37Å; L91-I97 HydrophobicContact CD2-CG1 4.33Å; L91-I97 HydrophobicContact CD2-CG2 3.67Å; L91-E302 WeakPolarHBondContact CD1-OE2 3.49Å
92	S	32.8	Very low	46.8	Very low	87 Å²	87	83.8 Å²	83.8	61%	0.608	46%	0.46	S	S	*	.			trans	-73.8	127.3	161.6	44.9	0	0	0	0	108.3	K90 E94 I97	K90-S92 PolarHBondContact O-N 3.45Å; K90-S92 VanDerWaalsContact O-N 3.14Å; S92-E94 PolarHBondContact O-N 2.97Å; S92-I97 VanDerWaalsContact O-CD1 3.31Å; S92-I97 WeakPolarHBondContact O-CD1 3.27Å
93	N	32.3	Very low	49.4	Very low	148 Å²	148	83.3 Å²	83.3	79%	0.791	46%	0.455	S	S	*	.			trans	-74	88.8	-177.7	-76.5	-18.7	0	0	0	111.9
94	E	32.3	Very low	52.3	Low	138 Å²	138	78.2 Å²	78.2	65%	0.645	42%	0.424	S	S	*	.			trans	-118.7	153.5	167.4	-78	-71.8	156.8	0	0	110.9	S92 G96 I97	S92-E94 PolarHBondContact O-N 2.97Å; E94-G96 PolarHBondContact O-N 3.39Å; E94-I97 WeakPolarHBondContact O-CD1 3.48Å; E94-I97 WeakPolarHBondContact O-CG1 3.14Å; E94-I97 PolarHBondContact O-N 3.14Å
95	P	46.2	Very low	54.6	Low	124 Å²	124	78.6 Å²	78.6	81%	0.805	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-2.8	-165.2	9	-8.9	0	0	0	117
96	G	48.2	Very low	56.9	Low	47 Å²	47	78.7 Å²	78.7	49%	0.485	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.6	174.7	0	0	0	0	0	115.8	E94 A98	E94-G96 PolarHBondContact O-N 3.39Å; G96-A98 PolarHBondContact O-N 3.13Å
97	I	51.9	Low	59.3	Low	38 Å²	38	79.2 Å²	79.2	20%	0.195	43%	0.434	C	S	.	.	H	α-helix	trans	-66.2	-31.3	-171.2	-69.8	162.3	0	0	0	114	L91 S92 E94 D99 Q100 S101	L91-I97 HydrophobicContact CD2-CD1 4.37Å; L91-I97 HydrophobicContact CD2-CG1 4.33Å; L91-I97 HydrophobicContact CD2-CG2 3.67Å; S92-I97 VanDerWaalsContact O-CD1 3.31Å; S92-I97 WeakPolarHBondContact O-CD1 3.27Å; E94-I97 WeakPolarHBondContact O-CD1 3.48Å; E94-I97 WeakPolarHBondContact O-CG1 3.14Å; E94-I97 PolarHBondContact O-N 3.14Å; I97-D99 PolarHBondContact O-N 2.84Å; I97-Q100 PolarHBondContact O-N 3.4Å; I97-S101 VanDerWaalsContact O-CB 3.31Å; I97-S101 WeakPolarHBondContact O-CB 3.48Å; I97-S101 PolarHBondContact O-N 3.29Å; I97-S101 PolarHBondContact O-OG 3.11Å
98	A	57.4	Low	61.7	Low	64 Å²	64	76.1 Å²	76.1	53%	0.529	42%	0.418	S	S	.	.	H	α-helix	trans	-64.3	-30.1	-174.4	0	0	0	0	0	112.9	G96 S101 K102	G96-A98 PolarHBondContact O-N 3.13Å; A98-S101 WeakPolarHBondContact CA-OG 3.29Å; A98-S101 PolarHBondContact O-OG 3.16Å; A98-S101 VanDerWaalsContact O-OG 3.11Å; A98-K102 WeakPolarHBondContact O-CD 3.4Å; A98-K102 VanDerWaalsContact O-CG 3.3Å; A98-K102 WeakPolarHBondContact O-CG 3.35Å
99	D	60.9	Low	64.4	Low	122 Å²	122	75.8 Å²	75.8	65%	0.652	41%	0.411	S	S	*	.	H	α-helix	trans	-83.4	-42.1	177.4	-160.5	36.6	0	0	0	111.2	I97 S101 K102 Q103	I97-D99 PolarHBondContact O-N 2.84Å; D99-S101 PolarHBondContact O-N 3.43Å; D99-K102 PolarHBondContact O-N 3.46Å; D99-Q103 PolarHBondContact O-N 3.32Å
100	Q	64.8	Low	66.8	Low	89 Å²	89	75.5 Å²	75.5	42%	0.416	41%	0.41	S	S	.	.	H	α-helix	trans	-60.8	-44.5	175	-69.2	-179.4	-6.6	0	0	112.2	I97 K102 Q103 V104	I97-Q100 PolarHBondContact O-N 3.4Å; Q100-K102 VanDerWaalsContact C-N 3.32Å; Q100-K102 PolarHBondContact O-N 3.01Å; Q100-Q103 PolarHBondContact O-N 3.32Å; Q100-V104 WeakPolarHBondContact O-CG2 3.45Å; Q100-V104 PolarHBondContact O-N 2.92Å
101	S	77.2	Confident	69.6	Low	26 Å²	26	72 Å²	72	18%	0.182	40%	0.398	C	S	.	.	H	α-helix	trans	-60.9	-39.9	177	54.6	0	0	0	0	112	I97 A98 D99 V104 I105	I97-S101 VanDerWaalsContact O-CB 3.31Å; I97-S101 WeakPolarHBondContact O-CB 3.48Å; I97-S101 PolarHBondContact O-N 3.29Å; I97-S101 PolarHBondContact O-OG 3.11Å; A98-S101 WeakPolarHBondContact CA-OG 3.29Å; A98-S101 PolarHBondContact O-OG 3.16Å; A98-S101 VanDerWaalsContact O-OG 3.11Å; D99-S101 PolarHBondContact O-N 3.43Å; S101-V104 PolarHBondContact O-N 2.91Å; S101-I105 WeakPolarHBondContact O-CB 3.32Å; S101-I105 WeakPolarHBondContact O-CD1 3.41Å; S101-I105 WeakPolarHBondContact O-CG1 3.36Å; S101-I105 PolarHBondContact O-N 3.39Å
102	K	84.1	Confident	72.5	Confident	141 Å²	141	73.3 Å²	73.3	61%	0.613	41%	0.405	S	S	*	.	H	α-helix	trans	-64.1	-43.2	174.8	-74.8	174.3	-176.7	177.5	0	112.3	A98 D99 Q100 I105 D106	A98-K102 WeakPolarHBondContact O-CD 3.4Å; A98-K102 VanDerWaalsContact O-CG 3.3Å; A98-K102 WeakPolarHBondContact O-CG 3.35Å; D99-K102 PolarHBondContact O-N 3.46Å; Q100-K102 VanDerWaalsContact C-N 3.32Å; Q100-K102 PolarHBondContact O-N 3.01Å; K102-I105 PolarHBondContact O-N 2.88Å; K102-D106 PolarHBondContact O-N 3.44Å
103	Q	88.1	Confident	75.3	Confident	98 Å²	98	78 Å²	78	46%	0.458	41%	0.414	S	S	.	.	H	α-helix	trans	-62	-44.7	177.1	-171.6	180	12	0	0	111.5	D99 Q100 D106 L107	D99-Q103 PolarHBondContact O-N 3.32Å; Q100-Q103 PolarHBondContact O-N 3.32Å; Q103-D106 PolarHBondContact O-N 3.46Å; Q103-L107 HydrophobicContact CG-CD1 4.39Å; Q103-L107 WeakPolarHBondContact O-CG 3.27Å; Q103-L107 PolarHBondContact O-N 3.33Å
104	V	89.9	Confident	78.2	Confident	5 Å²	5	73.4 Å²	73.4	3%	0.03	39%	0.389	C	S	.	.	H	α-helix	trans	-62.2	-45.4	175.9	174	0	0	0	0	110.7	Q100 S101 D106 L107 L108 Y301 L332	Q100-V104 WeakPolarHBondContact O-CG2 3.45Å; Q100-V104 PolarHBondContact O-N 2.92Å; S101-V104 PolarHBondContact O-N 2.91Å; V104-D106 VanDerWaalsContact C-N 3.28Å; V104-D106 PolarHBondContact O-N 2.84Å; V104-L107 PolarHBondContact O-N 3.47Å; V104-L108 HydrophobicContact CG1-CD1 3.85Å; V104-L108 HydrophobicContact CG1-CG 4.24Å; V104-L108 VanDerWaalsContact O-CG 3.27Å; V104-L108 WeakPolarHBondContact O-CG 3.34Å; V104-L108 PolarHBondContact O-N 3.35Å; V104-Y301 HydrophobicContact CG1-CD2 4.12Å; V104-L332 HydrophobicContact CG1-CD2 4.06Å; V104-L332 HydrophobicContact CG2-CD2 3.59Å; V104-L332 HydrophobicContact CG2-CG 4.17Å
105	I	91.4	Very high	81.2	Confident	46 Å²	46	67 Å²	67	24%	0.236	36%	0.359	C	S	.	.	H	α-helix	trans	-58.3	-41.5	177.3	-71.8	164.4	0	0	0	111.3	S101 K102 L108 K109	S101-I105 WeakPolarHBondContact O-CB 3.32Å; S101-I105 WeakPolarHBondContact O-CD1 3.41Å; S101-I105 WeakPolarHBondContact O-CG1 3.36Å; S101-I105 PolarHBondContact O-N 3.39Å; K102-I105 PolarHBondContact O-N 2.88Å; I105-L108 PolarHBondContact O-N 3.21Å; I105-K109 PolarHBondContact O-N 3.3Å
106	D	93.9	Very high	83.3	Confident	92 Å²	92	64.9 Å²	64.9	49%	0.492	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-43.3	177.4	-165.8	54.8	0	0	0	112.1	K102 Q103 V104 L108 K109	K102-D106 PolarHBondContact O-N 3.44Å; Q103-D106 PolarHBondContact O-N 3.46Å; V104-D106 VanDerWaalsContact C-N 3.28Å; V104-D106 PolarHBondContact O-N 2.84Å; D106-L108 VanDerWaalsContact C-N 3.28Å; D106-L108 PolarHBondContact O-N 3.31Å; D106-K109 WeakPolarHBondContact O-CB 3.35Å; D106-K109 WeakPolarHBondContact O-CG 3.14Å; D106-K109 PolarHBondContact O-N 3.16Å; D106-K109 WeakPolarHBondContact OD1-CD 3.18Å; D106-K109 VanDerWaalsContact OD1-CE 3.24Å; D106-K109 WeakPolarHBondContact OD1-CE 3.41Å; D106-K109 IonicContact OD1-NZ 3.58Å; D106-K109 PolarHBondContact OD1-NZ 2.7Å
107	L	95.2	Very high	85.4	Confident	24 Å²	24	63 Å²	63	13%	0.126	32%	0.319	C	S	.	.	H	α-helix	trans	-62.2	-34.6	175.3	-71.1	169.5	0	0	0	112.3	Q103 V104 K109 K294 F324 D327 S331	Q103-L107 HydrophobicContact CG-CD1 4.39Å; Q103-L107 WeakPolarHBondContact O-CG 3.27Å; Q103-L107 PolarHBondContact O-N 3.33Å; V104-L107 PolarHBondContact O-N 3.47Å; L107-K109 VanDerWaalsContact C-N 3.28Å; L107-K109 PolarHBondContact O-N 2.88Å; L107-K294 WeakPolarHBondContact O-CE 3.42Å; L107-K294 PolarHBondContact O-NZ 2.98Å; L107-F324 HydrophobicContact CB-CE2 4.28Å; L107-F324 HydrophobicContact CD2-CD2 4.31Å; L107-F324 WeakPolarHBondContact O-CE2 3.28Å; L107-D327 HydrophobicContact CD1-CB 4.12Å; L107-D327 WeakPolarHBondContact CD1-O 3.38Å; L107-D327 HydrophobicContact CD2-CB 3.74Å; L107-S331 WeakPolarHBondContact CD1-OG 3.41Å
108	L	95.6	Very high	87.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	2.4	179.1	-63.5	-179.5	0	0	0	114.4	V104 I105 D106 V110 L297 Y301 L328	V104-L108 HydrophobicContact CG1-CD1 3.85Å; V104-L108 HydrophobicContact CG1-CG 4.24Å; V104-L108 VanDerWaalsContact O-CG 3.27Å; V104-L108 WeakPolarHBondContact O-CG 3.34Å; V104-L108 PolarHBondContact O-N 3.35Å; I105-L108 PolarHBondContact O-N 3.21Å; D106-L108 VanDerWaalsContact C-N 3.28Å; D106-L108 PolarHBondContact O-N 3.31Å; L108-V110 PolarHBondContact O-N 3.12Å; L108-L297 HydrophobicContact CD1-CG 4.21Å; L108-L297 HydrophobicContact CD2-CB 4.23Å; L108-L297 HydrophobicContact CD2-CD2 3.68Å; L108-L297 HydrophobicContact CD2-CG 4.05Å; L108-Y301 HydrophobicContact CD1-CG 4.37Å; L108-L328 HydrophobicContact CD2-CD1 4.44Å
109	K	95.9	Very high	88.8	Confident	100 Å²	100	61.3 Å²	61.3	44%	0.435	31%	0.31	S	S	.	.			trans	-60.6	133.4	169.8	-72.2	175.7	-179.2	166.7	0	110.6	I105 D106 L107 K294	I105-K109 PolarHBondContact O-N 3.3Å; D106-K109 WeakPolarHBondContact O-CB 3.35Å; D106-K109 WeakPolarHBondContact O-CG 3.14Å; D106-K109 PolarHBondContact O-N 3.16Å; D106-K109 WeakPolarHBondContact OD1-CD 3.18Å; D106-K109 VanDerWaalsContact OD1-CE 3.24Å; D106-K109 WeakPolarHBondContact OD1-CE 3.41Å; D106-K109 IonicContact OD1-NZ 3.58Å; D106-K109 PolarHBondContact OD1-NZ 2.7Å; L107-K109 VanDerWaalsContact C-N 3.28Å; L107-K109 PolarHBondContact O-N 2.88Å; K109-K294 PolarHBondContact O-NZ 2.98Å
110	V	96.3	Very high	90.3	Very high	13 Å²	13	56.1 Å²	56.1	8%	0.079	28%	0.282	C	S	.	.			trans	-95.7	126.8	-175.8	-177.9	0	0	0	0	109.3	L108 I112 L115 F253 E291 K294 L295	L108-V110 PolarHBondContact O-N 3.12Å; V110-I112 PolarHBondContact O-N 3.41Å; V110-L115 HydrophobicContact CG1-CD1 3.82Å; V110-L115 HydrophobicContact CG1-CD2 3.8Å; V110-L115 HydrophobicContact CG1-CG 3.84Å; V110-F253 HydrophobicContact CB-CB 4.21Å; V110-F253 HydrophobicContact CB-CD1 4.2Å; V110-F253 HydrophobicContact CG1-CD1 4.13Å; V110-F253 PolarHBondContact N-O 3.24Å; V110-E291 HydrophobicContact CG1-CB 4.09Å; V110-K294 HydrophobicContact CG2-CB 4.15Å; V110-L295 HydrophobicContact CG2-CB 3.91Å; V110-L295 HydrophobicContact CG2-CD1 4.41Å
111	N	94.8	Very high	91.6	Very high	65 Å²	65	53.1 Å²	53.1	35%	0.348	27%	0.269	S	S	.	.			trans	-81.1	98.1	171	-173.5	-18.6	0	0	0	109.7	K113 M114 L115 E291	N111-K113 PolarHBondContact O-N 3.13Å; N111-K113 VanDerWaalsContact O-N 3.11Å; N111-K113 PolarHBondContact OD1-N 3.45Å; N111-M114 HydrophobicContact CB-CB 4.18Å; N111-M114 HydrophobicContact CB-CG 4.12Å; N111-M114 WeakPolarHBondContact O-CA 3.26Å; N111-M114 WeakPolarHBondContact O-CB 3.14Å; N111-M114 PolarHBondContact O-N 2.68Å; N111-L115 PolarHBondContact O-N 2.78Å; N111-E291 PolarHBondContact N-OE2 2.97Å
112	I	92.6	Very high	92.3	Very high	73 Å²	73	53.8 Å²	53.8	37%	0.374	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-54.9	-34.6	-175.7	-59.4	166.3	0	0	0	112.3	V110 M114 L115 M148 F253	V110-I112 PolarHBondContact O-N 3.41Å; I112-M114 PolarHBondContact O-N 3.18Å; I112-L115 WeakPolarHBondContact O-CB 3.31Å; I112-L115 PolarHBondContact O-N 2.74Å; I112-M148 HydrophobicContact CD1-CE 3.71Å; I112-F253 HydrophobicContact CD1-CB 4.08Å; I112-F253 HydrophobicContact CD1-CD2 4.16Å; I112-F253 HydrophobicContact CD1-CG 4.02Å; I112-F253 HydrophobicContact CG1-CB 4.04Å; I112-F253 HydrophobicContact CG1-CD1 4.02Å; I112-F253 HydrophobicContact CG1-CD2 4.45Å; I112-F253 HydrophobicContact CG1-CG 3.91Å
113	K	92.1	Very high	92.6	Very high	184 Å²	184	53.9 Å²	53.9	80%	0.8	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-64.3	-28.8	178.4	-62	-177.3	-179.5	179.4	0	112.4	N111	N111-K113 PolarHBondContact O-N 3.13Å; N111-K113 VanDerWaalsContact O-N 3.11Å; N111-K113 PolarHBondContact OD1-N 3.45Å
114	M	94	Very high	92.7	Very high	53 Å²	53	53.8 Å²	53.8	26%	0.261	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-91.1	-2.1	-178.4	-62.7	-64.7	177.4	0	0	112.7	N111 I112 N116 R287 S288 E291	N111-M114 HydrophobicContact CB-CB 4.18Å; N111-M114 HydrophobicContact CB-CG 4.12Å; N111-M114 WeakPolarHBondContact O-CA 3.26Å; N111-M114 WeakPolarHBondContact O-CB 3.14Å; N111-M114 PolarHBondContact O-N 2.68Å; I112-M114 PolarHBondContact O-N 3.18Å; M114-N116 VanDerWaalsContact C-N 3.27Å; M114-R287 HydrophobicContact CB-CG 4.11Å; M114-R287 HydrophobicContact CG-CG 4.29Å; M114-R287 HydrophobicContact SD-CG 4.11Å; M114-S288 VanDerWaalsContact O-CA 3.24Å; M114-S288 WeakPolarHBondContact O-CA 3.17Å; M114-S288 PolarHBondContact O-OG 3.02Å; M114-S288 VanDerWaalsContact O-OG 3.1Å; M114-E291 HydrophobicContact CB-CG 3.71Å
115	L	94	Very high	92.7	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.021	30%	0.296	C	S	.	.	S	Bend	trans	-73.6	-19.6	170.1	-71	172.8	0	0	0	112.7	V110 N111 I112 H117 F253 E291 Y292	V110-L115 HydrophobicContact CG1-CD1 3.82Å; V110-L115 HydrophobicContact CG1-CD2 3.8Å; V110-L115 HydrophobicContact CG1-CG 3.84Å; N111-L115 PolarHBondContact O-N 2.78Å; I112-L115 WeakPolarHBondContact O-CB 3.31Å; I112-L115 PolarHBondContact O-N 2.74Å; L115-H117 PolarHBondContact O-N 2.97Å; L115-F253 HydrophobicContact CD1-CD1 3.98Å; L115-F253 HydrophobicContact CD1-CE1 3.64Å; L115-E291 HydrophobicContact CD2-CB 3.65Å; L115-E291 HydrophobicContact CG-CB 4.31Å; L115-Y292 HydrophobicContact CB-CE2 4.28Å; L115-Y292 HydrophobicContact CD2-CD1 4.11Å; L115-Y292 HydrophobicContact CD2-CD2 3.75Å; L115-Y292 HydrophobicContact CD2-CE1 4.08Å; L115-Y292 HydrophobicContact CD2-CE2 3.7Å; L115-Y292 HydrophobicContact CD2-CG 3.96Å
116	N	91.8	Very high	92.4	Very high	78 Å²	78	58.7 Å²	58.7	42%	0.417	30%	0.3	S	S	.	.			trans	-78.1	92.6	-179.3	-177.5	5.2	0	0	0	111.4	M114 V118 G119 E120	M114-N116 VanDerWaalsContact C-N 3.27Å; N116-V118 VanDerWaalsContact C-N 3.27Å; N116-V118 PolarHBondContact O-N 3Å; N116-V118 WeakPolarHBondContact OD1-CB 3.29Å; N116-V118 PolarHBondContact OD1-N 3.06Å; N116-V118 VanDerWaalsContact OD1-N 3.14Å; N116-G119 WeakPolarHBondContact O-CA 3.38Å; N116-G119 PolarHBondContact O-N 3.03Å; N116-G119 VanDerWaalsContact O-N 3.07Å; N116-G119 PolarHBondContact OD1-N 3.48Å; N116-G119 VanDerWaalsContact OD1-N 3.12Å; N116-E120 PolarHBondContact O-N 3.48Å
117	H	91.4	Very high	91.8	Very high	8 Å²	8	57.9 Å²	57.9	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-33	178	78.7	-91.3	0	0	0	113.1	L115 G119 E120 L121 E236 Y276 I280 R283 C285 S288	L115-H117 PolarHBondContact O-N 2.97Å; H117-G119 VanDerWaalsContact C-N 3.32Å; H117-G119 PolarHBondContact O-N 3.26Å; H117-E120 WeakPolarHBondContact O-CB 3.4Å; H117-E120 PolarHBondContact O-N 2.86Å; H117-L121 WeakPolarHBondContact O-CG 3.25Å; H117-L121 PolarHBondContact O-N 2.89Å; H117-E236 IonicContact CE1-OE1 3.78Å; H117-Y276 PolarHBondContact CE1-OH 3.35Å; H117-Y276 PolarHBondContact ND1-OH 2.98Å; H117-Y276 VanDerWaalsContact ND1-OH 3.13Å; H117-I280 HydrophobicContact CB-CB 4.4Å; H117-I280 HydrophobicContact CB-CG2 4.24Å; H117-R283 PolarHBondContact NE2-NH1 3.41Å; H117-C285 HydrophobicContact CB-CB 3.92Å; H117-S288 VanDerWaalsContact CA-OG 3.28Å; H117-S288 WeakPolarHBondContact CA-OG 3.38Å; H117-S288 PolarHBondContact N-OG 3.18Å
118	V	89.8	Confident	91	Very high	35 Å²	35	65.3 Å²	65.3	21%	0.212	34%	0.336	C	S	.	.	H	α-helix	trans	-66.2	-38.2	175.4	-177.6	0	0	0	0	110.7	N116 L121 S122	N116-V118 VanDerWaalsContact C-N 3.27Å; N116-V118 PolarHBondContact O-N 3Å; N116-V118 WeakPolarHBondContact OD1-CB 3.29Å; N116-V118 PolarHBondContact OD1-N 3.06Å; N116-V118 VanDerWaalsContact OD1-N 3.14Å; V118-L121 PolarHBondContact O-N 2.91Å; V118-S122 WeakPolarHBondContact O-CB 3.27Å; V118-S122 PolarHBondContact O-N 3.3Å; V118-S122 PolarHBondContact O-OG 3.22Å
119	G	90.5	Very high	90	Very high	31 Å²	31	70.6 Å²	70.6	32%	0.32	37%	0.368	S	S	.	.	H	α-helix	trans	-65	-38.6	172.4	0	0	0	0	0	112.5	N116 H117 S122 R123	N116-G119 WeakPolarHBondContact O-CA 3.38Å; N116-G119 PolarHBondContact O-N 3.03Å; N116-G119 VanDerWaalsContact O-N 3.07Å; N116-G119 PolarHBondContact OD1-N 3.48Å; N116-G119 VanDerWaalsContact OD1-N 3.12Å; H117-G119 VanDerWaalsContact C-N 3.32Å; H117-G119 PolarHBondContact O-N 3.26Å; G119-S122 PolarHBondContact O-N 3.07Å; G119-R123 PolarHBondContact O-N 3.44Å
120	E	93.8	Very high	88.6	Confident	14 Å²	14	68.5 Å²	68.5	7%	0.065	36%	0.361	C	S	.	.	H	α-helix	trans	-64.4	-46.4	173.4	178.5	170.6	-166.2	0	0	112.1	N116 H117 S122 R123 L124 C285 Y286 R287 S288	N116-E120 PolarHBondContact O-N 3.48Å; H117-E120 WeakPolarHBondContact O-CB 3.4Å; H117-E120 PolarHBondContact O-N 2.86Å; E120-S122 VanDerWaalsContact C-N 3.28Å; E120-S122 PolarHBondContact O-N 3.37Å; E120-R123 WeakPolarHBondContact O-CB 3.16Å; E120-R123 PolarHBondContact O-N 3.24Å; E120-R123 VanDerWaalsContact O-N 3.15Å; E120-L124 HydrophobicContact CG-CD1 4.1Å; E120-L124 WeakPolarHBondContact O-CG 3.03Å; E120-L124 PolarHBondContact O-N 3.38Å; E120-C285 VanDerWaalsContact CD-CA 3.49Å; E120-C285 HydrophobicContact CG-CB 4.48Å; E120-C285 VanDerWaalsContact OE2-C 3.29Å; E120-C285 WeakPolarHBondContact OE2-CA 3.38Å; E120-C285 WeakPolarHBondContact OE2-CB 3.46Å; E120-Y286 PolarHBondContact OE1-N 3.23Å; E120-R287 WeakPolarHBondContact OE1-CB 3.31Å; E120-R287 PolarHBondContact OE1-N 2.89Å; E120-R287 PolarHBondContact OE2-N 2.91Å; E120-S288 VanDerWaalsContact OE2-CB 3.32Å; E120-S288 WeakPolarHBondContact OE2-CB 3.46Å; E120-S288 PolarHBondContact OE2-N 3.17Å; E120-S288 PolarHBondContact OE2-OG 3.1Å
121	L	91.4	Very high	86.7	Confident	26 Å²	26	69.7 Å²	69.7	14%	0.136	38%	0.376	C	S	.	.	H	α-helix	trans	-56	-47.3	173	-70.1	172.4	0	0	0	110.2	H117 V118 R123 L124 F125 I130 C285	H117-L121 WeakPolarHBondContact O-CG 3.25Å; H117-L121 PolarHBondContact O-N 2.89Å; V118-L121 PolarHBondContact O-N 2.91Å; L121-R123 PolarHBondContact O-N 3.2Å; L121-L124 PolarHBondContact O-N 3.04Å; L121-F125 HydrophobicContact CD2-CD2 4.11Å; L121-F125 HydrophobicContact CD2-CE2 3.83Å; L121-F125 PolarHBondContact O-N 2.89Å; L121-I130 HydrophobicContact CB-CD1 3.47Å; L121-I130 VanDerWaalsContact CB-CD1 3.47Å; L121-I130 HydrophobicContact CB-CG1 4.11Å; L121-I130 VanDerWaalsContact O-CD1 3.24Å; L121-I130 WeakPolarHBondContact O-CD1 3.32Å; L121-C285 WeakPolarHBondContact CD2-SG 3.4Å; L121-C285 WeakPolarHBondContact CG-SG 3.37Å
122	S	91.9	Very high	84.3	Confident	39 Å²	39	69.1 Å²	69.1	27%	0.273	39%	0.386	S	S	.	.	H	α-helix	trans	-59.6	-33.1	-178.9	-60.5	0	0	0	0	112.1	V118 G119 E120 G126	V118-S122 WeakPolarHBondContact O-CB 3.27Å; V118-S122 PolarHBondContact O-N 3.3Å; V118-S122 PolarHBondContact O-OG 3.22Å; G119-S122 PolarHBondContact O-N 3.07Å; E120-S122 VanDerWaalsContact C-N 3.28Å; E120-S122 PolarHBondContact O-N 3.37Å; S122-G126 CarbonylContact O-C 3.53Å; S122-G126 WeakPolarHBondContact O-CA 3.18Å; S122-G126 PolarHBondContact O-N 3.29Å
123	R	91	Very high	82.2	Confident	143 Å²	143	69.5 Å²	69.5	54%	0.54	39%	0.394	S	S	.	.	H	α-helix	trans	-73.7	-33.5	173.7	-176.3	179.6	65.4	-152.8	-2.9	113	G119 E120 L121	G119-R123 PolarHBondContact O-N 3.44Å; E120-R123 WeakPolarHBondContact O-CB 3.16Å; E120-R123 PolarHBondContact O-N 3.24Å; E120-R123 VanDerWaalsContact O-N 3.15Å; L121-R123 PolarHBondContact O-N 3.2Å
124	L	89.9	Confident	80.1	Confident	96 Å²	96	67.2 Å²	67.2	50%	0.503	39%	0.386	S	S	.	.	H	α-helix	trans	-80	-43.1	-177.4	-71	172.2	0	0	0	113	E120 L121	E120-L124 HydrophobicContact CG-CD1 4.1Å; E120-L124 WeakPolarHBondContact O-CG 3.03Å; E120-L124 PolarHBondContact O-N 3.38Å; L121-L124 PolarHBondContact O-N 3.04Å
125	F	89.2	Confident	77.6	Confident	122 Å²	122	70.2 Å²	70.2	54%	0.535	41%	0.408	S	S	.	.	H	α-helix	trans	-111.5	-10.4	-172.5	-59.6	-76.5	0	0	0	113.9	L121 V129 I130	L121-F125 HydrophobicContact CD2-CD2 4.11Å; L121-F125 HydrophobicContact CD2-CE2 3.83Å; L121-F125 PolarHBondContact O-N 2.89Å; F125-V129 HydrophobicContact CB-CB 4.27Å; F125-V129 HydrophobicContact CB-CG1 4.29Å; F125-V129 WeakPolarHBondContact O-CG2 3.48Å; F125-I130 HydrophobicContact CB-CD1 4.32Å
126	G	84.4	Confident	75	Confident	32 Å²	32	74.6 Å²	74.6	33%	0.33	44%	0.438	S	S	.	.			trans	86.9	147.5	-170.3	0	0	0	0	0	112.2	S122 E128 V129	S122-G126 CarbonylContact O-C 3.53Å; S122-G126 WeakPolarHBondContact O-CA 3.18Å; S122-G126 PolarHBondContact O-N 3.29Å; G126-E128 PolarHBondContact O-N 3.33Å; G126-V129 PolarHBondContact O-N 2.86Å
127	S	82.7	Confident	72.6	Confident	76 Å²	76	77.3 Å²	77.3	53%	0.531	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.8	-175.7	51	0	0	0	0	114.4	G131 G132	S127-G131 CarbonylContact O-C 3.55Å; S127-G132 PolarHBondContact O-N 2.94Å
128	E	77.3	Confident	70	Confident	179 Å²	179	89.1 Å²	89.1	84%	0.836	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-39.9	-179.8	-64.7	179.4	175.6	0	0	112	G126 I130 G131	G126-E128 PolarHBondContact O-N 3.33Å; E128-I130 PolarHBondContact O-N 3.38Å; E128-G131 PolarHBondContact O-N 3.32Å; E128-G131 VanDerWaalsContact O-N 3.15Å
129	V	74.7	Confident	67.6	Low	112 Å²	112	97.5 Å²	97.5	68%	0.679	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-32.3	-174.2	177.1	0	0	0	0	112.3	F125 G126 G131	F125-V129 HydrophobicContact CB-CB 4.27Å; F125-V129 HydrophobicContact CB-CG1 4.29Å; F125-V129 WeakPolarHBondContact O-CG2 3.48Å; G126-V129 PolarHBondContact O-N 2.86Å; V129-G131 PolarHBondContact O-N 3.19Å
130	I	66.1	Low	65.3	Low	56 Å²	56	105.5 Å²	105.5	29%	0.287	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-5.4	178.9	-67.4	145.4	0	0	0	111.2	L121 F125 E128	L121-I130 HydrophobicContact CB-CD1 3.47Å; L121-I130 VanDerWaalsContact CB-CD1 3.47Å; L121-I130 HydrophobicContact CB-CG1 4.11Å; L121-I130 VanDerWaalsContact O-CD1 3.24Å; L121-I130 WeakPolarHBondContact O-CD1 3.32Å; F125-I130 HydrophobicContact CB-CD1 4.32Å; E128-I130 PolarHBondContact O-N 3.38Å
131	G	57.2	Low	62.8	Low	38 Å²	38	117 Å²	117	39%	0.392	59%	0.592	S	S	.	*			trans	65.8	141	-151.2	0	0	0	0	0	108	S127 E128 V129 S133	S127-G131 CarbonylContact O-C 3.55Å; E128-G131 PolarHBondContact O-N 3.32Å; E128-G131 VanDerWaalsContact O-N 3.15Å; V129-G131 PolarHBondContact O-N 3.19Å; G131-S133 PolarHBondContact O-N 3.14Å
132	G	45.1	Very low	60.5	Low	53 Å²	53	120.2 Å²	120.2	55%	0.546	62%	0.617	S	S	.	*			trans	-59.6	87.6	160	0	0	0	0	0	107.4	S127 E134	S127-G132 PolarHBondContact O-N 2.94Å; G132-E134 VanDerWaalsContact C-N 3.29Å; G132-E134 PolarHBondContact O-N 3.48Å
133	S	47.9	Very low	58.2	Low	80 Å²	80	129.6 Å²	129.6	56%	0.559	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	101.2	176.6	174.2	0	0	0	0	105.2	G131 T135	G131-S133 PolarHBondContact O-N 3.14Å; S133-T135 VanDerWaalsContact C-N 3.28Å; S133-T135 PolarHBondContact O-N 3.5Å
134	E	47.6	Very low	56.1	Low	136 Å²	136	126 Å²	126	64%	0.636	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	38.1	58.6	173.2	-54.9	-172.8	172.8	0	0	112	G132 C136	G132-E134 VanDerWaalsContact C-N 3.29Å; G132-E134 PolarHBondContact O-N 3.48Å; E134-C136 PolarHBondContact O-N 3.26Å
135	T	41.7	Very low	54.3	Low	117 Å²	117	130.2 Å²	130.2	72%	0.718	66%	0.655	S	S	*	*			trans	-51.1	102.1	144.6	33.9	0	0	0	0	103.2	S133 L137	S133-T135 VanDerWaalsContact C-N 3.28Å; S133-T135 PolarHBondContact O-N 3.5Å; T135-L137 VanDerWaalsContact C-N 3.31Å; T135-L137 PolarHBondContact O-N 2.97Å
136	C	40.4	Very low	52.8	Low	96 Å²	96	132.2 Å²	132.2	65%	0.649	67%	0.666	S	S	*	*			trans	-35.5	110.8	168.8	-85.9	0	0	0	0	104	E134 R138	E134-C136 PolarHBondContact O-N 3.26Å; C136-R138 PolarHBondContact O-N 2.81Å; C136-R138 VanDerWaalsContact O-N 3.11Å
137	L	40.4	Very low	52.3	Low	134 Å²	134	131.3 Å²	131.3	70%	0.702	66%	0.656	S	S	*	*			trans	-37.1	130.5	161.1	-69.4	163.4	0	0	0	104.2	T135 R139	T135-L137 VanDerWaalsContact C-N 3.31Å; T135-L137 PolarHBondContact O-N 2.97Å; L137-R139 HydrophobicContact CB-CG 4.26Å; L137-R139 PolarHBondContact O-N 3.11Å
138	R	36.9	Very low	52.5	Low	256 Å²	256	131.7 Å²	131.7	97%	0.966	65%	0.651	S	S	*	*	S	Bend	trans	-58.6	30	178.7	-82.3	170.6	71.4	168.7	1.7	113.1	C136 K140	C136-R138 PolarHBondContact O-N 2.81Å; C136-R138 VanDerWaalsContact O-N 3.11Å; R138-K140 VanDerWaalsContact C-N 3.3Å; R138-K140 PolarHBondContact O-N 2.81Å
139	R	39.9	Very low	53.1	Low	212 Å²	212	123.5 Å²	123.5	80%	0.8	61%	0.612	S	S	*	*			trans	-62.5	91.5	158.9	-68.6	-173.6	115.6	104.1	-2.7	108.4	L137 R141	L137-R139 HydrophobicContact CB-CG 4.26Å; L137-R139 PolarHBondContact O-N 3.11Å; R139-R141 PolarHBondContact O-N 3.35Å
140	K	41.3	Very low	53.9	Low	199 Å²	199	118.1 Å²	118.1	87%	0.865	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	24.3	95.7	147.4	-68	178.6	176.5	177.7	0	115	R138 S142	R138-K140 VanDerWaalsContact C-N 3.3Å; R138-K140 PolarHBondContact O-N 2.81Å; K140-S142 VanDerWaalsContact C-N 3.28Å; K140-S142 PolarHBondContact O-N 3.45Å
141	R	41.8	Very low	55	Low	254 Å²	254	117.9 Å²	117.9	96%	0.958	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.4	29	145.4	-69.2	-176.4	173.7	164.1	-1.3	118.5	R139 R143	R139-R141 PolarHBondContact O-N 3.35Å; R141-R143 PolarHBondContact O-N 3.23Å; R141-R143 VanDerWaalsContact O-N 3.08Å
142	S	43.7	Very low	56.5	Low	94 Å²	94	117.8 Å²	117.8	66%	0.657	57%	0.574	S	S	*	*			trans	-73.7	103.3	158.3	-171.9	0	0	0	0	107.2	K140 V144	K140-S142 VanDerWaalsContact C-N 3.28Å; K140-S142 PolarHBondContact O-N 3.45Å; S142-V144 PolarHBondContact O-N 3.01Å
143	R	43.9	Very low	58.6	Low	236 Å²	236	118.2 Å²	118.2	89%	0.891	56%	0.561	S	S	*	*			trans	-67.2	74.7	168.3	-69.2	179.2	-170.9	159.7	2	107.2	R141 K145	R141-R143 PolarHBondContact O-N 3.23Å; R141-R143 VanDerWaalsContact O-N 3.08Å; R143-K145 VanDerWaalsContact C-N 3.35Å; R143-K145 PolarHBondContact O-N 3.26Å
144	V	45.4	Very low	60.4	Low	69 Å²	69	116.9 Å²	116.9	42%	0.418	55%	0.552	S	S	.	*			trans	-58.1	108.5	164.6	-178.7	0	0	0	0	104.6	S142 H146	S142-V144 PolarHBondContact O-N 3.01Å; V144-H146 PolarHBondContact O-N 3.05Å
145	K	52.5	Low	62.3	Low	183 Å²	183	111.9 Å²	111.9	80%	0.796	53%	0.53	S	S	*	.			trans	-58.9	107.7	-178.6	-69.4	178.4	-179.9	175.8	0	106.2	R143 G147 V152	R143-K145 VanDerWaalsContact C-N 3.35Å; R143-K145 PolarHBondContact O-N 3.26Å; K145-G147 PolarHBondContact O-N 2.85Å; K145-V152 WeakPolarHBondContact O-CG2 3.45Å
146	H	59	Low	64.8	Low	165 Å²	165	106.7 Å²	106.7	76%	0.764	50%	0.497	S	S	*	.			trans	-57.8	115	170.7	-85.2	-66.3	0	0	0	107.5	V144	V144-H146 PolarHBondContact O-N 3.05Å
147	G	73.8	Confident	67.2	Low	13 Å²	13	103 Å²	103	13%	0.134	47%	0.473	C	S	.	.			trans	-62.6	138.3	169.8	0	0	0	0	0	108.7	K145 V150	K145-G147 PolarHBondContact O-N 2.85Å; G147-V150 CarbonylContact C-O 3.42Å; G147-V150 WeakPolarHBondContact CA-O 3.39Å
148	M	85.1	Confident	69.5	Low	84 Å²	84	101.1 Å²	101.1	41%	0.414	47%	0.468	S	S	.	.	S	Bend	trans	-75.3	-31.6	-177.6	-62.9	178.5	73.9	0	0	111.7	I112 Q243 F253	I112-M148 HydrophobicContact CD1-CE 3.71Å; M148-Q243 VanDerWaalsContact N-CD 3.31Å; M148-F253 HydrophobicContact CB-CE2 3.83Å; M148-F253 HydrophobicContact CB-CZ 3.6Å; M148-F253 HydrophobicContact CE-CD2 3.54Å; M148-F253 HydrophobicContact CE-CE2 3.33Å; M148-F253 HydrophobicContact CE-CZ 4.21Å; M148-F253 HydrophobicContact CG-CE2 4.46Å; M148-F253 HydrophobicContact SD-CE2 3.84Å
149	L	90.5	Very high	72	Confident	6 Å²	6	91.6 Å²	91.6	3%	0.031	44%	0.439	C	S	.	.	S	Bend	trans	-79.7	-67.9	171.4	-66	-178.8	0	0	0	108.8	Q243 F246 F253 Y292 L295	L149-Q243 HydrophobicContact CD1-CB 4.15Å; L149-Q243 HydrophobicContact CD1-CG 4.39Å; L149-Q243 HydrophobicContact CG-CG 4.29Å; L149-Q243 VanDerWaalsContact N-OE1 3.09Å; L149-F246 HydrophobicContact CD1-CE2 4.17Å; L149-F246 HydrophobicContact CD1-CZ 3.88Å; L149-F253 HydrophobicContact CD2-CE1 3.74Å; L149-F253 HydrophobicContact CD2-CZ 3.83Å; L149-F253 HydrophobicContact CG-CZ 4.35Å; L149-Y292 PolarHBondContact O-OH 3.21Å; L149-L295 HydrophobicContact CD2-CD2 3.39Å
150	V	92.3	Very high	74.1	Confident	0 Å²	0	86.4 Å²	86.4	0%	0	43%	0.43	C	S	.	.	S	Bend	trans	-121.6	147.5	-175.7	-64.4	0	0	0	0	110.7	G147 V152 W156 E236 L239 H240 Y276	G147-V150 CarbonylContact C-O 3.42Å; G147-V150 WeakPolarHBondContact CA-O 3.39Å; V150-V152 PolarHBondContact O-N 3.43Å; V150-W156 HydrophobicContact CG2-CH2 4.36Å; V150-E236 HydrophobicContact CG1-CB 4.41Å; V150-E236 HydrophobicContact CG1-CG 4.21Å; V150-E236 WeakPolarHBondContact CG2-O 3.44Å; V150-L239 HydrophobicContact CG1-CB 4.09Å; V150-L239 HydrophobicContact CG1-CD1 3.79Å; V150-L239 HydrophobicContact CG2-CB 4.21Å; V150-H240 HydrophobicContact CG2-CB 4.1Å; V150-Y276 HydrophobicContact CG1-CE1 4.14Å
151	P	87.9	Confident	76.3	Confident	50 Å²	50	88.6 Å²	88.6	33%	0.325	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-60.7	133.3	170.7	27	-33.3	0	0	0	109.8	K153	P151-K153 PolarHBondContact O-N 3.19Å
152	V	89.2	Confident	78.8	Confident	37 Å²	37	78 Å²	78	22%	0.224	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-77.1	123.9	177.1	-175.4	0	0	0	0	108.2	K145 V150 W156 H240	K145-V152 WeakPolarHBondContact O-CG2 3.45Å; V150-V152 PolarHBondContact O-N 3.43Å; V152-W156 HydrophobicContact CG1-CE3 4.16Å; V152-H240 VanDerWaalsContact CG2-CE1 3.46Å; V152-H240 WeakPolarHBondContact CG2-CE1 3.32Å
153	K	89.2	Confident	81.2	Confident	61 Å²	61	74.3 Å²	74.3	27%	0.265	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-82.8	145	178.6	-62.3	-177.5	-170.5	167	0	110.8	P151 T155 W156 D233 E236	P151-K153 PolarHBondContact O-N 3.19Å; K153-T155 PolarHBondContact O-N 2.97Å; K153-W156 HydrophobicContact CB-CD2 3.9Å; K153-W156 HydrophobicContact CB-CE3 4.36Å; K153-W156 HydrophobicContact CB-CG 4.17Å; K153-W156 HydrophobicContact CB-CZ2 4.21Å; K153-W156 HydrophobicContact CD-CH2 4.45Å; K153-W156 HydrophobicContact CD-CZ2 3.67Å; K153-W156 HydrophobicContact CG-CD2 4.42Å; K153-W156 HydrophobicContact CG-CH2 4.2Å; K153-W156 HydrophobicContact CG-CZ2 3.83Å; K153-W156 PolarHBondContact O-N 3.33Å; K153-D233 WeakPolarHBondContact CD-OD1 3.36Å; K153-D233 WeakPolarHBondContact CE-OD1 3.44Å; K153-D233 IonicContact NZ-OD1 3.61Å; K153-D233 PolarHBondContact NZ-OD1 2.88Å; K153-E236 WeakPolarHBondContact CE-OE2 3.46Å; K153-E236 IonicContact NZ-OE2 3.55Å; K153-E236 PolarHBondContact NZ-OE2 2.84Å
154	S	85.9	Confident	83.7	Confident	53 Å²	53	63.8 Å²	63.8	37%	0.371	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-16	177.1	58.4	0	0	0	0	113.5	I606	S154-I606 WeakPolarHBondContact O-CD1 3.23Å; S154-I606 WeakPolarHBondContact O-CG1 3.31Å
155	T	88.3	Confident	86.2	Confident	30 Å²	30	63 Å²	63	18%	0.184	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-13.4	180	58.1	0	0	0	0	114	K153 D605	K153-T155 PolarHBondContact O-N 2.97Å; T155-D605 WeakPolarHBondContact CA-OD1 3.42Å; T155-D605 WeakPolarHBondContact CG2-OD2 3.47Å; T155-D605 WeakPolarHBondContact O-CA 3.48Å
156	W	93.1	Very high	88.3	Confident	8 Å²	8	54.8 Å²	54.8	3%	0.03	30%	0.295	C	S	.	.	S	Bend	trans	-84.2	143.1	-174.2	-63.9	-14.3	0	0	0	111.3	V150 V152 K153 D233 E236 R237 H240	V150-W156 HydrophobicContact CG2-CH2 4.36Å; V152-W156 HydrophobicContact CG1-CE3 4.16Å; K153-W156 HydrophobicContact CB-CD2 3.9Å; K153-W156 HydrophobicContact CB-CE3 4.36Å; K153-W156 HydrophobicContact CB-CG 4.17Å; K153-W156 HydrophobicContact CB-CZ2 4.21Å; K153-W156 HydrophobicContact CD-CH2 4.45Å; K153-W156 HydrophobicContact CD-CZ2 3.67Å; K153-W156 HydrophobicContact CG-CD2 4.42Å; K153-W156 HydrophobicContact CG-CH2 4.2Å; K153-W156 HydrophobicContact CG-CZ2 3.83Å; K153-W156 PolarHBondContact O-N 3.33Å; W156-D233 PolarHBondContact NE1-OD1 3.5Å; W156-D233 PolarHBondContact NE1-OD2 2.96Å; W156-E236 HydrophobicContact CH2-CB 3.79Å; W156-E236 HydrophobicContact CZ2-CB 3.88Å; W156-R237 HydrophobicContact CD2-CG 4.31Å; W156-R237 HydrophobicContact CZ2-CB 4.16Å; W156-H240 HydrophobicContact CE3-CB 4.11Å; W156-H240 AromaticContact CE3-CD2 3.72Å; W156-H240 AromaticContact CE3-CG 3.93Å; W156-H240 HydrophobicContact CH2-CB 4.25Å; W156-H240 HydrophobicContact CZ3-CB 3.53Å; W156-H240 AromaticContact CZ3-CD2 3.99Å; W156-H240 AromaticContact CZ3-CG 3.7Å
157	P	91.1	Very high	90.1	Very high	20 Å²	20	51.8 Å²	51.8	13%	0.13	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-57.8	154.7	173.3	-24.9	34.4	0	0	0	112.2	P209 Y210 I604	P157-P209 HydrophobicContact CG-CB 3.91Å; P157-P209 HydrophobicContact CG-CG 4.03Å; P157-Y210 HydrophobicContact CB-CE2 4.18Å; P157-Y210 WeakPolarHBondContact O-CE2 3.19Å; P157-Y210 PolarHBondContact O-OH 2.97Å; P157-I604 HydrophobicContact CG-CG2 3.16Å
158	P	89.6	Confident	91.2	Very high	94 Å²	94	54.5 Å²	54.5	61%	0.61	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-63.2	142	173	29.2	-36	0	0	0	111.2	V160	P158-V160 VanDerWaalsContact C-N 3.27Å; P158-V160 HydrophobicContact CB-CG2 4.13Å; P158-V160 HydrophobicContact CG-CG2 4.44Å; P158-V160 PolarHBondContact O-N 3.5Å
159	T	88.7	Confident	91.6	Very high	56 Å²	56	54.3 Å²	54.3	34%	0.344	30%	0.297	S	S	.	.			trans	-78.1	73.3	176.1	40.6	0	0	0	0	110.8	Y210 H240	T159-Y210 HydrophobicContact CG2-CD2 4.23Å; T159-Y210 HydrophobicContact CG2-CE1 4Å; T159-Y210 HydrophobicContact CG2-CE2 3.71Å; T159-H240 WeakPolarHBondContact CG2-NE2 3.07Å
160	V	85	Confident	91.6	Very high	103 Å²	103	56 Å²	56	62%	0.624	32%	0.316	S	S	*	.			trans	-108.9	124.2	177.3	-179.2	0	0	0	0	109.6	P158 I162	P158-V160 VanDerWaalsContact C-N 3.27Å; P158-V160 HydrophobicContact CB-CG2 4.13Å; P158-V160 HydrophobicContact CG-CG2 4.44Å; P158-V160 PolarHBondContact O-N 3.5Å; V160-I162 VanDerWaalsContact C-N 3.26Å; V160-I162 PolarHBondContact O-N 3.09Å; V160-I162 VanDerWaalsContact O-N 3.15Å
161	R	86.3	Confident	91.4	Very high	244 Å²	244	63 Å²	63	92%	0.921	36%	0.363	S	S	*	.	S	Bend	trans	48.1	43	174.1	-62	-177.7	-176.4	-146.8	2.1	114.1	G163	R161-G163 PolarHBondContact O-N 3.39Å
162	I	93.5	Very high	91.5	Very high	32 Å²	32	61.8 Å²	61.8	16%	0.164	36%	0.36	C	S	.	.			trans	-67.1	-0.9	-178.6	65.3	167.7	0	0	0	114.4	V160 L164 Y182 Y210 A241 S244	V160-I162 VanDerWaalsContact C-N 3.26Å; V160-I162 PolarHBondContact O-N 3.09Å; V160-I162 VanDerWaalsContact O-N 3.15Å; I162-L164 HydrophobicContact CD1-CB 4.01Å; I162-L164 HydrophobicContact CG1-CB 4.1Å; I162-L164 PolarHBondContact O-N 2.95Å; I162-Y182 VanDerWaalsContact O-CD2 3.3Å; I162-Y182 WeakPolarHBondContact O-CD2 3.5Å; I162-Y210 HydrophobicContact CG2-CD2 3.52Å; I162-Y210 HydrophobicContact CG2-CE2 4.38Å; I162-Y210 HydrophobicContact CG2-CG 3.92Å; I162-A241 HydrophobicContact CD1-CB 4.39Å; I162-S244 VanDerWaalsContact CD1-OG 3.31Å; I162-S244 WeakPolarHBondContact CD1-OG 3.31Å
163	G	95.5	Very high	91.8	Very high	17 Å²	17	62.9 Å²	62.9	18%	0.175	36%	0.364	C	S	.	.	S	Bend	trans	73.3	4.3	178.7	0	0	0	0	0	115.4	R161 H178 S179 Y182	R161-G163 PolarHBondContact O-N 3.39Å; G163-H178 WeakPolarHBondContact O-CA 3.17Å; G163-S179 WeakPolarHBondContact CA-OG 3.48Å; G163-S179 PolarHBondContact O-N 3.07Å; G163-Y182 WeakPolarHBondContact O-CB 3.49Å
164	L	96.4	Very high	92.2	Very high	14 Å²	14	61 Å²	61	7%	0.073	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.2	176.8	-174.8	64.3	0	0	0	109.9	I162 F176 H178 I212 F242 A245	I162-L164 HydrophobicContact CD1-CB 4.01Å; I162-L164 HydrophobicContact CG1-CB 4.1Å; I162-L164 PolarHBondContact O-N 2.95Å; L164-F176 HydrophobicContact CD1-CB 4.06Å; L164-F176 HydrophobicContact CD1-CD1 3.89Å; L164-F176 HydrophobicContact CD1-CG 4.25Å; L164-F176 HydrophobicContact CD2-CD1 4.47Å; L164-F176 HydrophobicContact CG-CD1 4.15Å; L164-H178 WeakPolarHBondContact CD1-CD2 3.47Å; L164-I212 HydrophobicContact CD2-CD1 4.11Å; L164-I212 HydrophobicContact CD2-CG1 4.06Å; L164-F242 HydrophobicContact CD2-CD1 3.85Å; L164-F242 HydrophobicContact CD2-CE1 4.18Å; L164-A245 HydrophobicContact CB-CB 4.13Å; L164-A245 HydrophobicContact CD2-CB 3.89Å; L164-A245 HydrophobicContact CG-CB 3.61Å; L164-A245 WeakPolarHBondContact O-CB 3.35Å
165	S	96.5	Very high	92.8	Very high	53 Å²	53	58.8 Å²	58.8	37%	0.371	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	172.8	177.8	60.5	0	0	0	0	110.4	F176 V177	S165-F176 CarbonylContact O-C 3.51Å; S165-F176 VanDerWaalsContact O-CA 3.29Å; S165-F176 WeakPolarHBondContact O-CA 3.3Å; S165-V177 PolarHBondContact N-O 3.2Å; S165-V177 PolarHBondContact O-N 2.94Å; S165-V177 PolarHBondContact OG-O 3.17Å; S165-V177 VanDerWaalsContact OG-O 3.14Å
166	M	97.7	Very high	93.3	Very high	10 Å²	10	57.5 Å²	57.5	5%	0.049	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.7	178.7	-179.9	-176.5	-73.6	0	0	110.9	Y174 T175 F176 A245 F246 H247 F250	M166-Y174 HydrophobicContact CG-CD1 4.22Å; M166-Y174 HydrophobicContact SD-CD1 4.05Å; M166-Y174 HydrophobicContact SD-CG 4.23Å; M166-T175 WeakPolarHBondContact CA-O 3.46Å; M166-T175 WeakPolarHBondContact CG-O 3.33Å; M166-F176 HydrophobicContact CB-CD1 4.33Å; M166-F176 HydrophobicContact CB-CE1 4.48Å; M166-F176 HydrophobicContact CE-CD1 4.08Å; M166-F176 HydrophobicContact CE-CD2 4.46Å; M166-F176 HydrophobicContact CE-CE1 3.42Å; M166-F176 VanDerWaalsContact CE-CE1 3.42Å; M166-F176 HydrophobicContact CE-CE2 3.87Å; M166-F176 HydrophobicContact CE-CZ 3.29Å; M166-A245 WeakPolarHBondContact CB-O 3.48Å; M166-A245 PolarHBondContact N-O 3.48Å; M166-F246 HydrophobicContact CE-CD1 3.57Å; M166-F246 HydrophobicContact CE-CE1 4.07Å; M166-F246 HydrophobicContact CE-CG 4.46Å; M166-H247 HydrophobicContact CB-CB 4.18Å; M166-H247 HydrophobicContact CG-CB 4.07Å; M166-H247 HydrophobicContact SD-CB 4.11Å; M166-F250 HydrophobicContact CE-CD1 3.76Å; M166-F250 HydrophobicContact CE-CD2 4.3Å; M166-F250 HydrophobicContact CE-CE1 3.77Å; M166-F250 HydrophobicContact CE-CE2 4.3Å; M166-F250 HydrophobicContact CE-CG 4.03Å; M166-F250 HydrophobicContact CE-CZ 4.05Å; M166-F250 HydrophobicContact SD-CB 3.51Å; M166-F250 VanDerWaalsContact SD-CB 3.51Å; M166-F250 HydrophobicContact SD-CD1 3.62Å; M166-F250 HydrophobicContact SD-CD2 3.63Å; M166-F250 HydrophobicContact SD-CE1 4.18Å; M166-F250 HydrophobicContact SD-CE2 4.18Å; M166-F250 HydrophobicContact SD-CG 3.3Å; M166-F250 WeakPolarHBondContact SD-CG 3.31Å; M166-F250 HydrophobicContact SD-CZ 4.43Å
167	E	96.5	Very high	93.5	Very high	103 Å²	103	59.1 Å²	59.1	48%	0.481	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	141.6	179.5	-68.4	-178.9	178	0	0	111.5	Y174 T175 V177	E167-Y174 WeakPolarHBondContact O-CA 3.16Å; E167-T175 PolarHBondContact N-O 3.22Å; E167-T175 PolarHBondContact O-N 2.91Å; E167-V177 HydrophobicContact CB-CG2 4.13Å; E167-V177 HydrophobicContact CG-CG2 3.74Å
168	P	96.6	Very high	93.8	Very high	70 Å²	70	58.7 Å²	58.7	46%	0.455	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131	171.3	30.5	-32.2	0	0	0	111.2	Y174	P168-Y174 HydrophobicContact CB-CD1 3.99Å; P168-Y174 HydrophobicContact CB-CE1 3.72Å
169	L	94	Very high	94.1	Very high	79 Å²	79	56 Å²	56	41%	0.414	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-6	172.7	-69.2	167.9	0	0	0	112.8	L173 T175	L169-L173 HydrophobicContact CB-CB 4.17Å; L169-L173 HydrophobicContact CB-CD2 4.07Å; L169-L173 HydrophobicContact CB-CG 4.11Å; L169-L173 HydrophobicContact CD1-CD2 3.84Å; L169-L173 HydrophobicContact CD1-CG 3.95Å; L169-L173 PolarHBondContact N-O 2.72Å; L169-T175 HydrophobicContact CD1-CG2 3.87Å; L169-T175 HydrophobicContact CD2-CG2 4.24Å; L169-T175 HydrophobicContact CG-CG2 4.01Å
170	G	89.9	Confident	94.4	Very high	41 Å²	41	61 Å²	61	42%	0.423	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100	161	-176.8	0	0	0	0	0	113.2	G172 L173	G170-G172 PolarHBondContact O-N 3.42Å; G170-G172 VanDerWaalsContact O-N 3.12Å; G170-L173 WeakPolarHBondContact O-CB 3.37Å; G170-L173 PolarHBondContact O-N 2.91Å
171	C	87.9	Confident	94.9	Very high	148 Å²	148	61.9 Å²	61.9	100%	1	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	33.5	178.2	-56.5	0	0	0	0	115.2	L173	C171-L173 VanDerWaalsContact C-N 3.27Å; C171-L173 PolarHBondContact O-N 3.29Å
172	G	90.8	Very high	95.4	Very high	25 Å²	25	50.5 Å²	50.5	26%	0.258	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	2	-177.8	0	0	0	0	0	114.9	G170 Y174 C257 R258	G170-G172 PolarHBondContact O-N 3.42Å; G170-G172 VanDerWaalsContact O-N 3.12Å; G172-Y174 WeakPolarHBondContact O-CD2 3.49Å; G172-Y174 WeakPolarHBondContact O-CE2 3.29Å; G172-C257 CarbonylContact O-C 3.22Å; G172-C257 WeakPolarHBondContact O-CA 3.47Å; G172-R258 PolarHBondContact O-N 3.42Å
173	L	95.9	Very high	95.5	Very high	59 Å²	59	50.8 Å²	50.8	31%	0.309	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	138	173.6	-171.1	67.3	0	0	0	110.9	L169 G170 C171 R258	L169-L173 HydrophobicContact CB-CB 4.17Å; L169-L173 HydrophobicContact CB-CD2 4.07Å; L169-L173 HydrophobicContact CB-CG 4.11Å; L169-L173 HydrophobicContact CD1-CD2 3.84Å; L169-L173 HydrophobicContact CD1-CG 3.95Å; L169-L173 PolarHBondContact N-O 2.72Å; G170-L173 WeakPolarHBondContact O-CB 3.37Å; G170-L173 PolarHBondContact O-N 2.91Å; C171-L173 VanDerWaalsContact C-N 3.27Å; C171-L173 PolarHBondContact O-N 3.29Å; L173-R258 HydrophobicContact CD1-CB 3.86Å
174	Y	98	Very high	95.5	Very high	21 Å²	21	53.8 Å²	53.8	8%	0.082	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	165	178.5	-65	-100.9	0	0	0	110.6	M166 E167 P168 G172 H247 S249 F250 C257 R258 L259	M166-Y174 HydrophobicContact CG-CD1 4.22Å; M166-Y174 HydrophobicContact SD-CD1 4.05Å; M166-Y174 HydrophobicContact SD-CG 4.23Å; E167-Y174 WeakPolarHBondContact O-CA 3.16Å; P168-Y174 HydrophobicContact CB-CD1 3.99Å; P168-Y174 HydrophobicContact CB-CE1 3.72Å; G172-Y174 WeakPolarHBondContact O-CD2 3.49Å; G172-Y174 WeakPolarHBondContact O-CE2 3.29Å; Y174-H247 HydrophobicContact CD1-CB 4.31Å; Y174-H247 HydrophobicContact CE1-CB 4.23Å; Y174-S249 WeakPolarHBondContact CE1-OG 3.49Å; Y174-S249 PolarHBondContact OH-O 2.91Å; Y174-S249 VanDerWaalsContact OH-O 3.14Å; Y174-S249 PolarHBondContact OH-OG 3.48Å; Y174-F250 HydrophobicContact CD1-CB 4.14Å; Y174-F250 HydrophobicContact CD1-CD2 4.03Å; Y174-F250 AromaticContact CD2-CD2 3.44Å; Y174-F250 HydrophobicContact CD2-CD2 3.44Å; Y174-F250 VanDerWaalsContact CD2-CD2 3.44Å; Y174-F250 AromaticContact CD2-CE2 4Å; Y174-F250 HydrophobicContact CD2-CE2 4Å; Y174-F250 HydrophobicContact CE1-CB 4.02Å; Y174-F250 HydrophobicContact CE1-CD2 4.41Å; Y174-F250 AromaticContact CE2-CD2 3.86Å; Y174-F250 HydrophobicContact CE2-CD2 3.86Å; Y174-F250 HydrophobicContact CG-CB 4.5Å; Y174-F250 AromaticContact CG-CD2 3.53Å; Y174-F250 HydrophobicContact CG-CD2 3.53Å; Y174-F250 HydrophobicContact CG-CE2 4.17Å; Y174-F250 HydrophobicContact CG-CG 4.41Å; Y174-C257 HydrophobicContact CD2-CB 4.3Å; Y174-C257 HydrophobicContact CE2-CB 4.22Å; Y174-R258 PolarHBondContact N-O 2.68Å; Y174-L259 VanDerWaalsContact O-CD2 3.26Å; Y174-L259 WeakPolarHBondContact O-CD2 3.42Å
175	T	97.7	Very high	95.5	Very high	8 Å²	8	54.7 Å²	54.7	5%	0.049	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	145.9	171.9	-171.6	0	0	0	0	110.2	M166 E167 L169 V177 R263	M166-T175 WeakPolarHBondContact CA-O 3.46Å; M166-T175 WeakPolarHBondContact CG-O 3.33Å; E167-T175 PolarHBondContact N-O 3.22Å; E167-T175 PolarHBondContact O-N 2.91Å; L169-T175 HydrophobicContact CD1-CG2 3.87Å; L169-T175 HydrophobicContact CD2-CG2 4.24Å; L169-T175 HydrophobicContact CG-CG2 4.01Å; T175-V177 HydrophobicContact CG2-CG2 4.32Å; T175-R263 WeakPolarHBondContact OG1-CD 3.45Å
176	F	98.2	Very high	95.5	Very high	3 Å²	3	52.2 Å²	52.2	1%	0.013	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	150.9	164.6	-69.7	-77.4	0	0	0	110.7	L164 S165 M166 F242 A245 F246 L259 V265 N266 L269	L164-F176 HydrophobicContact CD1-CB 4.06Å; L164-F176 HydrophobicContact CD1-CD1 3.89Å; L164-F176 HydrophobicContact CD1-CG 4.25Å; L164-F176 HydrophobicContact CD2-CD1 4.47Å; L164-F176 HydrophobicContact CG-CD1 4.15Å; S165-F176 CarbonylContact O-C 3.51Å; S165-F176 VanDerWaalsContact O-CA 3.29Å; S165-F176 WeakPolarHBondContact O-CA 3.3Å; M166-F176 HydrophobicContact CB-CD1 4.33Å; M166-F176 HydrophobicContact CB-CE1 4.48Å; M166-F176 HydrophobicContact CE-CD1 4.08Å; M166-F176 HydrophobicContact CE-CD2 4.46Å; M166-F176 HydrophobicContact CE-CE1 3.42Å; M166-F176 VanDerWaalsContact CE-CE1 3.42Å; M166-F176 HydrophobicContact CE-CE2 3.87Å; M166-F176 HydrophobicContact CE-CZ 3.29Å; F176-F242 HydrophobicContact CD1-CD1 4.1Å; F176-F242 HydrophobicContact CD1-CE1 4.41Å; F176-F242 HydrophobicContact CD2-CD1 4.24Å; F176-F242 HydrophobicContact CD2-CE1 4.06Å; F176-F242 AromaticContact CE1-CD1 3.55Å; F176-F242 HydrophobicContact CE1-CD1 3.55Å; F176-F242 HydrophobicContact CE1-CE1 4.24Å; F176-F242 AromaticContact CE2-CD1 3.7Å; F176-F242 HydrophobicContact CE2-CD1 3.7Å; F176-F242 AromaticContact CE2-CE1 3.87Å; F176-F242 HydrophobicContact CE2-CE1 3.87Å; F176-F242 HydrophobicContact CG-CD1 4.42Å; F176-F242 HydrophobicContact CG-CE1 4.32Å; F176-F242 HydrophobicContact CZ-CB 4.24Å; F176-F242 AromaticContact CZ-CD1 3.31Å; F176-F242 HydrophobicContact CZ-CD1 3.31Å; F176-F242 AromaticContact CZ-CE1 3.96Å; F176-F242 HydrophobicContact CZ-CE1 3.96Å; F176-F242 HydrophobicContact CZ-CG 4.14Å; F176-A245 HydrophobicContact CD1-CB 4.42Å; F176-A245 HydrophobicContact CE1-CB 4.18Å; F176-F246 HydrophobicContact CE1-CD1 4.33Å; F176-F246 HydrophobicContact CE1-CE1 4.49Å; F176-F246 HydrophobicContact CZ-CD1 4.2Å; F176-F246 AromaticContact CZ-CE1 3.96Å; F176-F246 HydrophobicContact CZ-CE1 3.96Å; F176-L259 HydrophobicContact CE2-CD1 4.03Å; F176-V265 HydrophobicContact CB-CB 4.24Å; F176-V265 HydrophobicContact CB-CG2 4.31Å; F176-V265 VanDerWaalsContact O-CG2 3.26Å; F176-V265 WeakPolarHBondContact O-CG2 3.49Å; F176-N266 WeakPolarHBondContact CD2-OD1 3.09Å; F176-N266 PolarHBondContact N-OD1 3.02Å; F176-L269 HydrophobicContact CE2-CB 4.26Å; F176-L269 HydrophobicContact CE2-CD2 3.92Å; F176-L269 HydrophobicContact CZ-CD2 4.1Å
177	V	97.3	Very high	95.2	Very high	42 Å²	42	55 Å²	55	26%	0.255	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	124.7	177.7	179.3	0	0	0	0	108.4	S165 E167 T175	S165-V177 PolarHBondContact N-O 3.2Å; S165-V177 PolarHBondContact O-N 2.94Å; S165-V177 PolarHBondContact OG-O 3.17Å; S165-V177 VanDerWaalsContact OG-O 3.14Å; E167-V177 HydrophobicContact CB-CG2 4.13Å; E167-V177 HydrophobicContact CG-CG2 3.74Å; T175-V177 HydrophobicContact CG2-CG2 4.32Å
178	H	97.1	Very high	95.1	Very high	11 Å²	11	52.6 Å²	52.6	5%	0.051	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.6	179.3	-63.9	178.5	0	0	0	109.4	G163 L164 Y182 Q183 I526 Y527	G163-H178 WeakPolarHBondContact O-CA 3.17Å; L164-H178 WeakPolarHBondContact CD1-CD2 3.47Å; H178-Y182 HydrophobicContact CB-CD1 3.74Å; H178-Y182 HydrophobicContact CB-CG 4.27Å; H178-Y182 AromaticContact CE1-CE1 3.62Å; H178-Y182 AromaticContact CG-CD1 3.53Å; H178-Y182 AromaticContact CG-CE1 3.87Å; H178-Y182 AromaticContact ND1-CD1 3.53Å; H178-Y182 AromaticContact ND1-CE1 3.55Å; H178-Q183 HydrophobicContact CB-CG 3.92Å; H178-Q183 PolarHBondContact O-NE2 2.84Å; H178-I526 HydrophobicContact CB-CD1 4.36Å; H178-Y527 AromaticContact ND1-CE2 3.99Å; H178-Y527 AromaticContact ND1-CZ 3.76Å; H178-Y527 PolarHBondContact ND1-OH 2.89Å
179	S	96.7	Very high	95	Very high	36 Å²	36	49.3 Å²	49.3	25%	0.252	28%	0.277	S	S	.	.			trans	-63.5	165.2	173.2	86.9	0	0	0	0	111	G163 E181 Y182 Q183	G163-S179 WeakPolarHBondContact CA-OG 3.48Å; G163-S179 PolarHBondContact O-N 3.07Å; S179-E181 VanDerWaalsContact CB-OE2 3.27Å; S179-E181 WeakPolarHBondContact CB-OE2 3.37Å; S179-E181 PolarHBondContact O-N 3.42Å; S179-E181 PolarHBondContact OG-N 3.06Å; S179-E181 PolarHBondContact OG-OE2 2.74Å; S179-Y182 PolarHBondContact O-N 3.39Å; S179-Y182 PolarHBondContact OG-N 3.18Å; S179-Q183 VanDerWaalsContact O-CG 3.27Å; S179-Q183 WeakPolarHBondContact O-CG 3.36Å; S179-Q183 PolarHBondContact O-N 3.18Å
180	K	95.1	Very high	94.9	Very high	162 Å²	162	48.3 Å²	48.3	70%	0.704	27%	0.268	S	S	*	.	H	α-helix	trans	-60.6	-37.7	177.9	-70	-176.8	179	179.6	0	111.5	Q183 N184	K180-Q183 PolarHBondContact O-N 2.84Å; K180-N184 VanDerWaalsContact O-CG 3.22Å; K180-N184 PolarHBondContact O-N 3.3Å; K180-N184 PolarHBondContact O-OD1 3.47Å
181	E	95.4	Very high	94.9	Very high	121 Å²	121	51.2 Å²	51.2	57%	0.565	27%	0.273	S	S	*	.	H	α-helix	trans	-64.1	-48.5	176.4	-56.8	71.6	-154.6	0	0	110.5	S179 Q183 N184 I185	S179-E181 VanDerWaalsContact CB-OE2 3.27Å; S179-E181 WeakPolarHBondContact CB-OE2 3.37Å; S179-E181 PolarHBondContact O-N 3.42Å; S179-E181 PolarHBondContact OG-N 3.06Å; S179-E181 PolarHBondContact OG-OE2 2.74Å; E181-Q183 VanDerWaalsContact C-N 3.27Å; E181-Q183 PolarHBondContact O-N 3.3Å; E181-N184 WeakPolarHBondContact O-CB 3.2Å; E181-N184 PolarHBondContact O-N 3.44Å; E181-N184 VanDerWaalsContact O-N 3.11Å; E181-I185 WeakPolarHBondContact O-CD1 3.48Å; E181-I185 WeakPolarHBondContact O-CG1 3.2Å; E181-I185 PolarHBondContact O-N 3.35Å
182	Y	97.3	Very high	95.1	Very high	6 Å²	6	44.6 Å²	44.6	2%	0.024	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-40.3	174.8	-166.2	-80	0	0	0	111.7	I162 G163 H178 S179 N184 I185 Q186 H211 I212	I162-Y182 VanDerWaalsContact O-CD2 3.3Å; I162-Y182 WeakPolarHBondContact O-CD2 3.5Å; G163-Y182 WeakPolarHBondContact O-CB 3.49Å; H178-Y182 HydrophobicContact CB-CD1 3.74Å; H178-Y182 HydrophobicContact CB-CG 4.27Å; H178-Y182 AromaticContact CE1-CE1 3.62Å; H178-Y182 AromaticContact CG-CD1 3.53Å; H178-Y182 AromaticContact CG-CE1 3.87Å; H178-Y182 AromaticContact ND1-CD1 3.53Å; H178-Y182 AromaticContact ND1-CE1 3.55Å; S179-Y182 PolarHBondContact O-N 3.39Å; S179-Y182 PolarHBondContact OG-N 3.18Å; Y182-N184 VanDerWaalsContact C-N 3.33Å; Y182-N184 PolarHBondContact O-N 3.23Å; Y182-I185 PolarHBondContact O-N 3.28Å; Y182-Q186 PolarHBondContact O-N 3.48Å; Y182-H211 AromaticContact CE1-CD2 3.92Å; Y182-H211 AromaticContact CE2-CD2 3.97Å; Y182-H211 AromaticContact CZ-CD2 3.55Å; Y182-H211 PolarHBondContact OH-CD2 3.03Å; Y182-I212 WeakPolarHBondContact OH-CB 3.48Å; Y182-I212 WeakPolarHBondContact OH-CG1 3.49Å; Y182-I212 PolarHBondContact OH-N 2.85Å
183	Q	96.1	Very high	94.9	Very high	37 Å²	37	44.4 Å²	44.4	17%	0.173	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-38.1	176.6	-70	173.4	41.4	0	0	112.5	H178 S179 K180 E181 Q186 R187 I526 Y527	H178-Q183 HydrophobicContact CB-CG 3.92Å; H178-Q183 PolarHBondContact O-NE2 2.84Å; S179-Q183 VanDerWaalsContact O-CG 3.27Å; S179-Q183 WeakPolarHBondContact O-CG 3.36Å; S179-Q183 PolarHBondContact O-N 3.18Å; K180-Q183 PolarHBondContact O-N 2.84Å; E181-Q183 VanDerWaalsContact C-N 3.27Å; E181-Q183 PolarHBondContact O-N 3.3Å; Q183-Q186 PolarHBondContact O-N 2.85Å; Q183-R187 WeakPolarHBondContact O-CG 3.26Å; Q183-R187 PolarHBondContact O-N 2.9Å; Q183-R187 VanDerWaalsContact O-N 3.11Å; Q183-I526 HydrophobicContact CG-CD1 4.46Å; Q183-Y527 HydrophobicContact CB-CE1 3.78Å; Q183-Y527 HydrophobicContact CG-CE1 3.76Å
184	N	95.2	Very high	94.4	Very high	81 Å²	81	48.6 Å²	48.6	43%	0.433	24%	0.241	S	C	.	.	H	α-helix	trans	-63	-45.1	174.1	-64.6	-17	0	0	0	111.1	K180 E181 Y182 Q186 R187 S188	K180-N184 VanDerWaalsContact O-CG 3.22Å; K180-N184 PolarHBondContact O-N 3.3Å; K180-N184 PolarHBondContact O-OD1 3.47Å; E181-N184 WeakPolarHBondContact O-CB 3.2Å; E181-N184 PolarHBondContact O-N 3.44Å; E181-N184 VanDerWaalsContact O-N 3.11Å; Y182-N184 VanDerWaalsContact C-N 3.33Å; Y182-N184 PolarHBondContact O-N 3.23Å; N184-Q186 VanDerWaalsContact C-N 3.33Å; N184-Q186 PolarHBondContact O-N 2.84Å; N184-R187 PolarHBondContact O-N 3.43Å; N184-R187 VanDerWaalsContact O-N 3.16Å; N184-R187 PolarHBondContact OD1-NH1 3.27Å; N184-S188 PolarHBondContact O-N 2.86Å; N184-S188 PolarHBondContact O-OG 3.14Å
185	I	95.8	Very high	93.7	Very high	33 Å²	33	50.3 Å²	50.3	17%	0.169	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-43.7	177.1	-62.9	155.2	0	0	0	110.8	E181 Y182 R187 S188 F189 I204 N208 H211	E181-I185 WeakPolarHBondContact O-CD1 3.48Å; E181-I185 WeakPolarHBondContact O-CG1 3.2Å; E181-I185 PolarHBondContact O-N 3.35Å; Y182-I185 PolarHBondContact O-N 3.28Å; I185-R187 VanDerWaalsContact C-N 3.3Å; I185-R187 PolarHBondContact O-N 3.42Å; I185-S188 WeakPolarHBondContact O-CB 3.49Å; I185-S188 PolarHBondContact O-N 3.1Å; I185-S188 VanDerWaalsContact O-N 3.16Å; I185-F189 PolarHBondContact O-N 2.89Å; I185-I204 HydrophobicContact CG2-CG2 3.82Å; I185-N208 HydrophobicContact CD1-CB 4.32Å; I185-N208 VanDerWaalsContact CD1-CG 3.49Å; I185-N208 WeakPolarHBondContact CD1-OD1 3.46Å; I185-N208 HydrophobicContact CG2-CB 4.25Å; I185-H211 HydrophobicContact CG2-CB 4.32Å
186	Q	95.4	Very high	92.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-37.6	176.7	-174.2	75.4	51.4	0	0	112.3	Y182 Q183 N184 F189 Y190 H211 D213 Y527	Y182-Q186 PolarHBondContact O-N 3.48Å; Q183-Q186 PolarHBondContact O-N 2.85Å; N184-Q186 VanDerWaalsContact C-N 3.33Å; N184-Q186 PolarHBondContact O-N 2.84Å; Q186-F189 VanDerWaalsContact NE2-CD1 3.35Å; Q186-F189 WeakPolarHBondContact O-CB 3.47Å; Q186-F189 PolarHBondContact O-N 3.22Å; Q186-Y190 HydrophobicContact CG-CD2 4.38Å; Q186-Y190 HydrophobicContact CG-CE2 3.73Å; Q186-Y190 VanDerWaalsContact NE2-CE1 3.3Å; Q186-Y190 VanDerWaalsContact NE2-CZ 3.26Å; Q186-Y190 PolarHBondContact NE2-OH 2.92Å; Q186-Y190 WeakPolarHBondContact O-CD2 3.29Å; Q186-Y190 PolarHBondContact O-N 3.31Å; Q186-H211 PolarHBondContact OE1-NE2 3.42Å; Q186-H211 VanDerWaalsContact OE1-NE2 3.09Å; Q186-D213 PolarHBondContact NE2-OD2 3.19Å; Q186-D213 PolarHBondContact OE1-OD2 3.32Å; Q186-Y527 HydrophobicContact CB-CD1 4.49Å; Q186-Y527 HydrophobicContact CB-CE1 3.73Å; Q186-Y527 HydrophobicContact CB-CE2 4.41Å; Q186-Y527 HydrophobicContact CG-CD1 4.24Å; Q186-Y527 HydrophobicContact CG-CD2 4.17Å; Q186-Y527 HydrophobicContact CG-CE1 3.77Å; Q186-Y527 HydrophobicContact CG-CE2 3.72Å; Q186-Y527 HydrophobicContact CG-CG 4.41Å; Q186-Y527 VanDerWaalsContact CG-CZ 3.48Å
187	R	93.4	Very high	92	Very high	68 Å²	68	60.8 Å²	60.8	26%	0.257	31%	0.308	S	S	.	.	H	α-helix	trans	-66.5	-43.2	174.6	-67.4	-172.8	-143.9	100.8	3.8	111.4	Q183 N184 I185 F189 Y190 N191 Y527	Q183-R187 WeakPolarHBondContact O-CG 3.26Å; Q183-R187 PolarHBondContact O-N 2.9Å; Q183-R187 VanDerWaalsContact O-N 3.11Å; N184-R187 PolarHBondContact O-N 3.43Å; N184-R187 VanDerWaalsContact O-N 3.16Å; N184-R187 PolarHBondContact OD1-NH1 3.27Å; I185-R187 VanDerWaalsContact C-N 3.3Å; I185-R187 PolarHBondContact O-N 3.42Å; R187-F189 PolarHBondContact O-N 3.2Å; R187-Y190 PolarHBondContact O-N 3.31Å; R187-N191 PolarHBondContact O-N 2.97Å; R187-Y527 HydrophobicContact CG-CD1 4.5Å
188	S	93.1	Very high	91.1	Very high	54 Å²	54	60.5 Å²	60.5	38%	0.378	31%	0.307	S	S	.	.	H	α-helix	trans	-59.3	-36.1	172.9	-60.3	0	0	0	0	111.9	N184 I185 N191 A192	N184-S188 PolarHBondContact O-N 2.86Å; N184-S188 PolarHBondContact O-OG 3.14Å; I185-S188 WeakPolarHBondContact O-CB 3.49Å; I185-S188 PolarHBondContact O-N 3.1Å; I185-S188 VanDerWaalsContact O-N 3.16Å; S188-N191 PolarHBondContact O-N 3.14Å; S188-A192 WeakPolarHBondContact O-CB 3.33Å; S188-A192 PolarHBondContact O-N 2.88Å
189	F	94.1	Very high	90.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-45.1	173.1	169.2	-96	0	0	0	112.9	I185 Q186 R187 N191 A192 L193 L201 I204 H211 D213 S214 Q217 F515	I185-F189 PolarHBondContact O-N 2.89Å; Q186-F189 VanDerWaalsContact NE2-CD1 3.35Å; Q186-F189 WeakPolarHBondContact O-CB 3.47Å; Q186-F189 PolarHBondContact O-N 3.22Å; R187-F189 PolarHBondContact O-N 3.2Å; F189-N191 VanDerWaalsContact C-N 3.33Å; F189-N191 PolarHBondContact O-N 3.04Å; F189-A192 WeakPolarHBondContact O-CB 3.2Å; F189-A192 PolarHBondContact O-N 2.92Å; F189-A192 VanDerWaalsContact O-N 3.13Å; F189-L193 HydrophobicContact CD1-CD1 4.05Å; F189-L193 HydrophobicContact CD1-CG 4.44Å; F189-L193 HydrophobicContact CE1-CD1 3.4Å; F189-L193 VanDerWaalsContact CE1-CD1 3.4Å; F189-L193 HydrophobicContact CE1-CG 4.02Å; F189-L193 HydrophobicContact CE2-CD1 4.43Å; F189-L193 HydrophobicContact CE2-CD2 4.24Å; F189-L193 HydrophobicContact CE2-CG 4.24Å; F189-L193 HydrophobicContact CZ-CD1 3.63Å; F189-L193 HydrophobicContact CZ-CD2 4.01Å; F189-L193 HydrophobicContact CZ-CG 3.91Å; F189-L193 WeakPolarHBondContact O-CG 3.32Å; F189-L193 PolarHBondContact O-N 3.26Å; F189-L201 HydrophobicContact CD2-CD2 3.58Å; F189-L201 HydrophobicContact CE2-CD2 3.62Å; F189-I204 VanDerWaalsContact CA-CD1 3.42Å; F189-I204 HydrophobicContact CB-CD1 3.93Å; F189-H211 AromaticContact CD2-CE1 3.95Å; F189-H211 AromaticContact CG-CE1 3.6Å; F189-D213 HydrophobicContact CD1-CB 4.08Å; F189-D213 HydrophobicContact CE1-CB 3.51Å; F189-D213 HydrophobicContact CE2-CB 4.3Å; F189-D213 HydrophobicContact CZ-CB 3.65Å; F189-S214 VanDerWaalsContact CD2-OG 3.32Å; F189-S214 WeakPolarHBondContact CD2-OG 3.34Å; F189-Q217 HydrophobicContact CE2-CB 4.25Å; F189-Q217 HydrophobicContact CZ-CB 4.21Å; F189-F515 AromaticContact CE1-CE1 3.96Å; F189-F515 HydrophobicContact CE1-CE1 3.96Å; F189-F515 HydrophobicContact CE1-CE2 4.13Å; F189-F515 AromaticContact CE1-CZ 3.75Å; F189-F515 HydrophobicContact CE1-CZ 3.75Å; F189-F515 HydrophobicContact CZ-CD1 4.14Å; F189-F515 AromaticContact CZ-CE1 3.82Å; F189-F515 HydrophobicContact CZ-CE1 3.82Å; F189-F515 HydrophobicContact CZ-CZ 4.1Å
190	Y	91.9	Very high	90.3	Very high	59 Å²	59	64 Å²	64	23%	0.231	32%	0.324	C	S	.	.	H	α-helix	trans	-61.1	-42.1	175	-64.4	-38.3	0	0	0	112	Q186 R187 A192 L193 E194 Q264 Y527	Q186-Y190 HydrophobicContact CG-CD2 4.38Å; Q186-Y190 HydrophobicContact CG-CE2 3.73Å; Q186-Y190 VanDerWaalsContact NE2-CE1 3.3Å; Q186-Y190 VanDerWaalsContact NE2-CZ 3.26Å; Q186-Y190 PolarHBondContact NE2-OH 2.92Å; Q186-Y190 WeakPolarHBondContact O-CD2 3.29Å; Q186-Y190 PolarHBondContact O-N 3.31Å; R187-Y190 PolarHBondContact O-N 3.31Å; Y190-A192 VanDerWaalsContact C-N 3.31Å; Y190-A192 PolarHBondContact O-N 2.82Å; Y190-L193 HydrophobicContact CD1-CD1 4.29Å; Y190-L193 WeakPolarHBondContact O-CB 3.31Å; Y190-L193 PolarHBondContact O-N 3.26Å; Y190-E194 PolarHBondContact O-N 3.17Å; Y190-Q264 PolarHBondContact OH-NE2 3.12Å; Y190-Y527 HydrophobicContact CE2-CD1 4.48Å; Y190-Y527 HydrophobicContact CE2-CD2 4.19Å; Y190-Y527 AromaticContact CE2-CG 3.93Å; Y190-Y527 HydrophobicContact CE2-CG 3.93Å
191	N	91.2	Very high	90	Very high	101 Å²	101	56.7 Å²	56.7	54%	0.54	29%	0.292	S	S	.	.	H	α-helix	trans	-61.8	-39.2	173.7	-64.5	-17.9	0	0	0	111.9	R187 S188 F189 E194 S195	R187-N191 PolarHBondContact O-N 2.97Å; S188-N191 PolarHBondContact O-N 3.14Å; F189-N191 VanDerWaalsContact C-N 3.33Å; F189-N191 PolarHBondContact O-N 3.04Å; N191-E194 PolarHBondContact O-N 3.05Å; N191-S195 PolarHBondContact O-N 3.04Å
192	A	90.7	Very high	89.8	Confident	10 Å²	10	51.1 Å²	51.1	8%	0.083	27%	0.266	C	S	.	.	H	α-helix	trans	-66.3	-36.2	176.6	0	0	0	0	0	112.4	S188 F189 Y190 S195 N200 L201 I204	S188-A192 WeakPolarHBondContact O-CB 3.33Å; S188-A192 PolarHBondContact O-N 2.88Å; F189-A192 WeakPolarHBondContact O-CB 3.2Å; F189-A192 PolarHBondContact O-N 2.92Å; F189-A192 VanDerWaalsContact O-N 3.13Å; Y190-A192 VanDerWaalsContact C-N 3.31Å; Y190-A192 PolarHBondContact O-N 2.82Å; A192-S195 PolarHBondContact O-N 3.4Å; A192-S195 PolarHBondContact O-OG 2.88Å; A192-N200 HydrophobicContact CB-CB 3.79Å; A192-L201 HydrophobicContact CB-CD2 3.82Å; A192-I204 HydrophobicContact CB-CD1 3.78Å
193	L	87.5	Confident	89.5	Confident	20 Å²	20	52.4 Å²	52.4	11%	0.105	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-41.8	174	-72.4	176.9	0	0	0	112.2	F189 Y190 S195 M196 L201 Q217 Y513 F515	F189-L193 HydrophobicContact CD1-CD1 4.05Å; F189-L193 HydrophobicContact CD1-CG 4.44Å; F189-L193 HydrophobicContact CE1-CD1 3.4Å; F189-L193 VanDerWaalsContact CE1-CD1 3.4Å; F189-L193 HydrophobicContact CE1-CG 4.02Å; F189-L193 HydrophobicContact CE2-CD1 4.43Å; F189-L193 HydrophobicContact CE2-CD2 4.24Å; F189-L193 HydrophobicContact CE2-CG 4.24Å; F189-L193 HydrophobicContact CZ-CD1 3.63Å; F189-L193 HydrophobicContact CZ-CD2 4.01Å; F189-L193 HydrophobicContact CZ-CG 3.91Å; F189-L193 WeakPolarHBondContact O-CG 3.32Å; F189-L193 PolarHBondContact O-N 3.26Å; Y190-L193 HydrophobicContact CD1-CD1 4.29Å; Y190-L193 WeakPolarHBondContact O-CB 3.31Å; Y190-L193 PolarHBondContact O-N 3.26Å; L193-S195 PolarHBondContact O-N 3.04Å; L193-M196 PolarHBondContact O-N 2.77Å; L193-L201 HydrophobicContact CD2-CD1 4.17Å; L193-L201 HydrophobicContact CD2-CD2 4.14Å; L193-L201 HydrophobicContact CG-CD2 4.44Å; L193-Q217 HydrophobicContact CD2-CG 4.08Å; L193-Y513 HydrophobicContact CB-CE1 4.5Å; L193-Y513 HydrophobicContact CD1-CD1 4.25Å; L193-Y513 HydrophobicContact CD1-CE1 4.03Å; L193-F515 HydrophobicContact CD1-CE1 3.55Å; L193-F515 HydrophobicContact CD1-CZ 3.61Å; L193-F515 HydrophobicContact CD2-CE1 4.45Å
194	E	84.9	Confident	89.4	Confident	148 Å²	148	51.6 Å²	51.6	69%	0.692	28%	0.278	S	S	*	.	H	α-helix	trans	-63.5	-30.6	177.6	-69.3	-178	177.7	0	0	112.3	Y190 N191 M196	Y190-E194 PolarHBondContact O-N 3.17Å; N191-E194 PolarHBondContact O-N 3.05Å; E194-M196 PolarHBondContact O-N 2.96Å
195	S	84.1	Confident	89.3	Confident	56 Å²	56	47.7 Å²	47.7	39%	0.392	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.7	178.7	78.7	0	0	0	0	114.4	N191 A192 L193 N197 N200	N191-S195 PolarHBondContact O-N 3.04Å; A192-S195 PolarHBondContact O-N 3.4Å; A192-S195 PolarHBondContact O-OG 2.88Å; L193-S195 PolarHBondContact O-N 3.04Å; S195-N197 PolarHBondContact O-N 2.94Å; S195-N200 PolarHBondContact OG-ND2 3.48Å
196	M	77.3	Confident	89.2	Confident	168 Å²	168	51 Å²	51	83%	0.828	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	12.4	-176.8	-64.4	-70.5	-126.8	0	0	115	L193 E194	L193-M196 PolarHBondContact O-N 2.77Å; E194-M196 PolarHBondContact O-N 2.96Å
197	N	81.9	Confident	89	Confident	63 Å²	63	58.1 Å²	58.1	34%	0.337	30%	0.302	S	S	.	.			trans	-103.5	111	177.7	-175.5	-7.7	0	0	0	110	S195 N199 N200	S195-N197 PolarHBondContact O-N 2.94Å; N197-N199 PolarHBondContact O-N 3.1Å; N197-N199 WeakPolarHBondContact OD1-CB 3.28Å; N197-N199 PolarHBondContact OD1-N 2.85Å; N197-N199 VanDerWaalsContact OD1-N 3.1Å; N197-N199 PolarHBondContact OD1-ND2 3.4Å; N197-N200 WeakPolarHBondContact O-CB 3.44Å; N197-N200 PolarHBondContact O-N 2.97Å; N197-N200 VanDerWaalsContact O-N 3.16Å
198	P	80.1	Confident	89.1	Confident	36 Å²	36	57 Å²	57	23%	0.234	30%	0.301	C	S	.	.	H	α-helix	trans	-66.3	-21.2	-176.1	30.2	-37.5	0	0	0	112.9	N200 L201 S202 I221 F593	P198-N200 PolarHBondContact O-N 3.23Å; P198-L201 WeakPolarHBondContact O-CB 3.35Å; P198-L201 PolarHBondContact O-N 3.49Å; P198-S202 PolarHBondContact O-N 3.21Å; P198-I221 HydrophobicContact CB-CD1 4.46Å; P198-F593 HydrophobicContact CB-CD1 4.06Å; P198-F593 HydrophobicContact CB-CD2 3.7Å; P198-F593 HydrophobicContact CB-CE1 3.89Å; P198-F593 HydrophobicContact CB-CE2 3.57Å; P198-F593 HydrophobicContact CB-CG 3.94Å; P198-F593 HydrophobicContact CB-CZ 3.65Å; P198-F593 HydrophobicContact CG-CB 4.26Å; P198-F593 HydrophobicContact CG-CD1 4.18Å; P198-F593 HydrophobicContact CG-CD2 3.76Å; P198-F593 HydrophobicContact CG-CE2 4.18Å; P198-F593 HydrophobicContact CG-CG 3.77Å; P198-F593 WeakPolarHBondContact O-CE2 3.47Å
199	N	86.5	Confident	89.3	Confident	57 Å²	57	55.7 Å²	55.7	31%	0.305	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-29	176	-64.7	-59.3	0	0	0	112.9	N197 L201 S202 G203 F593	N197-N199 PolarHBondContact O-N 3.1Å; N197-N199 WeakPolarHBondContact OD1-CB 3.28Å; N197-N199 PolarHBondContact OD1-N 2.85Å; N197-N199 VanDerWaalsContact OD1-N 3.1Å; N197-N199 PolarHBondContact OD1-ND2 3.4Å; N199-L201 VanDerWaalsContact C-N 3.28Å; N199-L201 PolarHBondContact O-N 3.48Å; N199-S202 VanDerWaalsContact CA-OG 3.3Å; N199-S202 WeakPolarHBondContact CA-OG 3.45Å; N199-S202 PolarHBondContact O-N 3.05Å; N199-S202 PolarHBondContact O-OG 2.98Å; N199-G203 PolarHBondContact O-N 3.34Å; N199-F593 WeakPolarHBondContact OD1-CD2 3.34Å
200	N	89.3	Confident	89.4	Confident	65 Å²	65	56.2 Å²	56.2	35%	0.348	29%	0.293	S	S	.	.	H	α-helix	trans	-67	-34.2	176.1	-68.3	-18.3	0	0	0	111	A192 S195 N197 P198 G203 I204	A192-N200 HydrophobicContact CB-CB 3.79Å; S195-N200 PolarHBondContact OG-ND2 3.48Å; N197-N200 WeakPolarHBondContact O-CB 3.44Å; N197-N200 PolarHBondContact O-N 2.97Å; N197-N200 VanDerWaalsContact O-N 3.16Å; P198-N200 PolarHBondContact O-N 3.23Å; N200-G203 PolarHBondContact O-N 2.92Å; N200-I204 WeakPolarHBondContact O-CG1 3.3Å; N200-I204 PolarHBondContact O-N 2.82Å
201	L	89.4	Confident	89.6	Confident	7 Å²	7	53.4 Å²	53.4	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-69.1	-39.1	175.3	-58.6	179.4	0	0	0	111.8	F189 A192 L193 P198 N199 G203 I204 L205 Q217 L218 I221	F189-L201 HydrophobicContact CD2-CD2 3.58Å; F189-L201 HydrophobicContact CE2-CD2 3.62Å; A192-L201 HydrophobicContact CB-CD2 3.82Å; L193-L201 HydrophobicContact CD2-CD1 4.17Å; L193-L201 HydrophobicContact CD2-CD2 4.14Å; L193-L201 HydrophobicContact CG-CD2 4.44Å; P198-L201 WeakPolarHBondContact O-CB 3.35Å; P198-L201 PolarHBondContact O-N 3.49Å; N199-L201 VanDerWaalsContact C-N 3.28Å; N199-L201 PolarHBondContact O-N 3.48Å; L201-G203 VanDerWaalsContact C-N 3.32Å; L201-G203 PolarHBondContact O-N 2.85Å; L201-I204 PolarHBondContact O-N 2.92Å; L201-L205 PolarHBondContact O-N 2.94Å; L201-Q217 HydrophobicContact CD1-CG 3.81Å; L201-L218 HydrophobicContact CB-CD1 4.47Å; L201-L218 HydrophobicContact CB-CD2 3.88Å; L201-L218 HydrophobicContact CB-CG 4.25Å; L201-I221 HydrophobicContact CD1-CD1 4.16Å
202	S	90.1	Very high	89.9	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.028	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-34.9	174.9	51.8	0	0	0	0	112.4	P198 N199 L205 Y206	P198-S202 PolarHBondContact O-N 3.21Å; N199-S202 VanDerWaalsContact CA-OG 3.3Å; N199-S202 WeakPolarHBondContact CA-OG 3.45Å; N199-S202 PolarHBondContact O-N 3.05Å; N199-S202 PolarHBondContact O-OG 2.98Å; S202-L205 PolarHBondContact O-N 3.2Å; S202-Y206 WeakPolarHBondContact O-CB 3.49Å; S202-Y206 PolarHBondContact O-N 2.95Å
203	G	92.5	Very high	90.2	Very high	34 Å²	34	48.6 Å²	48.6	35%	0.351	26%	0.255	S	S	.	.	H	α-helix	trans	-61.3	-43.5	173.1	0	0	0	0	0	112.4	N199 N200 L201 L205 Y206 E207	N199-G203 PolarHBondContact O-N 3.34Å; N200-G203 PolarHBondContact O-N 2.92Å; L201-G203 VanDerWaalsContact C-N 3.32Å; L201-G203 PolarHBondContact O-N 2.85Å; G203-L205 VanDerWaalsContact C-N 3.34Å; G203-L205 PolarHBondContact O-N 3Å; G203-Y206 WeakPolarHBondContact O-CB 3.32Å; G203-Y206 PolarHBondContact O-N 3.29Å; G203-E207 PolarHBondContact O-N 3.34Å
204	I	93.4	Very high	90.6	Very high	19 Å²	19	47.7 Å²	47.7	10%	0.097	25%	0.25	C	S	.	.	H	α-helix	trans	-61.3	-43.6	174.9	-65.9	170.9	0	0	0	111.1	I185 F189 A192 N200 L201 Y206 N208 S214	I185-I204 HydrophobicContact CG2-CG2 3.82Å; F189-I204 VanDerWaalsContact CA-CD1 3.42Å; F189-I204 HydrophobicContact CB-CD1 3.93Å; A192-I204 HydrophobicContact CB-CD1 3.78Å; N200-I204 WeakPolarHBondContact O-CG1 3.3Å; N200-I204 PolarHBondContact O-N 2.82Å; L201-I204 PolarHBondContact O-N 2.92Å; I204-Y206 VanDerWaalsContact C-N 3.34Å; I204-N208 WeakPolarHBondContact O-CA 3.47Å; I204-N208 WeakPolarHBondContact O-CB 3.17Å; I204-N208 PolarHBondContact O-N 3.44Å; I204-N208 PolarHBondContact O-ND2 3.46Å; I204-S214 WeakPolarHBondContact CG2-OG 3.42Å
205	L	93.3	Very high	91.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68	-34.6	179.6	-174.1	67.4	0	0	0	112.3	L201 S202 G203 N208 P209 L215 L218 L234 L597 L601	L201-L205 PolarHBondContact O-N 2.94Å; S202-L205 PolarHBondContact O-N 3.2Å; G203-L205 VanDerWaalsContact C-N 3.34Å; G203-L205 PolarHBondContact O-N 3Å; L205-N208 CarbonylContact O-C 3.2Å; L205-N208 PolarHBondContact O-N 2.88Å; L205-P209 VanDerWaalsContact O-CA 3.27Å; L205-P209 WeakPolarHBondContact O-CA 3.39Å; L205-P209 VanDerWaalsContact O-N 3.17Å; L205-L215 HydrophobicContact CD1-CD2 3.47Å; L205-L215 VanDerWaalsContact CD1-CD2 3.47Å; L205-L215 HydrophobicContact CD1-CG 3.87Å; L205-L215 HydrophobicContact CD2-CD2 4.31Å; L205-L218 HydrophobicContact CB-CD1 3.8Å; L205-L218 HydrophobicContact CD2-CD1 3.55Å; L205-L218 HydrophobicContact CG-CD1 4.21Å; L205-L234 HydrophobicContact CD2-CD2 3.69Å; L205-L597 HydrophobicContact CD2-CD1 4.15Å; L205-L601 HydrophobicContact CD2-CD2 4.2Å
206	Y	92.7	Very high	91.7	Very high	103 Å²	103	38.1 Å²	38.1	40%	0.404	20%	0.199	S	C	.	.	H	α-helix	trans	-59	-49.7	175.1	179.6	-103.8	0	0	0	111.9	S202 G203 I204 V600 M603 I604	S202-Y206 WeakPolarHBondContact O-CB 3.49Å; S202-Y206 PolarHBondContact O-N 2.95Å; G203-Y206 WeakPolarHBondContact O-CB 3.32Å; G203-Y206 PolarHBondContact O-N 3.29Å; I204-Y206 VanDerWaalsContact C-N 3.34Å; Y206-V600 HydrophobicContact CD2-CG1 4.11Å; Y206-V600 HydrophobicContact CD2-CG2 4.48Å; Y206-V600 HydrophobicContact CG-CG1 4.42Å; Y206-M603 HydrophobicContact CD2-CB 4.44Å; Y206-M603 HydrophobicContact CE2-CB 3.74Å; Y206-M603 HydrophobicContact CE2-CE 3.67Å; Y206-M603 HydrophobicContact CE2-SD 4.09Å; Y206-M603 VanDerWaalsContact OH-CE 3.31Å; Y206-M603 WeakPolarHBondContact OH-CE 3.19Å; Y206-I604 HydrophobicContact CD2-CG1 4.19Å
207	E	93	Very high	92.5	Very high	149 Å²	149	31.1 Å²	31.1	70%	0.696	17%	0.165	S	C	*	.	H	α-helix	trans	-74.2	-31.7	178.1	-65.6	-179.3	176.2	0	0	112.5	G203	G203-E207 PolarHBondContact O-N 3.34Å
208	N	95.3	Very high	93.1	Very high	44 Å²	44	28.1 Å²	28.1	24%	0.235	15%	0.149	C	C	.	.			trans	-131.5	79.5	-173.7	-54.7	-80.9	0	0	0	110.9	I185 I204 L205 Y210 H211	I185-N208 HydrophobicContact CD1-CB 4.32Å; I185-N208 VanDerWaalsContact CD1-CG 3.49Å; I185-N208 WeakPolarHBondContact CD1-OD1 3.46Å; I185-N208 HydrophobicContact CG2-CB 4.25Å; I204-N208 WeakPolarHBondContact O-CA 3.47Å; I204-N208 WeakPolarHBondContact O-CB 3.17Å; I204-N208 PolarHBondContact O-N 3.44Å; I204-N208 PolarHBondContact O-ND2 3.46Å; L205-N208 CarbonylContact O-C 3.2Å; L205-N208 PolarHBondContact O-N 2.88Å; N208-Y210 PolarHBondContact O-N 3.5Å; N208-H211 HydrophobicContact CB-CB 4.21Å; N208-H211 PolarHBondContact O-N 3.14Å; N208-H211 VanDerWaalsContact O-N 3.12Å
209	P	95.5	Very high	93.8	Very high	27 Å²	27	26.5 Å²	26.5	18%	0.175	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-13.8	-172.4	-27.2	36.1	0	0	0	115.8	P157 L205 R237 I604	P157-P209 HydrophobicContact CG-CB 3.91Å; P157-P209 HydrophobicContact CG-CG 4.03Å; L205-P209 VanDerWaalsContact O-CA 3.27Å; L205-P209 WeakPolarHBondContact O-CA 3.39Å; L205-P209 VanDerWaalsContact O-N 3.17Å; P209-R237 WeakPolarHBondContact O-CD 3.44Å; P209-I604 HydrophobicContact CB-CG2 4.09Å; P209-I604 HydrophobicContact CG-CG2 4.04Å
210	Y	96.7	Very high	94.1	Very high	10 Å²	10	25 Å²	25	4%	0.039	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	16.5	-175.7	-68.4	-62.9	0	0	0	113.9	P157 T159 I162 N208 I212 R237 H240 A241	P157-Y210 HydrophobicContact CB-CE2 4.18Å; P157-Y210 WeakPolarHBondContact O-CE2 3.19Å; P157-Y210 PolarHBondContact O-OH 2.97Å; T159-Y210 HydrophobicContact CG2-CD2 4.23Å; T159-Y210 HydrophobicContact CG2-CE1 4Å; T159-Y210 HydrophobicContact CG2-CE2 3.71Å; I162-Y210 HydrophobicContact CG2-CD2 3.52Å; I162-Y210 HydrophobicContact CG2-CE2 4.38Å; I162-Y210 HydrophobicContact CG2-CG 3.92Å; N208-Y210 PolarHBondContact O-N 3.5Å; Y210-I212 PolarHBondContact O-N 2.88Å; Y210-R237 HydrophobicContact CD1-CG 3.95Å; Y210-R237 HydrophobicContact CE1-CG 3.58Å; Y210-H240 AromaticContact CE1-CD2 3.93Å; Y210-A241 HydrophobicContact CD1-CB 3.8Å; Y210-A241 HydrophobicContact CG-CB 4.39Å
211	H	97	Very high	94.2	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	12%	0.121	C	C	.	.			trans	-70.1	110.8	171.2	-176	-107.6	0	0	0	110.8	Y182 I185 Q186 F189 N208 D213 S214 L215	Y182-H211 AromaticContact CE1-CD2 3.92Å; Y182-H211 AromaticContact CE2-CD2 3.97Å; Y182-H211 AromaticContact CZ-CD2 3.55Å; Y182-H211 PolarHBondContact OH-CD2 3.03Å; I185-H211 HydrophobicContact CG2-CB 4.32Å; Q186-H211 PolarHBondContact OE1-NE2 3.42Å; Q186-H211 VanDerWaalsContact OE1-NE2 3.09Å; F189-H211 AromaticContact CD2-CE1 3.95Å; F189-H211 AromaticContact CG-CE1 3.6Å; N208-H211 HydrophobicContact CB-CB 4.21Å; N208-H211 PolarHBondContact O-N 3.14Å; N208-H211 VanDerWaalsContact O-N 3.12Å; H211-D213 PolarHBondContact O-N 2.66Å; H211-S214 WeakPolarHBondContact ND1-CB 3.48Å; H211-S214 PolarHBondContact ND1-N 3.24Å; H211-S214 PolarHBondContact ND1-OG 3.19Å; H211-S214 PolarHBondContact O-N 3.41Å; H211-L215 WeakPolarHBondContact O-CG 3.32Å; H211-L215 PolarHBondContact O-N 3.22Å
212	I	97.7	Very high	94.4	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.015	12%	0.119	C	C	.	.	H	α-helix	trans	-57.9	-53.2	-168.9	-61	-59.6	0	0	0	112.5	L164 Y182 Y210 S214 L215 L216 A241 F242	L164-I212 HydrophobicContact CD2-CD1 4.11Å; L164-I212 HydrophobicContact CD2-CG1 4.06Å; Y182-I212 WeakPolarHBondContact OH-CB 3.48Å; Y182-I212 WeakPolarHBondContact OH-CG1 3.49Å; Y182-I212 PolarHBondContact OH-N 2.85Å; Y210-I212 PolarHBondContact O-N 2.88Å; I212-S214 VanDerWaalsContact C-N 3.28Å; I212-S214 PolarHBondContact O-N 3.36Å; I212-L215 WeakPolarHBondContact O-CB 3.34Å; I212-L215 PolarHBondContact O-N 3.04Å; I212-L215 VanDerWaalsContact O-N 3.1Å; I212-L216 HydrophobicContact CG2-CD1 3.9Å; I212-L216 HydrophobicContact CG2-CG 4.29Å; I212-L216 WeakPolarHBondContact O-CG 3.49Å; I212-L216 PolarHBondContact O-N 3.27Å; I212-A241 HydrophobicContact CD1-CB 3.56Å; I212-F242 HydrophobicContact CB-CZ 4.31Å; I212-F242 HydrophobicContact CD1-CD1 4.42Å; I212-F242 HydrophobicContact CD1-CD2 3.97Å; I212-F242 HydrophobicContact CD1-CE1 4.34Å; I212-F242 HydrophobicContact CD1-CE2 3.86Å; I212-F242 HydrophobicContact CD1-CG 4.27Å; I212-F242 HydrophobicContact CD1-CZ 4.07Å; I212-F242 HydrophobicContact CG1-CE1 4.18Å; I212-F242 HydrophobicContact CG1-CE2 4.17Å; I212-F242 HydrophobicContact CG1-CZ 3.92Å; I212-F242 HydrophobicContact CG2-CE2 3.55Å; I212-F242 HydrophobicContact CG2-CZ 3.51Å
213	D	95.9	Very high	94.5	Very high	7 Å²	7	25.2 Å²	25.2	4%	0.037	13%	0.129	C	C	.	.	H	α-helix	trans	-69.4	-30.6	-173.4	-72.3	-0.2	0	0	0	111.5	Q186 F189 H211 Q217 F515	Q186-D213 PolarHBondContact NE2-OD2 3.19Å; Q186-D213 PolarHBondContact OE1-OD2 3.32Å; F189-D213 HydrophobicContact CD1-CB 4.08Å; F189-D213 HydrophobicContact CE1-CB 3.51Å; F189-D213 HydrophobicContact CE2-CB 4.3Å; F189-D213 HydrophobicContact CZ-CB 3.65Å; H211-D213 PolarHBondContact O-N 2.66Å; D213-Q217 VanDerWaalsContact O-CB 3.26Å; D213-Q217 WeakPolarHBondContact O-CB 3.39Å; D213-Q217 PolarHBondContact O-N 3.39Å; D213-F515 HydrophobicContact CB-CD2 4.11Å; D213-F515 HydrophobicContact CB-CE2 4.48Å; D213-F515 HydrophobicContact CB-CG 4.46Å
214	S	95.3	Very high	94.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.7	-46.6	169.6	-68.5	0	0	0	0	111.1	F189 I204 H211 I212 L216 Q217 L218	F189-S214 VanDerWaalsContact CD2-OG 3.32Å; F189-S214 WeakPolarHBondContact CD2-OG 3.34Å; I204-S214 WeakPolarHBondContact CG2-OG 3.42Å; H211-S214 WeakPolarHBondContact ND1-CB 3.48Å; H211-S214 PolarHBondContact ND1-N 3.24Å; H211-S214 PolarHBondContact ND1-OG 3.19Å; H211-S214 PolarHBondContact O-N 3.41Å; I212-S214 VanDerWaalsContact C-N 3.28Å; I212-S214 PolarHBondContact O-N 3.36Å; S214-L216 VanDerWaalsContact C-N 3.35Å; S214-L216 PolarHBondContact O-N 2.88Å; S214-Q217 PolarHBondContact O-N 2.83Å; S214-L218 WeakPolarHBondContact O-CB 3.39Å; S214-L218 WeakPolarHBondContact O-CD1 3.48Å; S214-L218 WeakPolarHBondContact O-CG 3.28Å; S214-L218 PolarHBondContact O-N 3.36Å
215	L	97.2	Very high	94.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.5	-45.3	177.7	-71.6	168.5	0	0	0	111.7	L205 H211 I212 S219 L234 R237 A238	L205-L215 HydrophobicContact CD1-CD2 3.47Å; L205-L215 VanDerWaalsContact CD1-CD2 3.47Å; L205-L215 HydrophobicContact CD1-CG 3.87Å; L205-L215 HydrophobicContact CD2-CD2 4.31Å; H211-L215 WeakPolarHBondContact O-CG 3.32Å; H211-L215 PolarHBondContact O-N 3.22Å; I212-L215 WeakPolarHBondContact O-CB 3.34Å; I212-L215 PolarHBondContact O-N 3.04Å; I212-L215 VanDerWaalsContact O-N 3.1Å; L215-S219 WeakPolarHBondContact O-CB 3.16Å; L215-S219 PolarHBondContact O-N 3.08Å; L215-L234 HydrophobicContact CD2-CB 4.41Å; L215-L234 HydrophobicContact CD2-CD2 3.72Å; L215-R237 HydrophobicContact CD1-CB 4.44Å; L215-R237 HydrophobicContact CD1-CG 4.33Å; L215-R237 HydrophobicContact CD2-CB 4.25Å; L215-R237 HydrophobicContact CD2-CG 4.33Å; L215-A238 HydrophobicContact CB-CB 3.98Å; L215-A238 HydrophobicContact CD1-CB 4.04Å
216	L	96.7	Very high	94.1	Very high	3 Å²	3	39 Å²	39	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-66.6	-46	179.5	-66.9	178.8	0	0	0	112	I212 S214 S219 E220 L235 A238 V271 A272 F515	I212-L216 HydrophobicContact CG2-CD1 3.9Å; I212-L216 HydrophobicContact CG2-CG 4.29Å; I212-L216 WeakPolarHBondContact O-CG 3.49Å; I212-L216 PolarHBondContact O-N 3.27Å; S214-L216 VanDerWaalsContact C-N 3.35Å; S214-L216 PolarHBondContact O-N 2.88Å; L216-S219 WeakPolarHBondContact O-CB 3.46Å; L216-S219 PolarHBondContact O-N 3.18Å; L216-E220 PolarHBondContact O-N 3.4Å; L216-E220 VanDerWaalsContact O-N 3.11Å; L216-L235 HydrophobicContact CD2-CD1 3.85Å; L216-A238 HydrophobicContact CD2-CB 4.2Å; L216-V271 HydrophobicContact CD1-CG1 4.49Å; L216-A272 HydrophobicContact CD2-CB 3.91Å; L216-F515 HydrophobicContact CB-CB 3.76Å; L216-F515 HydrophobicContact CD1-CB 4.25Å
217	Q	93.8	Very high	94.1	Very high	21 Å²	21	35 Å²	35	10%	0.098	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-41.7	-179.9	-173.7	59.6	77.2	0	0	111.9	F189 L193 L201 D213 S214 E220 I221 F515	F189-Q217 HydrophobicContact CE2-CB 4.25Å; F189-Q217 HydrophobicContact CZ-CB 4.21Å; L193-Q217 HydrophobicContact CD2-CG 4.08Å; L201-Q217 HydrophobicContact CD1-CG 3.81Å; D213-Q217 VanDerWaalsContact O-CB 3.26Å; D213-Q217 WeakPolarHBondContact O-CB 3.39Å; D213-Q217 PolarHBondContact O-N 3.39Å; S214-Q217 PolarHBondContact O-N 2.83Å; Q217-E220 PolarHBondContact NE2-OE2 3.14Å; Q217-E220 PolarHBondContact O-N 3.03Å; Q217-I221 HydrophobicContact CG-CD1 4.17Å; Q217-I221 VanDerWaalsContact O-CG1 3.27Å; Q217-I221 WeakPolarHBondContact O-CG1 3.43Å; Q217-I221 PolarHBondContact O-N 3.22Å; Q217-I221 VanDerWaalsContact O-N 3.09Å; Q217-F515 HydrophobicContact CB-CD1 4.18Å; Q217-F515 VanDerWaalsContact OE1-CD1 3.22Å
218	L	93.8	Very high	94.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-69.1	-37.5	177.3	-69.7	170.6	0	0	0	111.7	L201 L205 S214 E220 I221 M222 L234 F593 L597	L201-L218 HydrophobicContact CB-CD1 4.47Å; L201-L218 HydrophobicContact CB-CD2 3.88Å; L201-L218 HydrophobicContact CB-CG 4.25Å; L205-L218 HydrophobicContact CB-CD1 3.8Å; L205-L218 HydrophobicContact CD2-CD1 3.55Å; L205-L218 HydrophobicContact CG-CD1 4.21Å; S214-L218 WeakPolarHBondContact O-CB 3.39Å; S214-L218 WeakPolarHBondContact O-CD1 3.48Å; S214-L218 WeakPolarHBondContact O-CG 3.28Å; S214-L218 PolarHBondContact O-N 3.36Å; L218-E220 VanDerWaalsContact C-N 3.33Å; L218-E220 PolarHBondContact O-N 3.39Å; L218-I221 HydrophobicContact CD2-CD1 4.5Å; L218-I221 PolarHBondContact O-N 2.88Å; L218-M222 VanDerWaalsContact O-CG 3.31Å; L218-M222 WeakPolarHBondContact O-CG 3.27Å; L218-M222 PolarHBondContact O-N 2.53Å; L218-L234 HydrophobicContact CB-CD1 3.87Å; L218-F593 HydrophobicContact CD2-CE1 4.35Å; L218-F593 HydrophobicContact CD2-CE2 4.36Å; L218-F593 HydrophobicContact CD2-CZ 3.5Å; L218-F593 VanDerWaalsContact CD2-CZ 3.5Å; L218-L597 HydrophobicContact CB-CD2 4.45Å; L218-L597 HydrophobicContact CD1-CD1 4.18Å; L218-L597 HydrophobicContact CD2-CD1 4.48Å; L218-L597 HydrophobicContact CD2-CD2 4.3Å
219	S	95.6	Very high	94	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.014	17%	0.17	C	C	.	.	H	α-helix	trans	-55.3	-50.3	172.6	177.5	0	0	0	0	110.7	L215 L216 I221 M222 M223 G231	L215-S219 WeakPolarHBondContact O-CB 3.16Å; L215-S219 PolarHBondContact O-N 3.08Å; L216-S219 WeakPolarHBondContact O-CB 3.46Å; L216-S219 PolarHBondContact O-N 3.18Å; S219-I221 PolarHBondContact O-N 3.16Å; S219-M222 PolarHBondContact O-N 3.12Å; S219-M223 VanDerWaalsContact O-CG 3.3Å; S219-M223 WeakPolarHBondContact O-CG 3.26Å; S219-M223 PolarHBondContact O-N 3.41Å; S219-G231 WeakPolarHBondContact CB-O 3.39Å; S219-G231 PolarHBondContact OG-O 3.32Å
220	E	91.8	Very high	94	Very high	27 Å²	27	32.7 Å²	32.7	13%	0.126	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-46.7	177.4	-176.8	-169.7	-171.5	0	0	112.5	L216 Q217 L218 M222 M223 H224 R275 A514	L216-E220 PolarHBondContact O-N 3.4Å; L216-E220 VanDerWaalsContact O-N 3.11Å; Q217-E220 PolarHBondContact NE2-OE2 3.14Å; Q217-E220 PolarHBondContact O-N 3.03Å; L218-E220 VanDerWaalsContact C-N 3.33Å; L218-E220 PolarHBondContact O-N 3.39Å; E220-M222 VanDerWaalsContact C-N 3.26Å; E220-M222 PolarHBondContact O-N 2.99Å; E220-M223 PolarHBondContact O-N 3.32Å; E220-M223 VanDerWaalsContact O-N 3.16Å; E220-H224 PolarHBondContact O-N 3.22Å; E220-H224 IonicContact OE1-CE1 3.14Å; E220-R275 IonicContact OE1-NH2 2.66Å; E220-A514 HydrophobicContact CG-CB 4.37Å; E220-A514 WeakPolarHBondContact OE1-CB 3.47Å; E220-A514 WeakPolarHBondContact OE2-CB 3.43Å
221	I	91.7	Very high	93.9	Very high	32 Å²	32	32.2 Å²	32.2	16%	0.164	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-40.9	179.2	-64.4	162.6	0	0	0	110.5	P198 L201 Q217 L218 S219 H224 Q225 F593	P198-I221 HydrophobicContact CB-CD1 4.46Å; L201-I221 HydrophobicContact CD1-CD1 4.16Å; Q217-I221 HydrophobicContact CG-CD1 4.17Å; Q217-I221 VanDerWaalsContact O-CG1 3.27Å; Q217-I221 WeakPolarHBondContact O-CG1 3.43Å; Q217-I221 PolarHBondContact O-N 3.22Å; Q217-I221 VanDerWaalsContact O-N 3.09Å; L218-I221 HydrophobicContact CD2-CD1 4.5Å; L218-I221 PolarHBondContact O-N 2.88Å; S219-I221 PolarHBondContact O-N 3.16Å; I221-H224 PolarHBondContact O-N 3.34Å; I221-Q225 VanDerWaalsContact O-CG 3.32Å; I221-Q225 WeakPolarHBondContact O-CG 3.36Å; I221-Q225 PolarHBondContact O-N 3.46Å; I221-F593 HydrophobicContact CB-CE1 4.46Å; I221-F593 HydrophobicContact CG2-CD1 4.12Å; I221-F593 HydrophobicContact CG2-CE1 3.62Å
222	M	93	Very high	93.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67.9	-38.3	176.9	-68.5	-59.9	105.2	0	0	112.7	L218 S219 E220 H224 Q225 E226 D227 V230 L234 F593 L597	L218-M222 VanDerWaalsContact O-CG 3.31Å; L218-M222 WeakPolarHBondContact O-CG 3.27Å; L218-M222 PolarHBondContact O-N 2.53Å; S219-M222 PolarHBondContact O-N 3.12Å; E220-M222 VanDerWaalsContact C-N 3.26Å; E220-M222 PolarHBondContact O-N 2.99Å; M222-H224 VanDerWaalsContact C-N 3.33Å; M222-H224 PolarHBondContact O-N 2.84Å; M222-Q225 CarbonylContact O-C 3.55Å; M222-Q225 PolarHBondContact O-N 3.01Å; M222-Q225 VanDerWaalsContact O-N 3.1Å; M222-E226 PolarHBondContact O-N 3.25Å; M222-D227 PolarHBondContact O-N 3.15Å; M222-D227 VanDerWaalsContact O-N 3.09Å; M222-V230 HydrophobicContact CG-CB 4.47Å; M222-V230 HydrophobicContact CG-CG1 3.98Å; M222-V230 HydrophobicContact SD-CG1 4.38Å; M222-L234 HydrophobicContact CG-CD1 4.17Å; M222-F593 HydrophobicContact CE-CD1 3.72Å; M222-F593 HydrophobicContact CE-CE1 3.3Å; M222-F593 HydrophobicContact CE-CZ 4.28Å; M222-L597 HydrophobicContact CE-CD2 3.7Å; M222-L597 HydrophobicContact CG-CD2 3.7Å; M222-L597 HydrophobicContact SD-CD2 3.67Å
223	M	92.2	Very high	93.7	Very high	47 Å²	47	33.2 Å²	33.2	23%	0.232	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-43.4	174.8	-66.4	-61.6	-175.5	0	0	111.4	S219 E220 Q225 E226 T228 G231 K279	S219-M223 VanDerWaalsContact O-CG 3.3Å; S219-M223 WeakPolarHBondContact O-CG 3.26Å; S219-M223 PolarHBondContact O-N 3.41Å; E220-M223 PolarHBondContact O-N 3.32Å; E220-M223 VanDerWaalsContact O-N 3.16Å; M223-Q225 PolarHBondContact O-N 3.18Å; M223-E226 PolarHBondContact O-N 3.07Å; M223-E226 VanDerWaalsContact O-N 3.08Å; M223-T228 HydrophobicContact SD-CG2 4.38Å; M223-G231 VanDerWaalsContact CE-C 3.41Å; M223-K279 HydrophobicContact CE-CD 3.74Å; M223-K279 HydrophobicContact CE-CG 4.35Å; M223-K279 HydrophobicContact SD-CD 4.27Å
224	H	89.4	Confident	93.8	Very high	119 Å²	119	32.9 Å²	32.9	55%	0.551	17%	0.168	S	C	*	.	H	α-helix	trans	-67.1	-20.1	175.8	-70.6	151.8	0	0	0	114	E220 I221 M222 E226 E495	E220-H224 PolarHBondContact O-N 3.22Å; E220-H224 IonicContact OE1-CE1 3.14Å; I221-H224 PolarHBondContact O-N 3.34Å; M222-H224 VanDerWaalsContact C-N 3.33Å; M222-H224 PolarHBondContact O-N 2.84Å; H224-E226 VanDerWaalsContact C-N 3.28Å; H224-E495 IonicContact NE2-OE2 3.47Å
225	Q	90.2	Very high	93.9	Very high	46 Å²	46	33 Å²	33	22%	0.215	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	10.5	174.3	-69.2	177.8	4.6	0	0	112.9	I221 M222 M223 D227 A590	I221-Q225 VanDerWaalsContact O-CG 3.32Å; I221-Q225 WeakPolarHBondContact O-CG 3.36Å; I221-Q225 PolarHBondContact O-N 3.46Å; M222-Q225 CarbonylContact O-C 3.55Å; M222-Q225 PolarHBondContact O-N 3.01Å; M222-Q225 VanDerWaalsContact O-N 3.1Å; M223-Q225 PolarHBondContact O-N 3.18Å; Q225-D227 PolarHBondContact O-N 2.88Å; Q225-A590 HydrophobicContact CG-CB 4.29Å; Q225-A590 VanDerWaalsContact NE2-CB 3.26Å
226	E	91.2	Very high	93.9	Very high	179 Å²	179	33.3 Å²	33.3	84%	0.836	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.2	4.4	-177.7	-54	175.3	-179.9	0	0	113.7	M222 M223 H224 T228	M222-E226 PolarHBondContact O-N 3.25Å; M223-E226 PolarHBondContact O-N 3.07Å; M223-E226 VanDerWaalsContact O-N 3.08Å; H224-E226 VanDerWaalsContact C-N 3.28Å; E226-T228 PolarHBondContact O-N 3.22Å
227	D	93.1	Very high	93.8	Very high	17 Å²	17	33.5 Å²	33.5	9%	0.091	17%	0.171	C	C	.	.			trans	-82.9	69.8	171	-165.6	-12.8	0	0	0	110.8	M222 Q225 T229 V230 G231 R598	M222-D227 PolarHBondContact O-N 3.15Å; M222-D227 VanDerWaalsContact O-N 3.09Å; Q225-D227 PolarHBondContact O-N 2.88Å; D227-T229 PolarHBondContact O-N 3.17Å; D227-T229 PolarHBondContact OD1-OG1 3.46Å; D227-V230 WeakPolarHBondContact OD1-CG2 3.39Å; D227-V230 PolarHBondContact OD1-N 3.13Å; D227-V230 VanDerWaalsContact OD2-CG2 3.27Å; D227-V230 WeakPolarHBondContact OD2-CG2 3.08Å; D227-G231 PolarHBondContact O-N 2.85Å; D227-R598 IonicContact OD2-CZ 3.7Å; D227-R598 VanDerWaalsContact OD2-CZ 3.28Å; D227-R598 IonicContact OD2-NE 2.81Å; D227-R598 PolarHBondContact OD2-NE 3.07Å; D227-R598 VanDerWaalsContact OD2-NE 3.14Å; D227-R598 IonicContact OD2-NH2 2.76Å; D227-R598 PolarHBondContact OD2-NH2 2.97Å
228	T	93.3	Very high	94	Very high	49 Å²	49	32.5 Å²	32.5	30%	0.301	17%	0.166	S	C	.	.	H	α-helix	trans	-62.9	-30.3	-179	-71.4	0	0	0	0	112.7	M223 E226 T232 K279	M223-T228 HydrophobicContact SD-CG2 4.38Å; E226-T228 PolarHBondContact O-N 3.22Å; T228-T232 VanDerWaalsContact O-CB 3.3Å; T228-T232 WeakPolarHBondContact O-CB 3.36Å; T228-T232 PolarHBondContact O-N 2.82Å; T228-T232 PolarHBondContact O-OG1 2.83Å; T228-K279 HydrophobicContact CG2-CD 4.09Å
229	T	93.1	Very high	94.2	Very high	105 Å²	105	32.5 Å²	32.5	64%	0.644	17%	0.166	S	C	*	.	H	α-helix	trans	-71	-49.2	-174.6	59.2	0	0	0	0	110.3	D227 T232 D233	D227-T229 PolarHBondContact O-N 3.17Å; D227-T229 PolarHBondContact OD1-OG1 3.46Å; T229-T232 PolarHBondContact O-N 3.12Å; T229-D233 PolarHBondContact O-N 3.1Å
230	V	94.7	Very high	94.2	Very high	19 Å²	19	33.3 Å²	33.3	12%	0.115	17%	0.17	C	C	.	.	H	α-helix	trans	-65.3	-44.2	174.6	178	0	0	0	0	110.6	M222 D227 T232 D233 L234 R598 L601	M222-V230 HydrophobicContact CG-CB 4.47Å; M222-V230 HydrophobicContact CG-CG1 3.98Å; M222-V230 HydrophobicContact SD-CG1 4.38Å; D227-V230 WeakPolarHBondContact OD1-CG2 3.39Å; D227-V230 PolarHBondContact OD1-N 3.13Å; D227-V230 VanDerWaalsContact OD2-CG2 3.27Å; D227-V230 WeakPolarHBondContact OD2-CG2 3.08Å; V230-T232 VanDerWaalsContact C-N 3.29Å; V230-T232 PolarHBondContact O-N 3Å; V230-D233 WeakPolarHBondContact O-CB 3.24Å; V230-D233 PolarHBondContact O-N 3.27Å; V230-D233 VanDerWaalsContact O-N 3.12Å; V230-L234 HydrophobicContact CG1-CD1 4.1Å; V230-L234 HydrophobicContact CG1-CG 4.44Å; V230-L234 WeakPolarHBondContact O-CG 3.44Å; V230-L234 PolarHBondContact O-N 3.28Å; V230-R598 HydrophobicContact CG2-CG 4.49Å; V230-L601 HydrophobicContact CG1-CD1 3.46Å; V230-L601 VanDerWaalsContact CG1-CD1 3.46Å
231	G	95.3	Very high	94.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-56.6	-42.5	176.8	0	0	0	0	0	112.7	S219 M223 D227 L235	S219-G231 WeakPolarHBondContact CB-O 3.39Å; S219-G231 PolarHBondContact OG-O 3.32Å; M223-G231 VanDerWaalsContact CE-C 3.41Å; D227-G231 PolarHBondContact O-N 2.85Å; G231-L235 PolarHBondContact O-N 2.9Å
232	T	95.6	Very high	94.7	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.018	16%	0.156	C	C	.	.	H	α-helix	trans	-69.4	-38.7	177	-52.6	0	0	0	0	111.5	T228 T229 V230 L234 L235 E236 K279	T228-T232 VanDerWaalsContact O-CB 3.3Å; T228-T232 WeakPolarHBondContact O-CB 3.36Å; T228-T232 PolarHBondContact O-N 2.82Å; T228-T232 PolarHBondContact O-OG1 2.83Å; T229-T232 PolarHBondContact O-N 3.12Å; V230-T232 VanDerWaalsContact C-N 3.29Å; V230-T232 PolarHBondContact O-N 3Å; T232-L234 PolarHBondContact O-N 2.61Å; T232-L235 PolarHBondContact O-N 3.21Å; T232-E236 HydrophobicContact CG2-CG 4.23Å; T232-E236 WeakPolarHBondContact O-CB 3.24Å; T232-E236 WeakPolarHBondContact O-CG 3.41Å; T232-E236 PolarHBondContact O-N 3.43Å; T232-K279 HydrophobicContact CG2-CG 4.09Å
233	D	95.7	Very high	94.8	Very high	21 Å²	21	32.3 Å²	32.3	11%	0.112	16%	0.164	C	C	.	.	H	α-helix	trans	-59.1	-45.7	176.6	-172.3	72.7	0	0	0	112.2	K153 W156 T229 V230 L235 E236 R237	K153-D233 WeakPolarHBondContact CD-OD1 3.36Å; K153-D233 WeakPolarHBondContact CE-OD1 3.44Å; K153-D233 IonicContact NZ-OD1 3.61Å; K153-D233 PolarHBondContact NZ-OD1 2.88Å; W156-D233 PolarHBondContact NE1-OD1 3.5Å; W156-D233 PolarHBondContact NE1-OD2 2.96Å; T229-D233 PolarHBondContact O-N 3.1Å; V230-D233 WeakPolarHBondContact O-CB 3.24Å; V230-D233 PolarHBondContact O-N 3.27Å; V230-D233 VanDerWaalsContact O-N 3.12Å; D233-L235 VanDerWaalsContact C-N 3.33Å; D233-L235 PolarHBondContact O-N 3.07Å; D233-E236 PolarHBondContact O-N 3.41Å; D233-R237 VanDerWaalsContact O-CB 3.31Å; D233-R237 WeakPolarHBondContact O-CB 3.33Å; D233-R237 PolarHBondContact O-N 3.41Å; D233-R237 IonicContact OD2-CZ 3.25Å; D233-R237 IonicContact OD2-NE 2.91Å; D233-R237 IonicContact OD2-NH2 3.14Å; D233-R237 PolarHBondContact OD2-NH2 2.75Å
234	L	96.9	Very high	94.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-40.8	177.5	-67.3	169	0	0	0	112	L205 L215 L218 M222 V230 T232 R237 A238 L597 L601	L205-L234 HydrophobicContact CD2-CD2 3.69Å; L215-L234 HydrophobicContact CD2-CB 4.41Å; L215-L234 HydrophobicContact CD2-CD2 3.72Å; L218-L234 HydrophobicContact CB-CD1 3.87Å; M222-L234 HydrophobicContact CG-CD1 4.17Å; V230-L234 HydrophobicContact CG1-CD1 4.1Å; V230-L234 HydrophobicContact CG1-CG 4.44Å; V230-L234 WeakPolarHBondContact O-CG 3.44Å; V230-L234 PolarHBondContact O-N 3.28Å; T232-L234 PolarHBondContact O-N 2.61Å; L234-R237 PolarHBondContact O-N 2.9Å; L234-A238 PolarHBondContact O-N 3.37Å; L234-L597 HydrophobicContact CD1-CD2 4.22Å; L234-L601 HydrophobicContact CD2-CD1 4.48Å; L234-L601 HydrophobicContact CD2-CD2 4.06Å
235	L	97.2	Very high	95.2	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-66.4	-44.4	177.4	-176	59.1	0	0	0	112.1	L216 G231 T232 D233 R237 A238 L239 A272 R275 Y276	L216-L235 HydrophobicContact CD2-CD1 3.85Å; G231-L235 PolarHBondContact O-N 2.9Å; T232-L235 PolarHBondContact O-N 3.21Å; D233-L235 VanDerWaalsContact C-N 3.33Å; D233-L235 PolarHBondContact O-N 3.07Å; L235-R237 VanDerWaalsContact C-N 3.31Å; L235-R237 PolarHBondContact O-N 3.26Å; L235-A238 WeakPolarHBondContact O-CB 3.36Å; L235-A238 PolarHBondContact O-N 2.89Å; L235-L239 PolarHBondContact O-N 3.33Å; L235-L239 VanDerWaalsContact O-N 3.13Å; L235-A272 HydrophobicContact CD1-CB 4.19Å; L235-R275 HydrophobicContact CD1-CB 4.24Å; L235-R275 HydrophobicContact CD2-CB 3.93Å; L235-Y276 HydrophobicContact CD2-CD2 4.04Å; L235-Y276 HydrophobicContact CG-CD2 4.28Å
236	E	97	Very high	95.5	Very high	8 Å²	8	26.6 Å²	26.6	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-63.9	-38.5	174.7	-70.9	178	156.1	0	0	111.1	H117 V150 K153 W156 T232 D233 A238 L239 H240 Y276	H117-E236 IonicContact CE1-OE1 3.78Å; V150-E236 HydrophobicContact CG1-CB 4.41Å; V150-E236 HydrophobicContact CG1-CG 4.21Å; V150-E236 WeakPolarHBondContact CG2-O 3.44Å; K153-E236 WeakPolarHBondContact CE-OE2 3.46Å; K153-E236 IonicContact NZ-OE2 3.55Å; K153-E236 PolarHBondContact NZ-OE2 2.84Å; W156-E236 HydrophobicContact CH2-CB 3.79Å; W156-E236 HydrophobicContact CZ2-CB 3.88Å; T232-E236 HydrophobicContact CG2-CG 4.23Å; T232-E236 WeakPolarHBondContact O-CB 3.24Å; T232-E236 WeakPolarHBondContact O-CG 3.41Å; T232-E236 PolarHBondContact O-N 3.43Å; D233-E236 PolarHBondContact O-N 3.41Å; E236-A238 VanDerWaalsContact C-N 3.32Å; E236-A238 PolarHBondContact O-N 3.44Å; E236-L239 PolarHBondContact O-N 3.36Å; E236-H240 WeakPolarHBondContact O-CB 3.4Å; E236-H240 PolarHBondContact O-N 2.97Å; E236-Y276 HydrophobicContact CG-CD2 4.25Å; E236-Y276 HydrophobicContact CG-CE2 3.44Å; E236-Y276 VanDerWaalsContact CG-CE2 3.44Å; E236-Y276 WeakPolarHBondContact OE1-CE2 3.21Å; E236-Y276 PolarHBondContact OE1-OH 3.41Å
237	R	96.3	Very high	95.7	Very high	6 Å²	6	21.1 Å²	21.1	2%	0.023	12%	0.118	C	C	.	.	H	α-helix	trans	-63	-37.4	175.1	-164.4	-179.5	-55.9	-174.6	1.4	112.1	W156 P209 Y210 L215 D233 L234 L235 H240 A241	W156-R237 HydrophobicContact CD2-CG 4.31Å; W156-R237 HydrophobicContact CZ2-CB 4.16Å; P209-R237 WeakPolarHBondContact O-CD 3.44Å; Y210-R237 HydrophobicContact CD1-CG 3.95Å; Y210-R237 HydrophobicContact CE1-CG 3.58Å; L215-R237 HydrophobicContact CD1-CB 4.44Å; L215-R237 HydrophobicContact CD1-CG 4.33Å; L215-R237 HydrophobicContact CD2-CB 4.25Å; L215-R237 HydrophobicContact CD2-CG 4.33Å; D233-R237 VanDerWaalsContact O-CB 3.31Å; D233-R237 WeakPolarHBondContact O-CB 3.33Å; D233-R237 PolarHBondContact O-N 3.41Å; D233-R237 IonicContact OD2-CZ 3.25Å; D233-R237 IonicContact OD2-NE 2.91Å; D233-R237 IonicContact OD2-NH2 3.14Å; D233-R237 PolarHBondContact OD2-NH2 2.75Å; L234-R237 PolarHBondContact O-N 2.9Å; L235-R237 VanDerWaalsContact C-N 3.31Å; L235-R237 PolarHBondContact O-N 3.26Å; R237-H240 WeakPolarHBondContact O-CB 3.25Å; R237-H240 PolarHBondContact O-N 3.45Å; R237-A241 WeakPolarHBondContact O-CB 3.25Å; R237-A241 PolarHBondContact O-N 3.47Å
238	A	97.7	Very high	95.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-44.6	173.9	0	0	0	0	0	111.7	L215 L216 L234 L235 E236 H240 A241 F242	L215-A238 HydrophobicContact CB-CB 3.98Å; L215-A238 HydrophobicContact CD1-CB 4.04Å; L216-A238 HydrophobicContact CD2-CB 4.2Å; L234-A238 PolarHBondContact O-N 3.37Å; L235-A238 WeakPolarHBondContact O-CB 3.36Å; L235-A238 PolarHBondContact O-N 2.89Å; E236-A238 VanDerWaalsContact C-N 3.32Å; E236-A238 PolarHBondContact O-N 3.44Å; A238-H240 VanDerWaalsContact C-N 3.3Å; A238-H240 PolarHBondContact O-N 3.36Å; A238-A241 WeakPolarHBondContact O-CB 3.25Å; A238-A241 PolarHBondContact O-N 2.97Å; A238-F242 VanDerWaalsContact O-CD2 3.28Å; A238-F242 WeakPolarHBondContact O-CD2 3.44Å; A238-F242 PolarHBondContact O-N 3.49Å
239	L	97.4	Very high	95.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.1	-38.7	174.2	-69	174.3	0	0	0	111.8	V150 L235 E236 F242 Q243 L269 A272 L273 Y276	V150-L239 HydrophobicContact CG1-CB 4.09Å; V150-L239 HydrophobicContact CG1-CD1 3.79Å; V150-L239 HydrophobicContact CG2-CB 4.21Å; L235-L239 PolarHBondContact O-N 3.33Å; L235-L239 VanDerWaalsContact O-N 3.13Å; E236-L239 PolarHBondContact O-N 3.36Å; L239-F242 PolarHBondContact O-N 3.1Å; L239-Q243 WeakPolarHBondContact O-CB 2.96Å; L239-Q243 PolarHBondContact O-N 2.88Å; L239-L269 HydrophobicContact CD2-CD1 4.08Å; L239-A272 HydrophobicContact CD2-CB 3.66Å; L239-A272 HydrophobicContact CG-CB 4.21Å; L239-L273 HydrophobicContact CD2-CD2 3.82Å; L239-L273 HydrophobicContact CD2-CG 4.08Å; L239-Y276 HydrophobicContact CD1-CD1 3.87Å; L239-Y276 HydrophobicContact CD1-CD2 4.09Å; L239-Y276 HydrophobicContact CD1-CE1 4.43Å; L239-Y276 HydrophobicContact CD1-CG 3.67Å
240	H	96.2	Very high	95.8	Very high	19 Å²	19	22.7 Å²	22.7	9%	0.088	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-44.2	174.6	-179.9	52.9	0	0	0	112.2	V150 V152 W156 T159 Y210 E236 R237 A238 F242 Q243 S244	V150-H240 HydrophobicContact CG2-CB 4.1Å; V152-H240 VanDerWaalsContact CG2-CE1 3.46Å; V152-H240 WeakPolarHBondContact CG2-CE1 3.32Å; W156-H240 HydrophobicContact CE3-CB 4.11Å; W156-H240 AromaticContact CE3-CD2 3.72Å; W156-H240 AromaticContact CE3-CG 3.93Å; W156-H240 HydrophobicContact CH2-CB 4.25Å; W156-H240 HydrophobicContact CZ3-CB 3.53Å; W156-H240 AromaticContact CZ3-CD2 3.99Å; W156-H240 AromaticContact CZ3-CG 3.7Å; T159-H240 WeakPolarHBondContact CG2-NE2 3.07Å; Y210-H240 AromaticContact CE1-CD2 3.93Å; E236-H240 WeakPolarHBondContact O-CB 3.4Å; E236-H240 PolarHBondContact O-N 2.97Å; R237-H240 WeakPolarHBondContact O-CB 3.25Å; R237-H240 PolarHBondContact O-N 3.45Å; A238-H240 VanDerWaalsContact C-N 3.3Å; A238-H240 PolarHBondContact O-N 3.36Å; H240-F242 PolarHBondContact O-N 3.43Å; H240-Q243 PolarHBondContact O-N 2.87Å; H240-S244 WeakPolarHBondContact O-CB 3.2Å; H240-S244 PolarHBondContact O-N 2.83Å
241	A	96.6	Very high	95.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.1	-48.7	176.2	0	0	0	0	0	111.1	I162 Y210 I212 R237 A238 Q243 S244 A245	I162-A241 HydrophobicContact CD1-CB 4.39Å; Y210-A241 HydrophobicContact CD1-CB 3.8Å; Y210-A241 HydrophobicContact CG-CB 4.39Å; I212-A241 HydrophobicContact CD1-CB 3.56Å; R237-A241 WeakPolarHBondContact O-CB 3.25Å; R237-A241 PolarHBondContact O-N 3.47Å; A238-A241 WeakPolarHBondContact O-CB 3.25Å; A238-A241 PolarHBondContact O-N 2.97Å; A241-Q243 PolarHBondContact O-N 3.42Å; A241-S244 PolarHBondContact O-N 3.25Å; A241-S244 PolarHBondContact O-OG 3.49Å; A241-A245 PolarHBondContact O-N 2.64Å
242	F	97.4	Very high	95.6	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.009	15%	0.145	C	C	.	.	H	α-helix	trans	-58.8	-47.2	174.7	-80	-57.7	0	0	0	112.3	L164 F176 I212 A238 L239 H240 S244 A245 F246 G268 L269	L164-F242 HydrophobicContact CD2-CD1 3.85Å; L164-F242 HydrophobicContact CD2-CE1 4.18Å; F176-F242 HydrophobicContact CD1-CD1 4.1Å; F176-F242 HydrophobicContact CD1-CE1 4.41Å; F176-F242 HydrophobicContact CD2-CD1 4.24Å; F176-F242 HydrophobicContact CD2-CE1 4.06Å; F176-F242 AromaticContact CE1-CD1 3.55Å; F176-F242 HydrophobicContact CE1-CD1 3.55Å; F176-F242 HydrophobicContact CE1-CE1 4.24Å; F176-F242 AromaticContact CE2-CD1 3.7Å; F176-F242 HydrophobicContact CE2-CD1 3.7Å; F176-F242 AromaticContact CE2-CE1 3.87Å; F176-F242 HydrophobicContact CE2-CE1 3.87Å; F176-F242 HydrophobicContact CG-CD1 4.42Å; F176-F242 HydrophobicContact CG-CE1 4.32Å; F176-F242 HydrophobicContact CZ-CB 4.24Å; F176-F242 AromaticContact CZ-CD1 3.31Å; F176-F242 HydrophobicContact CZ-CD1 3.31Å; F176-F242 AromaticContact CZ-CE1 3.96Å; F176-F242 HydrophobicContact CZ-CE1 3.96Å; F176-F242 HydrophobicContact CZ-CG 4.14Å; I212-F242 HydrophobicContact CB-CZ 4.31Å; I212-F242 HydrophobicContact CD1-CD1 4.42Å; I212-F242 HydrophobicContact CD1-CD2 3.97Å; I212-F242 HydrophobicContact CD1-CE1 4.34Å; I212-F242 HydrophobicContact CD1-CE2 3.86Å; I212-F242 HydrophobicContact CD1-CG 4.27Å; I212-F242 HydrophobicContact CD1-CZ 4.07Å; I212-F242 HydrophobicContact CG1-CE1 4.18Å; I212-F242 HydrophobicContact CG1-CE2 4.17Å; I212-F242 HydrophobicContact CG1-CZ 3.92Å; I212-F242 HydrophobicContact CG2-CE2 3.55Å; I212-F242 HydrophobicContact CG2-CZ 3.51Å; A238-F242 VanDerWaalsContact O-CD2 3.28Å; A238-F242 WeakPolarHBondContact O-CD2 3.44Å; A238-F242 PolarHBondContact O-N 3.49Å; L239-F242 PolarHBondContact O-N 3.1Å; H240-F242 PolarHBondContact O-N 3.43Å; F242-S244 VanDerWaalsContact C-N 3.26Å; F242-S244 PolarHBondContact O-N 3.39Å; F242-A245 PolarHBondContact O-N 3.41Å; F242-F246 HydrophobicContact CB-CE1 4.32Å; F242-F246 WeakPolarHBondContact O-CD1 2.96Å; F242-F246 WeakPolarHBondContact O-CE1 3.46Å; F242-F246 PolarHBondContact O-N 3.2Å; F242-G268 VanDerWaalsContact CE2-C 3.5Å; F242-L269 HydrophobicContact CB-CD1 4.02Å; F242-L269 HydrophobicContact CD1-CB 4.29Å; F242-L269 HydrophobicContact CD2-CB 4.04Å; F242-L269 HydrophobicContact CD2-CD1 3.81Å; F242-L269 HydrophobicContact CE1-CB 4.14Å; F242-L269 VanDerWaalsContact CE2-CA 3.49Å; F242-L269 HydrophobicContact CE2-CB 3.89Å; F242-L269 HydrophobicContact CE2-CD1 4.44Å; F242-L269 VanDerWaalsContact CE2-N 3.34Å; F242-L269 HydrophobicContact CG-CB 4.23Å; F242-L269 HydrophobicContact CG-CD1 3.97Å; F242-L269 HydrophobicContact CZ-CB 3.92Å
243	Q	95.2	Very high	95.6	Very high	36 Å²	36	25.4 Å²	25.4	17%	0.168	15%	0.146	C	C	.	.	H	α-helix	trans	-61.1	-36.5	179.4	-160.9	-159.2	-46.8	0	0	112.3	M148 L149 L239 H240 A241 A245 F246	M148-Q243 VanDerWaalsContact N-CD 3.31Å; L149-Q243 HydrophobicContact CD1-CB 4.15Å; L149-Q243 HydrophobicContact CD1-CG 4.39Å; L149-Q243 HydrophobicContact CG-CG 4.29Å; L149-Q243 VanDerWaalsContact N-OE1 3.09Å; L239-Q243 WeakPolarHBondContact O-CB 2.96Å; L239-Q243 PolarHBondContact O-N 2.88Å; H240-Q243 PolarHBondContact O-N 2.87Å; A241-Q243 PolarHBondContact O-N 3.42Å; Q243-A245 PolarHBondContact O-N 2.76Å; Q243-F246 HydrophobicContact CB-CD2 4.47Å; Q243-F246 HydrophobicContact CB-CE2 4.29Å; Q243-F246 HydrophobicContact CG-CD2 3.95Å; Q243-F246 HydrophobicContact CG-CE2 3.89Å; Q243-F246 WeakPolarHBondContact O-CB 3.24Å; Q243-F246 PolarHBondContact O-N 2.95Å
244	S	94.5	Very high	95.4	Very high	50 Å²	50	27.1 Å²	27.1	35%	0.35	16%	0.155	S	C	.	.	H	α-helix	trans	-68	-25.2	177.9	78.2	0	0	0	0	112.7	I162 H240 A241 F242	I162-S244 VanDerWaalsContact CD1-OG 3.31Å; I162-S244 WeakPolarHBondContact CD1-OG 3.31Å; H240-S244 WeakPolarHBondContact O-CB 3.2Å; H240-S244 PolarHBondContact O-N 2.83Å; A241-S244 PolarHBondContact O-N 3.25Å; A241-S244 PolarHBondContact O-OG 3.49Å; F242-S244 VanDerWaalsContact C-N 3.26Å; F242-S244 PolarHBondContact O-N 3.39Å
245	A	95.6	Very high	94.9	Very high	8 Å²	8	27.1 Å²	27.1	7%	0.066	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-2.4	178	0	0	0	0	0	114	L164 M166 F176 A241 F242 Q243 H247	L164-A245 HydrophobicContact CB-CB 4.13Å; L164-A245 HydrophobicContact CD2-CB 3.89Å; L164-A245 HydrophobicContact CG-CB 3.61Å; L164-A245 WeakPolarHBondContact O-CB 3.35Å; M166-A245 WeakPolarHBondContact CB-O 3.48Å; M166-A245 PolarHBondContact N-O 3.48Å; F176-A245 HydrophobicContact CD1-CB 4.42Å; F176-A245 HydrophobicContact CE1-CB 4.18Å; A241-A245 PolarHBondContact O-N 2.64Å; F242-A245 PolarHBondContact O-N 3.41Å; Q243-A245 PolarHBondContact O-N 2.76Å; A245-H247 PolarHBondContact O-N 3.23Å
246	F	95.7	Very high	94.5	Very high	35 Å²	35	29.6 Å²	29.6	15%	0.154	17%	0.173	C	C	.	.			trans	-60.6	133.9	179	-72.4	-6.8	0	0	0	111.7	L149 M166 F176 F242 Q243 F250 P252 L269	L149-F246 HydrophobicContact CD1-CE2 4.17Å; L149-F246 HydrophobicContact CD1-CZ 3.88Å; M166-F246 HydrophobicContact CE-CD1 3.57Å; M166-F246 HydrophobicContact CE-CE1 4.07Å; M166-F246 HydrophobicContact CE-CG 4.46Å; F176-F246 HydrophobicContact CE1-CD1 4.33Å; F176-F246 HydrophobicContact CE1-CE1 4.49Å; F176-F246 HydrophobicContact CZ-CD1 4.2Å; F176-F246 AromaticContact CZ-CE1 3.96Å; F176-F246 HydrophobicContact CZ-CE1 3.96Å; F242-F246 HydrophobicContact CB-CE1 4.32Å; F242-F246 WeakPolarHBondContact O-CD1 2.96Å; F242-F246 WeakPolarHBondContact O-CE1 3.46Å; F242-F246 PolarHBondContact O-N 3.2Å; Q243-F246 HydrophobicContact CB-CD2 4.47Å; Q243-F246 HydrophobicContact CB-CE2 4.29Å; Q243-F246 HydrophobicContact CG-CD2 3.95Å; Q243-F246 HydrophobicContact CG-CE2 3.89Å; Q243-F246 WeakPolarHBondContact O-CB 3.24Å; Q243-F246 PolarHBondContact O-N 2.95Å; F246-F250 HydrophobicContact CB-CD1 4.04Å; F246-F250 AromaticContact CD1-CD1 3.75Å; F246-F250 HydrophobicContact CD1-CD1 3.75Å; F246-F250 AromaticContact CD1-CE1 3.82Å; F246-F250 HydrophobicContact CD1-CE1 3.82Å; F246-F250 AromaticContact CD2-CD1 3.84Å; F246-F250 HydrophobicContact CD2-CD1 3.84Å; F246-F250 HydrophobicContact CD2-CE1 4.15Å; F246-F250 HydrophobicContact CE1-CD1 4.1Å; F246-F250 AromaticContact CE1-CE1 3.68Å; F246-F250 HydrophobicContact CE1-CE1 3.68Å; F246-F250 HydrophobicContact CE2-CD1 4.19Å; F246-F250 HydrophobicContact CE2-CE1 4.03Å; F246-F250 AromaticContact CG-CD1 3.61Å; F246-F250 HydrophobicContact CG-CD1 3.61Å; F246-F250 HydrophobicContact CG-CE1 4.06Å; F246-F250 HydrophobicContact CZ-CD1 4.3Å; F246-F250 AromaticContact CZ-CE1 3.79Å; F246-F250 HydrophobicContact CZ-CE1 3.79Å; F246-P252 HydrophobicContact CE2-CG 4.1Å; F246-P252 HydrophobicContact CZ-CG 4.47Å; F246-L269 HydrophobicContact CE1-CD2 4.41Å
247	H	95.2	Very high	94.3	Very high	63 Å²	63	29.4 Å²	29.4	29%	0.292	17%	0.172	S	C	.	.			trans	-62.8	143.5	171.1	-173.8	-95.6	0	0	0	109.5	M166 Y174 A245 S249 F250	M166-H247 HydrophobicContact CB-CB 4.18Å; M166-H247 HydrophobicContact CG-CB 4.07Å; M166-H247 HydrophobicContact SD-CB 4.11Å; Y174-H247 HydrophobicContact CD1-CB 4.31Å; Y174-H247 HydrophobicContact CE1-CB 4.23Å; A245-H247 PolarHBondContact O-N 3.23Å; H247-S249 PolarHBondContact CE1-OG 2.77Å; H247-S249 VanDerWaalsContact CE1-OG 3.27Å; H247-S249 PolarHBondContact ND1-N 3Å; H247-S249 PolarHBondContact ND1-OG 3.43Å; H247-S249 PolarHBondContact O-N 3.25Å; H247-F250 HydrophobicContact CB-CB 4.13Å; H247-F250 WeakPolarHBondContact O-CA 3.43Å; H247-F250 VanDerWaalsContact O-CB 3.28Å; H247-F250 WeakPolarHBondContact O-CB 3.31Å; H247-F250 PolarHBondContact O-N 3.49Å
248	P	93.2	Very high	94.3	Very high	131 Å²	131	31.1 Å²	31.1	85%	0.851	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.9	-178	-29.4	36.3	0	0	0	115.3
249	S	93.1	Very high	94.3	Very high	62 Å²	62	31.2 Å²	31.2	43%	0.434	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.6	174.9	71.9	0	0	0	0	114.2	Y174 H247 N251	Y174-S249 WeakPolarHBondContact CE1-OG 3.49Å; Y174-S249 PolarHBondContact OH-O 2.91Å; Y174-S249 VanDerWaalsContact OH-O 3.14Å; Y174-S249 PolarHBondContact OH-OG 3.48Å; H247-S249 PolarHBondContact CE1-OG 2.77Å; H247-S249 VanDerWaalsContact CE1-OG 3.27Å; H247-S249 PolarHBondContact ND1-N 3Å; H247-S249 PolarHBondContact ND1-OG 3.43Å; H247-S249 PolarHBondContact O-N 3.25Å; S249-N251 PolarHBondContact O-N 3.2Å
250	F	95	Very high	94.2	Very high	11 Å²	11	32.9 Å²	32.9	5%	0.048	19%	0.188	C	C	.	.			trans	-79	105.9	177.2	-177.3	-105.2	0	0	0	109.6	M166 Y174 F246 H247 P252 C257 L259 L299	M166-F250 HydrophobicContact CE-CD1 3.76Å; M166-F250 HydrophobicContact CE-CD2 4.3Å; M166-F250 HydrophobicContact CE-CE1 3.77Å; M166-F250 HydrophobicContact CE-CE2 4.3Å; M166-F250 HydrophobicContact CE-CG 4.03Å; M166-F250 HydrophobicContact CE-CZ 4.05Å; M166-F250 HydrophobicContact SD-CB 3.51Å; M166-F250 VanDerWaalsContact SD-CB 3.51Å; M166-F250 HydrophobicContact SD-CD1 3.62Å; M166-F250 HydrophobicContact SD-CD2 3.63Å; M166-F250 HydrophobicContact SD-CE1 4.18Å; M166-F250 HydrophobicContact SD-CE2 4.18Å; M166-F250 HydrophobicContact SD-CG 3.3Å; M166-F250 WeakPolarHBondContact SD-CG 3.31Å; M166-F250 HydrophobicContact SD-CZ 4.43Å; Y174-F250 HydrophobicContact CD1-CB 4.14Å; Y174-F250 HydrophobicContact CD1-CD2 4.03Å; Y174-F250 AromaticContact CD2-CD2 3.44Å; Y174-F250 HydrophobicContact CD2-CD2 3.44Å; Y174-F250 VanDerWaalsContact CD2-CD2 3.44Å; Y174-F250 AromaticContact CD2-CE2 4Å; Y174-F250 HydrophobicContact CD2-CE2 4Å; Y174-F250 HydrophobicContact CE1-CB 4.02Å; Y174-F250 HydrophobicContact CE1-CD2 4.41Å; Y174-F250 AromaticContact CE2-CD2 3.86Å; Y174-F250 HydrophobicContact CE2-CD2 3.86Å; Y174-F250 HydrophobicContact CG-CB 4.5Å; Y174-F250 AromaticContact CG-CD2 3.53Å; Y174-F250 HydrophobicContact CG-CD2 3.53Å; Y174-F250 HydrophobicContact CG-CE2 4.17Å; Y174-F250 HydrophobicContact CG-CG 4.41Å; F246-F250 HydrophobicContact CB-CD1 4.04Å; F246-F250 AromaticContact CD1-CD1 3.75Å; F246-F250 HydrophobicContact CD1-CD1 3.75Å; F246-F250 AromaticContact CD1-CE1 3.82Å; F246-F250 HydrophobicContact CD1-CE1 3.82Å; F246-F250 AromaticContact CD2-CD1 3.84Å; F246-F250 HydrophobicContact CD2-CD1 3.84Å; F246-F250 HydrophobicContact CD2-CE1 4.15Å; F246-F250 HydrophobicContact CE1-CD1 4.1Å; F246-F250 AromaticContact CE1-CE1 3.68Å; F246-F250 HydrophobicContact CE1-CE1 3.68Å; F246-F250 HydrophobicContact CE2-CD1 4.19Å; F246-F250 HydrophobicContact CE2-CE1 4.03Å; F246-F250 AromaticContact CG-CD1 3.61Å; F246-F250 HydrophobicContact CG-CD1 3.61Å; F246-F250 HydrophobicContact CG-CE1 4.06Å; F246-F250 HydrophobicContact CZ-CD1 4.3Å; F246-F250 AromaticContact CZ-CE1 3.79Å; F246-F250 HydrophobicContact CZ-CE1 3.79Å; H247-F250 HydrophobicContact CB-CB 4.13Å; H247-F250 WeakPolarHBondContact O-CA 3.43Å; H247-F250 VanDerWaalsContact O-CB 3.28Å; H247-F250 WeakPolarHBondContact O-CB 3.31Å; H247-F250 PolarHBondContact O-N 3.49Å; F250-P252 HydrophobicContact CD1-CG 4.21Å; F250-P252 HydrophobicContact CE1-CB 3.82Å; F250-P252 HydrophobicContact CE1-CG 3.64Å; F250-P252 HydrophobicContact CZ-CB 3.82Å; F250-P252 HydrophobicContact CZ-CG 4.18Å; F250-C257 HydrophobicContact CD2-CB 3.64Å; F250-C257 HydrophobicContact CE2-CB 3.49Å; F250-C257 VanDerWaalsContact CE2-CB 3.49Å; F250-C257 HydrophobicContact CZ-CB 4.35Å; F250-L259 HydrophobicContact CE2-CD2 4.23Å; F250-L259 HydrophobicContact CE2-CG 4.4Å; F250-L259 HydrophobicContact CZ-CD1 4.35Å; F250-L259 HydrophobicContact CZ-CD2 4.46Å; F250-L259 HydrophobicContact CZ-CG 4.35Å; F250-L299 HydrophobicContact CZ-CD2 4.1Å
251	N	93.2	Very high	94.3	Very high	67 Å²	67	32.3 Å²	32.3	36%	0.358	19%	0.185	S	C	.	.			trans	-122.1	93.6	174.6	-177.7	-11.5	0	0	0	109	S249 F253 N254 C257	S249-N251 PolarHBondContact O-N 3.2Å; N251-F253 PolarHBondContact O-N 3.5Å; N251-F253 WeakPolarHBondContact OD1-CB 3.4Å; N251-F253 VanDerWaalsContact OD1-CD2 3.27Å; N251-F253 WeakPolarHBondContact OD1-CD2 3.34Å; N251-F253 PolarHBondContact OD1-N 3.27Å; N251-F253 VanDerWaalsContact OD1-N 3.13Å; N251-N254 VanDerWaalsContact O-CG 3.31Å; N251-N254 PolarHBondContact O-OD1 3.2Å; N251-C257 VanDerWaalsContact C-SG 3.53Å; N251-C257 PolarHBondContact N-SG 3.47Å; N251-C257 PolarHBondContact O-SG 2.95Å
252	P	93.3	Very high	94.2	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.019	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-75.5	-10.1	-177.2	33.7	-37.4	0	0	0	112.8	F246 F250 L295 S298 L299	F246-P252 HydrophobicContact CE2-CG 4.1Å; F246-P252 HydrophobicContact CZ-CG 4.47Å; F250-P252 HydrophobicContact CD1-CG 4.21Å; F250-P252 HydrophobicContact CE1-CB 3.82Å; F250-P252 HydrophobicContact CE1-CG 3.64Å; F250-P252 HydrophobicContact CZ-CB 3.82Å; F250-P252 HydrophobicContact CZ-CG 4.18Å; P252-L295 HydrophobicContact CB-CD1 3.64Å; P252-L295 HydrophobicContact CG-CD1 3.98Å; P252-S298 PolarHBondContact O-OG 3.13Å; P252-L299 HydrophobicContact CB-CD2 4.15Å
253	F	94.3	Very high	94.2	Very high	10 Å²	10	39.7 Å²	39.7	4%	0.044	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-77.8	-19.5	-176.4	-50.6	-70.8	0	0	0	113.6	V110 I112 L115 M148 L149 N251 L295	V110-F253 HydrophobicContact CB-CB 4.21Å; V110-F253 HydrophobicContact CB-CD1 4.2Å; V110-F253 HydrophobicContact CG1-CD1 4.13Å; V110-F253 PolarHBondContact N-O 3.24Å; I112-F253 HydrophobicContact CD1-CB 4.08Å; I112-F253 HydrophobicContact CD1-CD2 4.16Å; I112-F253 HydrophobicContact CD1-CG 4.02Å; I112-F253 HydrophobicContact CG1-CB 4.04Å; I112-F253 HydrophobicContact CG1-CD1 4.02Å; I112-F253 HydrophobicContact CG1-CD2 4.45Å; I112-F253 HydrophobicContact CG1-CG 3.91Å; L115-F253 HydrophobicContact CD1-CD1 3.98Å; L115-F253 HydrophobicContact CD1-CE1 3.64Å; M148-F253 HydrophobicContact CB-CE2 3.83Å; M148-F253 HydrophobicContact CB-CZ 3.6Å; M148-F253 HydrophobicContact CE-CD2 3.54Å; M148-F253 HydrophobicContact CE-CE2 3.33Å; M148-F253 HydrophobicContact CE-CZ 4.21Å; M148-F253 HydrophobicContact CG-CE2 4.46Å; M148-F253 HydrophobicContact SD-CE2 3.84Å; L149-F253 HydrophobicContact CD2-CE1 3.74Å; L149-F253 HydrophobicContact CD2-CZ 3.83Å; L149-F253 HydrophobicContact CG-CZ 4.35Å; N251-F253 PolarHBondContact O-N 3.5Å; N251-F253 WeakPolarHBondContact OD1-CB 3.4Å; N251-F253 VanDerWaalsContact OD1-CD2 3.27Å; N251-F253 WeakPolarHBondContact OD1-CD2 3.34Å; N251-F253 PolarHBondContact OD1-N 3.27Å; N251-F253 VanDerWaalsContact OD1-N 3.13Å; F253-L295 HydrophobicContact CD1-CD1 4.44Å
254	N	91.9	Very high	94.2	Very high	56 Å²	56	38.4 Å²	38.4	30%	0.299	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-88.7	-1.4	-179.1	69.7	9.3	0	0	0	113.8	N251 S256	N251-N254 VanDerWaalsContact O-CG 3.31Å; N251-N254 PolarHBondContact O-OD1 3.2Å; N254-S256 VanDerWaalsContact C-N 3.3Å; N254-S256 PolarHBondContact ND2-OG 3.39Å; N254-S256 PolarHBondContact O-N 2.88Å; N254-S256 WeakPolarHBondContact OD1-CB 3.23Å; N254-S256 PolarHBondContact OD1-N 3.26Å; N254-S256 PolarHBondContact OD1-OG 3.47Å
255	G	87.3	Confident	94.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	75.7	7.3	-178.9	0	0	0	0	0	115.6	R258	G255-R258 VanDerWaalsContact O-CZ 3.3Å; G255-R258 PolarHBondContact O-NH1 3.02Å; G255-R258 PolarHBondContact O-NH2 3.36Å
256	S	88.5	Confident	94.4	Very high	55 Å²	55	36.2 Å²	36.2	39%	0.385	19%	0.193	S	C	.	.			trans	-104.5	-17.6	-175.4	70.2	0	0	0	0	115.5	N254 R258	N254-S256 VanDerWaalsContact C-N 3.3Å; N254-S256 PolarHBondContact ND2-OG 3.39Å; N254-S256 PolarHBondContact O-N 2.88Å; N254-S256 WeakPolarHBondContact OD1-CB 3.23Å; N254-S256 PolarHBondContact OD1-N 3.26Å; N254-S256 PolarHBondContact OD1-OG 3.47Å; S256-R258 VanDerWaalsContact C-NH1 3.31Å
257	C	93.1	Very high	94.5	Very high	4 Å²	4	34.9 Å²	34.9	3%	0.027	19%	0.187	C	C	.	.			trans	-88	145	178.6	-58.7	0	0	0	0	111.3	G172 Y174 F250 N251	G172-C257 CarbonylContact O-C 3.22Å; G172-C257 WeakPolarHBondContact O-CA 3.47Å; Y174-C257 HydrophobicContact CD2-CB 4.3Å; Y174-C257 HydrophobicContact CE2-CB 4.22Å; F250-C257 HydrophobicContact CD2-CB 3.64Å; F250-C257 HydrophobicContact CE2-CB 3.49Å; F250-C257 VanDerWaalsContact CE2-CB 3.49Å; F250-C257 HydrophobicContact CZ-CB 4.35Å; N251-C257 VanDerWaalsContact C-SG 3.53Å; N251-C257 PolarHBondContact N-SG 3.47Å; N251-C257 PolarHBondContact O-SG 2.95Å
258	R	95.5	Very high	94.6	Very high	41 Å²	41	32.1 Å²	32.1	16%	0.155	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	151.5	-178.3	-60.5	-66.7	176.2	-85.5	-1.4	111.7	G172 L173 Y174 G255 S256 S298 L299 Y301	G172-R258 PolarHBondContact O-N 3.42Å; L173-R258 HydrophobicContact CD1-CB 3.86Å; Y174-R258 PolarHBondContact N-O 2.68Å; G255-R258 VanDerWaalsContact O-CZ 3.3Å; G255-R258 PolarHBondContact O-NH1 3.02Å; G255-R258 PolarHBondContact O-NH2 3.36Å; S256-R258 VanDerWaalsContact C-NH1 3.31Å; R258-S298 WeakPolarHBondContact CD-O 3.5Å; R258-S298 PolarHBondContact NH1-O 3.31Å; R258-L299 CarbonylContact C-O 3.41Å; R258-L299 VanDerWaalsContact CA-O 3.28Å; R258-L299 WeakPolarHBondContact CA-O 3.19Å; R258-L299 WeakPolarHBondContact CD-O 3.34Å; R258-Y301 VanDerWaalsContact NE-CD1 3.34Å; R258-Y301 VanDerWaalsContact NH2-CD1 3.32Å
259	L	97.5	Very high	94.8	Very high	2 Å²	2	26 Å²	26	1%	0.01	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.2	170.4	-65.8	178.9	0	0	0	109.3	Y174 F176 F250 F261 N266 L269 F270 L299	Y174-L259 VanDerWaalsContact O-CD2 3.26Å; Y174-L259 WeakPolarHBondContact O-CD2 3.42Å; F176-L259 HydrophobicContact CE2-CD1 4.03Å; F250-L259 HydrophobicContact CE2-CD2 4.23Å; F250-L259 HydrophobicContact CE2-CG 4.4Å; F250-L259 HydrophobicContact CZ-CD1 4.35Å; F250-L259 HydrophobicContact CZ-CD2 4.46Å; F250-L259 HydrophobicContact CZ-CG 4.35Å; L259-F261 PolarHBondContact O-N 3.21Å; L259-N266 HydrophobicContact CB-CB 4.42Å; L259-L269 HydrophobicContact CD1-CD2 3.64Å; L259-F270 HydrophobicContact CB-CE2 3.88Å; L259-F270 HydrophobicContact CB-CZ 4.03Å; L259-F270 HydrophobicContact CD1-CE2 4.46Å; L259-L299 HydrophobicContact CD1-CD1 4.3Å; L259-L299 HydrophobicContact CD1-CD2 3.99Å; L259-L299 HydrophobicContact CG-CD2 4.2Å; L259-L299 PolarHBondContact N-O 3.29Å
260	D	96.2	Very high	95.1	Very high	36 Å²	36	23.1 Å²	23.1	19%	0.193	12%	0.115	C	C	.	.			trans	-78.7	115.7	175.8	-179.3	5.6	0	0	0	110.4	K262 R263 N266	D260-K262 PolarHBondContact O-N 3.15Å; D260-K262 VanDerWaalsContact OD1-CB 3.26Å; D260-K262 WeakPolarHBondContact OD1-CB 3.34Å; D260-K262 WeakPolarHBondContact OD1-CG 3.3Å; D260-K262 PolarHBondContact OD1-N 2.94Å; D260-R263 HydrophobicContact CB-CG 4.41Å; D260-R263 PolarHBondContact O-N 3.42Å; D260-N266 PolarHBondContact O-ND2 3.35Å
261	F	97.2	Very high	95.3	Very high	6 Å²	6	22.6 Å²	22.6	3%	0.026	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-17.7	178	-172	-96.4	0	0	0	113.6	L259 R263 R267 F270 P305 L306 P520	L259-F261 PolarHBondContact O-N 3.21Å; F261-R263 PolarHBondContact O-N 2.95Å; F261-R267 HydrophobicContact CD2-CG 4.07Å; F261-R267 HydrophobicContact CE1-CG 4.39Å; F261-R267 HydrophobicContact CE2-CB 4.21Å; F261-R267 HydrophobicContact CE2-CG 3.92Å; F261-R267 HydrophobicContact CG-CG 4.37Å; F261-R267 HydrophobicContact CZ-CG 4.09Å; F261-R267 WeakPolarHBondContact O-CD 3.37Å; F261-R267 VanDerWaalsContact O-CG 3.27Å; F261-R267 WeakPolarHBondContact O-CG 2.97Å; F261-F270 HydrophobicContact CB-CE2 4.47Å; F261-F270 HydrophobicContact CB-CZ 4.4Å; F261-F270 HydrophobicContact CD2-CB 4.07Å; F261-F270 AromaticContact CD2-CD1 3.99Å; F261-F270 HydrophobicContact CD2-CD1 3.99Å; F261-F270 AromaticContact CD2-CD2 3.73Å; F261-F270 HydrophobicContact CD2-CD2 3.73Å; F261-F270 HydrophobicContact CD2-CE1 4.36Å; F261-F270 HydrophobicContact CD2-CE2 4.1Å; F261-F270 AromaticContact CD2-CG 3.67Å; F261-F270 HydrophobicContact CD2-CG 3.67Å; F261-F270 HydrophobicContact CD2-CZ 4.4Å; F261-F270 HydrophobicContact CE2-CB 3.9Å; F261-F270 HydrophobicContact CE2-CD2 4.35Å; F261-F270 HydrophobicContact CE2-CG 4.05Å; F261-P305 HydrophobicContact CB-CB 3.73Å; F261-P305 HydrophobicContact CB-CG 3.72Å; F261-P305 HydrophobicContact CD1-CB 3.42Å; F261-P305 VanDerWaalsContact CD1-CB 3.42Å; F261-P305 HydrophobicContact CD1-CG 4.24Å; F261-P305 HydrophobicContact CD2-CB 3.61Å; F261-P305 HydrophobicContact CD2-CG 3.55Å; F261-P305 HydrophobicContact CE1-CB 3.89Å; F261-P305 HydrophobicContact CE2-CB 4.05Å; F261-P305 HydrophobicContact CE2-CG 4.22Å; F261-P305 HydrophobicContact CG-CB 3.28Å; F261-P305 HydrophobicContact CG-CG 3.57Å; F261-P305 HydrophobicContact CZ-CB 4.18Å; F261-L306 HydrophobicContact CE2-CD2 4.02Å; F261-L306 HydrophobicContact CE2-CG 4.3Å; F261-L306 HydrophobicContact CZ-CD2 3.93Å; F261-P520 HydrophobicContact CD1-CG 3.74Å; F261-P520 HydrophobicContact CE1-CG 3.85Å
262	K	96.2	Very high	95.5	Very high	81 Å²	81	19.4 Å²	19.4	35%	0.352	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-27.6	175.5	-64.4	166.5	-173.1	153.7	0	111.7	D260 Q264 S523 I524	D260-K262 PolarHBondContact O-N 3.15Å; D260-K262 VanDerWaalsContact OD1-CB 3.26Å; D260-K262 WeakPolarHBondContact OD1-CB 3.34Å; D260-K262 WeakPolarHBondContact OD1-CG 3.3Å; D260-K262 PolarHBondContact OD1-N 2.94Å; K262-Q264 PolarHBondContact O-N 3.08Å; K262-S523 CarbonylContact O-C 3.57Å; K262-S523 WeakPolarHBondContact O-CA 3.37Å; K262-I524 PolarHBondContact O-N 3.33Å
263	R	96.3	Very high	95.8	Very high	77 Å²	77	19.3 Å²	19.3	29%	0.291	10%	0.095	S	C	.	.	B	Isolated β-bridge	trans	-78.5	118.1	177.6	-64.3	179.9	176.7	-97.1	-1.5	109.6	T175 D260 F261 V265 N266 I524	T175-R263 WeakPolarHBondContact OG1-CD 3.45Å; D260-R263 HydrophobicContact CB-CG 4.41Å; D260-R263 PolarHBondContact O-N 3.42Å; F261-R263 PolarHBondContact O-N 2.95Å; R263-V265 HydrophobicContact CB-CG2 4.15Å; R263-V265 PolarHBondContact O-N 3.4Å; R263-N266 PolarHBondContact O-N 3.07Å; R263-I524 HydrophobicContact CG-CB 4.34Å; R263-I524 HydrophobicContact CG-CD1 4.09Å
264	Q	95.2	Very high	96	Very high	8 Å²	8	18.8 Å²	18.8	4%	0.037	9%	0.093	C	C	.	.	H	α-helix	trans	-53.5	-40.7	-177.2	176.6	-82.3	-20.3	0	0	112.3	Y190 K262 N266 R267 I524 Y527	Y190-Q264 PolarHBondContact OH-NE2 3.12Å; K262-Q264 PolarHBondContact O-N 3.08Å; Q264-N266 PolarHBondContact O-N 2.73Å; Q264-N266 VanDerWaalsContact O-N 3.12Å; Q264-R267 VanDerWaalsContact CG-NH2 3.31Å; Q264-R267 WeakPolarHBondContact O-CB 3.37Å; Q264-R267 PolarHBondContact O-N 2.78Å; Q264-I524 PolarHBondContact N-O 3.41Å; Q264-Y527 VanDerWaalsContact OE1-CE2 3.29Å
265	V	96.6	Very high	96.2	Very high	12 Å²	12	17.4 Å²	17.4	7%	0.073	8%	0.084	C	C	.	.	H	α-helix	trans	-59.5	-23.2	179.6	-59.6	0	0	0	0	114.4	F176 R263 I526	F176-V265 HydrophobicContact CB-CB 4.24Å; F176-V265 HydrophobicContact CB-CG2 4.31Å; F176-V265 VanDerWaalsContact O-CG2 3.26Å; F176-V265 WeakPolarHBondContact O-CG2 3.49Å; R263-V265 HydrophobicContact CB-CG2 4.15Å; R263-V265 PolarHBondContact O-N 3.4Å; V265-I526 HydrophobicContact CG1-CD1 3.5Å; V265-I526 HydrophobicContact CG1-CG1 4Å
266	N	97.9	Very high	96.7	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-88.7	-25.7	178.3	-65.8	-22.6	0	0	0	112.4	F176 L259 D260 R263 Q264 G268 L269 F270	F176-N266 WeakPolarHBondContact CD2-OD1 3.09Å; F176-N266 PolarHBondContact N-OD1 3.02Å; L259-N266 HydrophobicContact CB-CB 4.42Å; D260-N266 PolarHBondContact O-ND2 3.35Å; R263-N266 PolarHBondContact O-N 3.07Å; Q264-N266 PolarHBondContact O-N 2.73Å; Q264-N266 VanDerWaalsContact O-N 3.12Å; N266-G268 VanDerWaalsContact C-N 3.31Å; N266-G268 PolarHBondContact O-N 2.92Å; N266-L269 PolarHBondContact O-N 2.74Å; N266-F270 HydrophobicContact CB-CE2 4.41Å; N266-F270 WeakPolarHBondContact O-CD2 3.07Å
267	R	97.6	Very high	97.2	Very high	7 Å²	7	14.8 Å²	14.8	3%	0.026	7%	0.065	C	C	.	.	H	α-helix	trans	-62	-36.2	-168.5	-66.2	-163.8	-66.8	-125.7	4.7	113.2	F261 Q264 L269 F270 V271 D516 S523	F261-R267 HydrophobicContact CD2-CG 4.07Å; F261-R267 HydrophobicContact CE1-CG 4.39Å; F261-R267 HydrophobicContact CE2-CB 4.21Å; F261-R267 HydrophobicContact CE2-CG 3.92Å; F261-R267 HydrophobicContact CG-CG 4.37Å; F261-R267 HydrophobicContact CZ-CG 4.09Å; F261-R267 WeakPolarHBondContact O-CD 3.37Å; F261-R267 VanDerWaalsContact O-CG 3.27Å; F261-R267 WeakPolarHBondContact O-CG 2.97Å; Q264-R267 VanDerWaalsContact CG-NH2 3.31Å; Q264-R267 WeakPolarHBondContact O-CB 3.37Å; Q264-R267 PolarHBondContact O-N 2.78Å; R267-L269 PolarHBondContact O-N 3Å; R267-F270 WeakPolarHBondContact O-CB 3.26Å; R267-F270 PolarHBondContact O-N 3.47Å; R267-V271 PolarHBondContact O-N 3.08Å; R267-D516 VanDerWaalsContact CD-OD1 3.3Å; R267-D516 WeakPolarHBondContact CD-OD1 3.46Å; R267-D516 IonicContact CZ-OD1 2.66Å; R267-D516 IonicContact CZ-OD2 2.9Å; R267-D516 VanDerWaalsContact CZ-OD2 3.23Å; R267-D516 VanDerWaalsContact NE-CG 3.32Å; R267-D516 IonicContact NE-OD1 3.63Å; R267-D516 PolarHBondContact NE-OD1 3.38Å; R267-D516 IonicContact NE-OD2 2.62Å; R267-D516 PolarHBondContact NE-OD2 2.84Å; R267-D516 IonicContact NH2-OD1 3.88Å; R267-D516 IonicContact NH2-OD2 3.8Å; R267-D516 PolarHBondContact NH2-OD2 3.43Å; R267-S523 PolarHBondContact NH1-OG 2.67Å
268	G	97.5	Very high	97.4	Very high	5 Å²	5	15.7 Å²	15.7	5%	0.052	7%	0.07	C	C	.	.	H	α-helix	trans	-55	-36.7	178.2	0	0	0	0	0	113	F242 N266 V271 A272	F242-G268 VanDerWaalsContact CE2-C 3.5Å; N266-G268 VanDerWaalsContact C-N 3.31Å; N266-G268 PolarHBondContact O-N 2.92Å; G268-V271 PolarHBondContact O-N 3.08Å; G268-A272 VanDerWaalsContact O-CB 3.24Å; G268-A272 WeakPolarHBondContact O-CB 3.49Å; G268-A272 PolarHBondContact O-N 3.01Å
269	L	98.3	Very high	97.4	Very high	3 Å²	3	14.8 Å²	14.8	2%	0.016	7%	0.067	C	C	.	.	H	α-helix	trans	-68.6	-41.6	177.8	178.6	60.9	0	0	0	111.8	F176 L239 F242 F246 L259 N266 R267 V271 A272 L273 L299	F176-L269 HydrophobicContact CE2-CB 4.26Å; F176-L269 HydrophobicContact CE2-CD2 3.92Å; F176-L269 HydrophobicContact CZ-CD2 4.1Å; L239-L269 HydrophobicContact CD2-CD1 4.08Å; F242-L269 HydrophobicContact CB-CD1 4.02Å; F242-L269 HydrophobicContact CD1-CB 4.29Å; F242-L269 HydrophobicContact CD2-CB 4.04Å; F242-L269 HydrophobicContact CD2-CD1 3.81Å; F242-L269 HydrophobicContact CE1-CB 4.14Å; F242-L269 VanDerWaalsContact CE2-CA 3.49Å; F242-L269 HydrophobicContact CE2-CB 3.89Å; F242-L269 HydrophobicContact CE2-CD1 4.44Å; F242-L269 VanDerWaalsContact CE2-N 3.34Å; F242-L269 HydrophobicContact CG-CB 4.23Å; F242-L269 HydrophobicContact CG-CD1 3.97Å; F242-L269 HydrophobicContact CZ-CB 3.92Å; F246-L269 HydrophobicContact CE1-CD2 4.41Å; L259-L269 HydrophobicContact CD1-CD2 3.64Å; N266-L269 PolarHBondContact O-N 2.74Å; R267-L269 PolarHBondContact O-N 3Å; L269-V271 VanDerWaalsContact C-N 3.34Å; L269-V271 PolarHBondContact O-N 3.39Å; L269-A272 PolarHBondContact O-N 3.35Å; L269-L273 HydrophobicContact CD1-CD1 4Å; L269-L273 HydrophobicContact CD1-CG 3.99Å; L269-L273 HydrophobicContact CG-CD1 3.96Å; L269-L273 HydrophobicContact CG-CG 4.39Å; L269-L273 WeakPolarHBondContact O-CB 3.25Å; L269-L273 VanDerWaalsContact O-CG 3.27Å; L269-L273 WeakPolarHBondContact O-CG 3.38Å; L269-L273 PolarHBondContact O-N 2.82Å; L269-L299 HydrophobicContact CD2-CD1 4.06Å; L269-L299 HydrophobicContact CG-CD1 4.29Å
270	F	98.6	Very high	97.3	Very high	1 Å²	1	14.7 Å²	14.7	0%	0.004	7%	0.066	C	C	.	.	H	α-helix	trans	-60.9	-45.6	176.7	-72	-99.7	0	0	0	110.9	L259 F261 N266 R267 F274 L296 L299 D300 P305 L306	L259-F270 HydrophobicContact CB-CE2 3.88Å; L259-F270 HydrophobicContact CB-CZ 4.03Å; L259-F270 HydrophobicContact CD1-CE2 4.46Å; F261-F270 HydrophobicContact CB-CE2 4.47Å; F261-F270 HydrophobicContact CB-CZ 4.4Å; F261-F270 HydrophobicContact CD2-CB 4.07Å; F261-F270 AromaticContact CD2-CD1 3.99Å; F261-F270 HydrophobicContact CD2-CD1 3.99Å; F261-F270 AromaticContact CD2-CD2 3.73Å; F261-F270 HydrophobicContact CD2-CD2 3.73Å; F261-F270 HydrophobicContact CD2-CE1 4.36Å; F261-F270 HydrophobicContact CD2-CE2 4.1Å; F261-F270 AromaticContact CD2-CG 3.67Å; F261-F270 HydrophobicContact CD2-CG 3.67Å; F261-F270 HydrophobicContact CD2-CZ 4.4Å; F261-F270 HydrophobicContact CE2-CB 3.9Å; F261-F270 HydrophobicContact CE2-CD2 4.35Å; F261-F270 HydrophobicContact CE2-CG 4.05Å; N266-F270 HydrophobicContact CB-CE2 4.41Å; N266-F270 WeakPolarHBondContact O-CD2 3.07Å; R267-F270 WeakPolarHBondContact O-CB 3.26Å; R267-F270 PolarHBondContact O-N 3.47Å; F270-F274 WeakPolarHBondContact O-CB 3.33Å; F270-F274 PolarHBondContact O-N 3.04Å; F270-L296 HydrophobicContact CB-CD1 4.04Å; F270-L296 HydrophobicContact CD1-CD1 3.55Å; F270-L296 HydrophobicContact CE1-CD1 4.4Å; F270-L296 HydrophobicContact CG-CD1 4.11Å; F270-L299 HydrophobicContact CE1-CB 3.74Å; F270-L299 HydrophobicContact CE1-CD1 4.36Å; F270-L299 HydrophobicContact CZ-CB 3.71Å; F270-L299 HydrophobicContact CZ-CD1 4.37Å; F270-D300 HydrophobicContact CE1-CB 3.93Å; F270-D300 HydrophobicContact CZ-CB 4.06Å; F270-P305 HydrophobicContact CD1-CG 3.82Å; F270-P305 HydrophobicContact CE1-CG 3.73Å; F270-L306 HydrophobicContact CB-CD1 3.75Å; F270-L306 HydrophobicContact CB-CG 4.32Å; F270-L306 WeakPolarHBondContact O-CD1 3.28Å
271	V	98.4	Very high	97.3	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-65.4	-44.4	178.5	174.1	0	0	0	0	111.2	L216 R267 G268 L269 L273 F274 R275 L493 A514	L216-V271 HydrophobicContact CD1-CG1 4.49Å; R267-V271 PolarHBondContact O-N 3.08Å; G268-V271 PolarHBondContact O-N 3.08Å; L269-V271 VanDerWaalsContact C-N 3.34Å; L269-V271 PolarHBondContact O-N 3.39Å; V271-L273 PolarHBondContact O-N 3.18Å; V271-F274 PolarHBondContact O-N 3.48Å; V271-R275 PolarHBondContact O-N 3.16Å; V271-L493 HydrophobicContact CG1-CD2 4.03Å; V271-A514 WeakPolarHBondContact CG1-O 3.17Å
272	A	98.4	Very high	97.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.7	-48.8	177.5	0	0	0	0	0	111.6	L216 L235 L239 G268 L269 Y276	L216-A272 HydrophobicContact CD2-CB 3.91Å; L235-A272 HydrophobicContact CD1-CB 4.19Å; L239-A272 HydrophobicContact CD2-CB 3.66Å; L239-A272 HydrophobicContact CG-CB 4.21Å; G268-A272 VanDerWaalsContact O-CB 3.24Å; G268-A272 WeakPolarHBondContact O-CB 3.49Å; G268-A272 PolarHBondContact O-N 3.01Å; L269-A272 PolarHBondContact O-N 3.35Å; A272-Y276 VanDerWaalsContact O-CB 3.28Å; A272-Y276 WeakPolarHBondContact O-CB 3.44Å; A272-Y276 PolarHBondContact O-N 3.13Å
273	L	98.5	Very high	97	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-62.1	-45.2	177.4	-72	171.2	0	0	0	111.6	L239 L269 V271 Y276 I277 Y292 L295 L296 L299	L239-L273 HydrophobicContact CD2-CD2 3.82Å; L239-L273 HydrophobicContact CD2-CG 4.08Å; L269-L273 HydrophobicContact CD1-CD1 4Å; L269-L273 HydrophobicContact CD1-CG 3.99Å; L269-L273 HydrophobicContact CG-CD1 3.96Å; L269-L273 HydrophobicContact CG-CG 4.39Å; L269-L273 WeakPolarHBondContact O-CB 3.25Å; L269-L273 VanDerWaalsContact O-CG 3.27Å; L269-L273 WeakPolarHBondContact O-CG 3.38Å; L269-L273 PolarHBondContact O-N 2.82Å; V271-L273 PolarHBondContact O-N 3.18Å; L273-Y276 PolarHBondContact O-N 3.38Å; L273-I277 WeakPolarHBondContact O-CD1 3.27Å; L273-I277 VanDerWaalsContact O-CG1 3.23Å; L273-I277 WeakPolarHBondContact O-CG1 3.49Å; L273-I277 PolarHBondContact O-N 3.05Å; L273-Y292 HydrophobicContact CD2-CD1 3.84Å; L273-Y292 HydrophobicContact CD2-CE1 4.14Å; L273-L295 HydrophobicContact CD1-CD2 4.38Å; L273-L295 HydrophobicContact CD1-CG 4.32Å; L273-L295 HydrophobicContact CD2-CD2 3.76Å; L273-L295 HydrophobicContact CD2-CG 4.49Å; L273-L296 HydrophobicContact CB-CB 4.41Å; L273-L296 HydrophobicContact CB-CD1 4.13Å; L273-L296 HydrophobicContact CD1-CD1 4.23Å; L273-L299 HydrophobicContact CD1-CD1 3.6Å
274	F	98.7	Very high	96.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-58.9	-51.2	178.5	-169.7	-73.8	0	0	0	111.7	F270 V271 Y276 I277 L278 L296 L306 M311 H490 L493	F270-F274 WeakPolarHBondContact O-CB 3.33Å; F270-F274 PolarHBondContact O-N 3.04Å; V271-F274 PolarHBondContact O-N 3.48Å; F274-Y276 VanDerWaalsContact C-N 3.27Å; F274-Y276 PolarHBondContact O-N 2.9Å; F274-I277 WeakPolarHBondContact O-CB 3.2Å; F274-I277 PolarHBondContact O-N 3.13Å; F274-L278 HydrophobicContact CD1-CD1 4.07Å; F274-L278 HydrophobicContact CD1-CG 4.37Å; F274-L278 HydrophobicContact CE1-CD1 3.79Å; F274-L278 HydrophobicContact CE1-CG 4.26Å; F274-L278 PolarHBondContact O-N 3.33Å; F274-L296 HydrophobicContact CB-CD2 3.97Å; F274-L296 HydrophobicContact CD2-CD2 4.02Å; F274-L296 HydrophobicContact CG-CD2 4.46Å; F274-L306 HydrophobicContact CB-CD1 3.75Å; F274-L306 HydrophobicContact CD2-CB 3.69Å; F274-L306 HydrophobicContact CD2-CD1 3.82Å; F274-L306 HydrophobicContact CD2-CG 4.4Å; F274-L306 HydrophobicContact CE2-CB 4Å; F274-L306 WeakPolarHBondContact CE2-O 3.38Å; F274-L306 HydrophobicContact CG-CD1 4.1Å; F274-M311 HydrophobicContact CD1-CE 4.19Å; F274-M311 HydrophobicContact CD2-CE 3.41Å; F274-M311 VanDerWaalsContact CD2-CE 3.41Å; F274-M311 HydrophobicContact CE1-CE 3.8Å; F274-M311 HydrophobicContact CE2-CE 2.96Å; F274-M311 HydrophobicContact CG-CE 4.02Å; F274-M311 HydrophobicContact CZ-CE 3.18Å; F274-H490 HydrophobicContact CE2-CB 4.48Å; F274-H490 AromaticContact CE2-CE1 3.99Å; F274-H490 AromaticContact CE2-ND1 3.49Å; F274-H490 WeakPolarHBondContact CE2-ND1 3.14Å; F274-H490 HydrophobicContact CZ-CB 4.38Å; F274-H490 AromaticContact CZ-CE1 3.86Å; F274-H490 AromaticContact CZ-CG 3.82Å; F274-H490 AromaticContact CZ-ND1 3.6Å; F274-L493 HydrophobicContact CB-CD1 4.29Å; F274-L493 HydrophobicContact CD1-CB 3.5Å; F274-L493 HydrophobicContact CD1-CD1 3.86Å; F274-L493 HydrophobicContact CD1-CG 4.28Å; F274-L493 HydrophobicContact CD2-CD1 4.24Å; F274-L493 HydrophobicContact CE1-CB 3.25Å; F274-L493 HydrophobicContact CE1-CD1 4.19Å; F274-L493 HydrophobicContact CE1-CG 4.36Å; F274-L493 HydrophobicContact CG-CB 4.36Å; F274-L493 HydrophobicContact CG-CD1 3.89Å; F274-L493 HydrophobicContact CZ-CB 3.93Å
275	R	97.6	Very high	97	Very high	27 Å²	27	17 Å²	17	10%	0.102	8%	0.084	C	C	.	.	H	α-helix	trans	-63.6	-35.9	178.3	-72.2	-170.6	171.8	-80.4	2	111.5	E220 L235 V271 L278 K279 L493 E495	E220-R275 IonicContact OE1-NH2 2.66Å; L235-R275 HydrophobicContact CD1-CB 4.24Å; L235-R275 HydrophobicContact CD2-CB 3.93Å; V271-R275 PolarHBondContact O-N 3.16Å; R275-L278 PolarHBondContact O-N 3.35Å; R275-K279 PolarHBondContact O-N 3.07Å; R275-L493 HydrophobicContact CG-CD2 4.39Å; R275-E495 IonicContact CZ-OE1 2.74Å; R275-E495 IonicContact NH1-OE1 2.86Å; R275-E495 PolarHBondContact NH1-OE1 3.05Å; R275-E495 IonicContact NH2-OE1 3.77Å; R275-E495 PolarHBondContact NH2-OE1 3.38Å; R275-E495 VanDerWaalsContact NH2-OE1 3.09Å
276	Y	97.8	Very high	97	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67.6	-39.8	178.6	-164.8	-114.3	0	0	0	111.9	H117 V150 L235 E236 L239 A272 L273 F274 L278 K279 I280 Y292	H117-Y276 PolarHBondContact CE1-OH 3.35Å; H117-Y276 PolarHBondContact ND1-OH 2.98Å; H117-Y276 VanDerWaalsContact ND1-OH 3.13Å; V150-Y276 HydrophobicContact CG1-CE1 4.14Å; L235-Y276 HydrophobicContact CD2-CD2 4.04Å; L235-Y276 HydrophobicContact CG-CD2 4.28Å; E236-Y276 HydrophobicContact CG-CD2 4.25Å; E236-Y276 HydrophobicContact CG-CE2 3.44Å; E236-Y276 VanDerWaalsContact CG-CE2 3.44Å; E236-Y276 WeakPolarHBondContact OE1-CE2 3.21Å; E236-Y276 PolarHBondContact OE1-OH 3.41Å; L239-Y276 HydrophobicContact CD1-CD1 3.87Å; L239-Y276 HydrophobicContact CD1-CD2 4.09Å; L239-Y276 HydrophobicContact CD1-CE1 4.43Å; L239-Y276 HydrophobicContact CD1-CG 3.67Å; A272-Y276 VanDerWaalsContact O-CB 3.28Å; A272-Y276 WeakPolarHBondContact O-CB 3.44Å; A272-Y276 PolarHBondContact O-N 3.13Å; L273-Y276 PolarHBondContact O-N 3.38Å; F274-Y276 VanDerWaalsContact C-N 3.27Å; F274-Y276 PolarHBondContact O-N 2.9Å; Y276-L278 VanDerWaalsContact C-N 3.32Å; Y276-L278 PolarHBondContact O-N 3.42Å; Y276-K279 PolarHBondContact O-N 3.08Å; Y276-I280 HydrophobicContact CD1-CD1 4.21Å; Y276-I280 HydrophobicContact CD1-CG2 4.07Å; Y276-I280 HydrophobicContact CD2-CG2 4.34Å; Y276-I280 HydrophobicContact CE1-CD1 4.31Å; Y276-I280 HydrophobicContact CE1-CG2 3.68Å; Y276-I280 HydrophobicContact CE2-CG2 3.97Å; Y276-I280 HydrophobicContact CG-CG2 4.39Å; Y276-I280 VanDerWaalsContact O-CG1 3.3Å; Y276-I280 WeakPolarHBondContact O-CG1 3.1Å; Y276-I280 PolarHBondContact O-N 3.34Å; Y276-Y292 HydrophobicContact CD1-CD1 4.27Å; Y276-Y292 HydrophobicContact CD1-CD2 4.28Å; Y276-Y292 AromaticContact CD1-CE1 3.86Å; Y276-Y292 HydrophobicContact CD1-CE1 3.86Å; Y276-Y292 AromaticContact CD1-CE2 3.89Å; Y276-Y292 HydrophobicContact CD1-CE2 3.89Å; Y276-Y292 HydrophobicContact CD1-CG 4.46Å; Y276-Y292 AromaticContact CD1-CZ 3.65Å; Y276-Y292 HydrophobicContact CE1-CD2 4.42Å; Y276-Y292 HydrophobicContact CE1-CE1 4.13Å; Y276-Y292 AromaticContact CE1-CE2 3.64Å; Y276-Y292 HydrophobicContact CE1-CE2 3.64Å; Y276-Y292 AromaticContact CE1-CZ 3.46Å; Y276-Y292 VanDerWaalsContact CE1-CZ 3.46Å; Y276-Y292 WeakPolarHBondContact CE1-OH 3.47Å
277	I	98.5	Very high	97	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-54.1	-49	172.7	-70.1	159.1	0	0	0	110.9	L273 F274 I280 S281 A289 Y292 L296 V308 M311 Y315	L273-I277 WeakPolarHBondContact O-CD1 3.27Å; L273-I277 VanDerWaalsContact O-CG1 3.23Å; L273-I277 WeakPolarHBondContact O-CG1 3.49Å; L273-I277 PolarHBondContact O-N 3.05Å; F274-I277 WeakPolarHBondContact O-CB 3.2Å; F274-I277 PolarHBondContact O-N 3.13Å; I277-I280 VanDerWaalsContact O-CG1 3.32Å; I277-I280 WeakPolarHBondContact O-CG1 3.47Å; I277-S281 VanDerWaalsContact O-CB 3.28Å; I277-S281 WeakPolarHBondContact O-CB 3.48Å; I277-S281 PolarHBondContact O-N 2.92Å; I277-S281 PolarHBondContact O-OG 2.92Å; I277-A289 HydrophobicContact CG2-CB 4.32Å; I277-Y292 HydrophobicContact CG1-CG 4.44Å; I277-L296 HydrophobicContact CD1-CB 4.23Å; I277-L296 HydrophobicContact CD1-CD2 3.9Å; I277-V308 HydrophobicContact CD1-CG2 4.39Å; I277-M311 HydrophobicContact CG2-SD 3.65Å; I277-Y315 HydrophobicContact CG2-CD2 4.08Å; I277-Y315 HydrophobicContact CG2-CE2 3.32Å
278	L	97.4	Very high	97.1	Very high	23 Å²	23	21.5 Å²	21.5	12%	0.12	10%	0.1	C	C	.	.	H	α-helix	trans	-60.7	-49.9	178.4	-61.6	179.6	0	0	0	110.7	F274 R275 Y276 I280 S281 E282 L493	F274-L278 HydrophobicContact CD1-CD1 4.07Å; F274-L278 HydrophobicContact CD1-CG 4.37Å; F274-L278 HydrophobicContact CE1-CD1 3.79Å; F274-L278 HydrophobicContact CE1-CG 4.26Å; F274-L278 PolarHBondContact O-N 3.33Å; R275-L278 PolarHBondContact O-N 3.35Å; Y276-L278 VanDerWaalsContact C-N 3.32Å; Y276-L278 PolarHBondContact O-N 3.42Å; L278-I280 PolarHBondContact O-N 3.48Å; L278-S281 PolarHBondContact O-N 2.9Å; L278-S281 VanDerWaalsContact O-N 3.09Å; L278-S281 PolarHBondContact O-OG 3.12Å; L278-E282 WeakPolarHBondContact O-CG 3.33Å; L278-E282 PolarHBondContact O-N 3.48Å; L278-L493 WeakPolarHBondContact CD1-O 3.27Å
279	K	95.4	Very high	97.1	Very high	21 Å²	21	21.3 Å²	21.3	9%	0.091	10%	0.097	C	C	.	.	H	α-helix	trans	-59.9	-43.1	-177.3	-169.5	65.4	-117.6	166.7	0	113.5	M223 T228 T232 R275 Y276 E282	M223-K279 HydrophobicContact CE-CD 3.74Å; M223-K279 HydrophobicContact CE-CG 4.35Å; M223-K279 HydrophobicContact SD-CD 4.27Å; T228-K279 HydrophobicContact CG2-CD 4.09Å; T232-K279 HydrophobicContact CG2-CG 4.09Å; R275-K279 PolarHBondContact O-N 3.07Å; Y276-K279 PolarHBondContact O-N 3.08Å; K279-E282 WeakPolarHBondContact CE-OE2 3.22Å; K279-E282 IonicContact NZ-OE2 3.98Å; K279-E282 PolarHBondContact NZ-OE2 2.92Å
280	I	95.4	Very high	97.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-73.4	-30.8	177.6	66.1	-170.7	0	0	0	111.6	H117 Y276 I277 L278 R283 C285 A289 Y292	H117-I280 HydrophobicContact CB-CB 4.4Å; H117-I280 HydrophobicContact CB-CG2 4.24Å; Y276-I280 HydrophobicContact CD1-CD1 4.21Å; Y276-I280 HydrophobicContact CD1-CG2 4.07Å; Y276-I280 HydrophobicContact CD2-CG2 4.34Å; Y276-I280 HydrophobicContact CE1-CD1 4.31Å; Y276-I280 HydrophobicContact CE1-CG2 3.68Å; Y276-I280 HydrophobicContact CE2-CG2 3.97Å; Y276-I280 HydrophobicContact CG-CG2 4.39Å; Y276-I280 VanDerWaalsContact O-CG1 3.3Å; Y276-I280 WeakPolarHBondContact O-CG1 3.1Å; Y276-I280 PolarHBondContact O-N 3.34Å; I277-I280 VanDerWaalsContact O-CG1 3.32Å; I277-I280 WeakPolarHBondContact O-CG1 3.47Å; L278-I280 PolarHBondContact O-N 3.48Å; I280-R283 PolarHBondContact O-N 3.45Å; I280-C285 HydrophobicContact CB-CB 4.42Å; I280-C285 WeakPolarHBondContact O-CB 3.25Å; I280-C285 PolarHBondContact O-N 3.07Å; I280-A289 HydrophobicContact CD1-CB 4.26Å; I280-A289 HydrophobicContact CG1-CB 4.03Å; I280-Y292 HydrophobicContact CD1-CD2 3.31Å; I280-Y292 HydrophobicContact CD1-CE2 3.79Å; I280-Y292 HydrophobicContact CD1-CG 4.16Å
281	S	96.2	Very high	97.1	Very high	14 Å²	14	21.2 Å²	21.2	10%	0.098	10%	0.097	C	C	.	.	H	α-helix	trans	-68.5	-34.2	176.4	76.7	0	0	0	0	113.1	I277 L278 R283 G284 Y286 Y315	I277-S281 VanDerWaalsContact O-CB 3.28Å; I277-S281 WeakPolarHBondContact O-CB 3.48Å; I277-S281 PolarHBondContact O-N 2.92Å; I277-S281 PolarHBondContact O-OG 2.92Å; L278-S281 PolarHBondContact O-N 2.9Å; L278-S281 VanDerWaalsContact O-N 3.09Å; L278-S281 PolarHBondContact O-OG 3.12Å; S281-R283 PolarHBondContact O-N 3.42Å; S281-G284 WeakPolarHBondContact O-CA 3.46Å; S281-G284 PolarHBondContact O-N 3.34Å; S281-Y286 WeakPolarHBondContact O-CE1 3.28Å; S281-Y315 WeakPolarHBondContact CB-OH 3.27Å; S281-Y315 PolarHBondContact OG-OH 3.47Å
282	E	94.1	Very high	97.1	Very high	135 Å²	135	21.2 Å²	21.2	63%	0.631	10%	0.097	S	C	*	.	H	α-helix	trans	-62.2	-26.1	173	-71.4	168.8	-169.7	0	0	112.6	L278 K279 G284	L278-E282 WeakPolarHBondContact O-CG 3.33Å; L278-E282 PolarHBondContact O-N 3.48Å; K279-E282 WeakPolarHBondContact CE-OE2 3.22Å; K279-E282 IonicContact NZ-OE2 3.98Å; K279-E282 PolarHBondContact NZ-OE2 2.92Å; E282-G284 PolarHBondContact O-N 3.36Å
283	R	92.7	Very high	97.1	Very high	88 Å²	88	21.2 Å²	21.2	33%	0.332	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	5.5	173	-62	-177.9	176.8	158.3	3.1	113	H117 I280 S281 C285	H117-R283 PolarHBondContact NE2-NH1 3.41Å; I280-R283 PolarHBondContact O-N 3.45Å; S281-R283 PolarHBondContact O-N 3.42Å; R283-C285 PolarHBondContact O-N 3.07Å
284	G	94.5	Very high	97.1	Very high	20 Å²	20	22.3 Å²	22.3	21%	0.206	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	12.1	-175.7	0	0	0	0	0	114.6	S281 E282 Y286	S281-G284 WeakPolarHBondContact O-CA 3.46Å; S281-G284 PolarHBondContact O-N 3.34Å; E282-G284 PolarHBondContact O-N 3.36Å; G284-Y286 VanDerWaalsContact O-CD2 3.28Å; G284-Y286 WeakPolarHBondContact O-CD2 3.46Å; G284-Y286 PolarHBondContact O-N 3.43Å
285	C	96.6	Very high	97	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.102	C	C	.	.			trans	-83.8	60.4	-179.9	-57	0	0	0	0	111.1	H117 E120 L121 I280 R283 R287 S288 A289	H117-C285 HydrophobicContact CB-CB 3.92Å; E120-C285 VanDerWaalsContact CD-CA 3.49Å; E120-C285 HydrophobicContact CG-CB 4.48Å; E120-C285 VanDerWaalsContact OE2-C 3.29Å; E120-C285 WeakPolarHBondContact OE2-CA 3.38Å; E120-C285 WeakPolarHBondContact OE2-CB 3.46Å; L121-C285 WeakPolarHBondContact CD2-SG 3.4Å; L121-C285 WeakPolarHBondContact CG-SG 3.37Å; I280-C285 HydrophobicContact CB-CB 4.42Å; I280-C285 WeakPolarHBondContact O-CB 3.25Å; I280-C285 PolarHBondContact O-N 3.07Å; R283-C285 PolarHBondContact O-N 3.07Å; C285-R287 VanDerWaalsContact C-N 3.31Å; C285-R287 PolarHBondContact O-N 3.18Å; C285-S288 PolarHBondContact O-N 3.01Å; C285-A289 WeakPolarHBondContact O-CB 3.32Å; C285-A289 PolarHBondContact O-N 2.78Å
286	Y	98	Very high	97.1	Very high	73 Å²	73	21.4 Å²	21.4	29%	0.286	10%	0.099	S	C	.	.	H	α-helix	trans	-67.8	-29.9	-170.9	-55.8	-60.9	0	0	0	113	E120 S281 G284 L290 Y315 Y318	E120-Y286 PolarHBondContact OE1-N 3.23Å; S281-Y286 WeakPolarHBondContact O-CE1 3.28Å; G284-Y286 VanDerWaalsContact O-CD2 3.28Å; G284-Y286 WeakPolarHBondContact O-CD2 3.46Å; G284-Y286 PolarHBondContact O-N 3.43Å; Y286-L290 WeakPolarHBondContact O-CB 3.34Å; Y286-L290 PolarHBondContact O-N 2.83Å; Y286-Y315 AromaticContact CD1-CD1 3.93Å; Y286-Y315 HydrophobicContact CD1-CD1 3.93Å; Y286-Y315 HydrophobicContact CD1-CE1 4.38Å; Y286-Y318 HydrophobicContact CD1-CD2 4.48Å; Y286-Y318 HydrophobicContact CD1-CG 4.27Å; Y286-Y318 HydrophobicContact CD2-CD1 4.33Å; Y286-Y318 HydrophobicContact CD2-CG 4.13Å; Y286-Y318 HydrophobicContact CE1-CD2 4.38Å; Y286-Y318 HydrophobicContact CE1-CG 4.28Å; Y286-Y318 AromaticContact CE2-CD1 3.99Å; Y286-Y318 HydrophobicContact CE2-CD1 3.99Å; Y286-Y318 HydrophobicContact CE2-CG 4.12Å; Y286-Y318 VanDerWaalsContact CG-CB 3.47Å; Y286-Y318 HydrophobicContact CG-CG 4.18Å
287	R	97.9	Very high	97.1	Very high	41 Å²	41	21.5 Å²	21.5	16%	0.155	10%	0.099	C	C	.	.	H	α-helix	trans	-68.5	-43.1	176.7	179.8	56.9	-171.7	-123.5	14.7	110.5	M114 E120 C285 L290 E291	M114-R287 HydrophobicContact CB-CG 4.11Å; M114-R287 HydrophobicContact CG-CG 4.29Å; M114-R287 HydrophobicContact SD-CG 4.11Å; E120-R287 WeakPolarHBondContact OE1-CB 3.31Å; E120-R287 PolarHBondContact OE1-N 2.89Å; E120-R287 PolarHBondContact OE2-N 2.91Å; C285-R287 VanDerWaalsContact C-N 3.31Å; C285-R287 PolarHBondContact O-N 3.18Å; R287-L290 WeakPolarHBondContact O-CB 3.45Å; R287-L290 PolarHBondContact O-N 3.1Å; R287-E291 IonicContact CZ-OE1 2.62Å; R287-E291 VanDerWaalsContact CZ-OE1 3.25Å; R287-E291 IonicContact NE-OE1 3.26Å; R287-E291 PolarHBondContact NE-OE1 3.38Å; R287-E291 IonicContact NH2-OE1 3.23Å; R287-E291 PolarHBondContact NH2-OE1 2.92Å; R287-E291 WeakPolarHBondContact O-CG 3.29Å; R287-E291 PolarHBondContact O-N 2.83Å
288	S	97.6	Very high	96.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-46.6	175.5	-53.1	0	0	0	0	110.6	M114 H117 E120 C285 L290 E291 Y292	M114-S288 VanDerWaalsContact O-CA 3.24Å; M114-S288 WeakPolarHBondContact O-CA 3.17Å; M114-S288 PolarHBondContact O-OG 3.02Å; M114-S288 VanDerWaalsContact O-OG 3.1Å; H117-S288 VanDerWaalsContact CA-OG 3.28Å; H117-S288 WeakPolarHBondContact CA-OG 3.38Å; H117-S288 PolarHBondContact N-OG 3.18Å; E120-S288 VanDerWaalsContact OE2-CB 3.32Å; E120-S288 WeakPolarHBondContact OE2-CB 3.46Å; E120-S288 PolarHBondContact OE2-N 3.17Å; E120-S288 PolarHBondContact OE2-OG 3.1Å; C285-S288 PolarHBondContact O-N 3.01Å; S288-L290 VanDerWaalsContact C-N 3.26Å; S288-L290 PolarHBondContact O-N 3.14Å; S288-E291 PolarHBondContact O-N 3.34Å; S288-E291 VanDerWaalsContact O-N 3.07Å; S288-Y292 VanDerWaalsContact O-CD2 3.24Å; S288-Y292 WeakPolarHBondContact O-CD2 3.28Å; S288-Y292 PolarHBondContact O-N 2.85Å
289	A	98.5	Very high	96.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-51.7	-44.9	174.7	0	0	0	0	0	112.4	I277 I280 C285 Y292 C293 Y315	I277-A289 HydrophobicContact CG2-CB 4.32Å; I280-A289 HydrophobicContact CD1-CB 4.26Å; I280-A289 HydrophobicContact CG1-CB 4.03Å; C285-A289 WeakPolarHBondContact O-CB 3.32Å; C285-A289 PolarHBondContact O-N 2.78Å; A289-Y292 PolarHBondContact O-N 3.25Å; A289-C293 PolarHBondContact O-N 3.47Å; A289-C293 PolarHBondContact O-SG 3.29Å; A289-C293 VanDerWaalsContact O-SG 3.37Å; A289-Y315 HydrophobicContact CB-CD1 3.98Å; A289-Y315 HydrophobicContact CB-CD2 3.97Å; A289-Y315 HydrophobicContact CB-CE1 4.3Å; A289-Y315 HydrophobicContact CB-CE2 4.27Å; A289-Y315 HydrophobicContact CB-CG 3.79Å
290	L	98.6	Very high	96.9	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-60.9	-45.7	176.6	179.7	65.1	0	0	0	112.9	Y286 R287 S288 Y292 C293 K294 I312 A316 Q321 F324	Y286-L290 WeakPolarHBondContact O-CB 3.34Å; Y286-L290 PolarHBondContact O-N 2.83Å; R287-L290 WeakPolarHBondContact O-CB 3.45Å; R287-L290 PolarHBondContact O-N 3.1Å; S288-L290 VanDerWaalsContact C-N 3.26Å; S288-L290 PolarHBondContact O-N 3.14Å; L290-Y292 VanDerWaalsContact C-N 3.27Å; L290-Y292 PolarHBondContact O-N 2.57Å; L290-C293 WeakPolarHBondContact O-CB 3.07Å; L290-C293 PolarHBondContact O-N 3.48Å; L290-C293 VanDerWaalsContact O-N 3.15Å; L290-K294 WeakPolarHBondContact O-CG 3.18Å; L290-K294 PolarHBondContact O-N 3Å; L290-I312 HydrophobicContact CD1-CG1 3.83Å; L290-A316 HydrophobicContact CD1-CB 3.87Å; L290-A316 HydrophobicContact CD2-CB 4.39Å; L290-Q321 HydrophobicContact CD2-CB 3.69Å; L290-Q321 HydrophobicContact CD2-CG 3.56Å; L290-F324 HydrophobicContact CD1-CD1 4.15Å; L290-F324 HydrophobicContact CD1-CE1 3.7Å; L290-F324 HydrophobicContact CD2-CD1 4.24Å; L290-F324 HydrophobicContact CG-CE1 4.46Å
291	E	98.2	Very high	96.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.6	-34.6	179.1	-62.4	-59.9	159.9	0	0	111.6	V110 N111 M114 L115 R287 S288 K294 L295	V110-E291 HydrophobicContact CG1-CB 4.09Å; N111-E291 PolarHBondContact N-OE2 2.97Å; M114-E291 HydrophobicContact CB-CG 3.71Å; L115-E291 HydrophobicContact CD2-CB 3.65Å; L115-E291 HydrophobicContact CG-CB 4.31Å; R287-E291 IonicContact CZ-OE1 2.62Å; R287-E291 VanDerWaalsContact CZ-OE1 3.25Å; R287-E291 IonicContact NE-OE1 3.26Å; R287-E291 PolarHBondContact NE-OE1 3.38Å; R287-E291 IonicContact NH2-OE1 3.23Å; R287-E291 PolarHBondContact NH2-OE1 2.92Å; R287-E291 WeakPolarHBondContact O-CG 3.29Å; R287-E291 PolarHBondContact O-N 2.83Å; S288-E291 PolarHBondContact O-N 3.34Å; S288-E291 VanDerWaalsContact O-N 3.07Å; E291-K294 WeakPolarHBondContact O-CB 3.26Å; E291-K294 PolarHBondContact O-N 3.49Å; E291-L295 PolarHBondContact O-N 2.98Å
292	Y	98.5	Very high	96.4	Very high	1 Å²	1	24 Å²	24	0%	0.004	11%	0.109	C	C	.	.	H	α-helix	trans	-70.6	-34.8	171.2	-80.2	-77.1	0	0	0	113	L115 L149 L273 Y276 I277 I280 S288 A289 L290 K294 L295 L296	L115-Y292 HydrophobicContact CB-CE2 4.28Å; L115-Y292 HydrophobicContact CD2-CD1 4.11Å; L115-Y292 HydrophobicContact CD2-CD2 3.75Å; L115-Y292 HydrophobicContact CD2-CE1 4.08Å; L115-Y292 HydrophobicContact CD2-CE2 3.7Å; L115-Y292 HydrophobicContact CD2-CG 3.96Å; L149-Y292 PolarHBondContact O-OH 3.21Å; L273-Y292 HydrophobicContact CD2-CD1 3.84Å; L273-Y292 HydrophobicContact CD2-CE1 4.14Å; Y276-Y292 HydrophobicContact CD1-CD1 4.27Å; Y276-Y292 HydrophobicContact CD1-CD2 4.28Å; Y276-Y292 AromaticContact CD1-CE1 3.86Å; Y276-Y292 HydrophobicContact CD1-CE1 3.86Å; Y276-Y292 AromaticContact CD1-CE2 3.89Å; Y276-Y292 HydrophobicContact CD1-CE2 3.89Å; Y276-Y292 HydrophobicContact CD1-CG 4.46Å; Y276-Y292 AromaticContact CD1-CZ 3.65Å; Y276-Y292 HydrophobicContact CE1-CD2 4.42Å; Y276-Y292 HydrophobicContact CE1-CE1 4.13Å; Y276-Y292 AromaticContact CE1-CE2 3.64Å; Y276-Y292 HydrophobicContact CE1-CE2 3.64Å; Y276-Y292 AromaticContact CE1-CZ 3.46Å; Y276-Y292 VanDerWaalsContact CE1-CZ 3.46Å; Y276-Y292 WeakPolarHBondContact CE1-OH 3.47Å; I277-Y292 HydrophobicContact CG1-CG 4.44Å; I280-Y292 HydrophobicContact CD1-CD2 3.31Å; I280-Y292 HydrophobicContact CD1-CE2 3.79Å; I280-Y292 HydrophobicContact CD1-CG 4.16Å; S288-Y292 VanDerWaalsContact O-CD2 3.24Å; S288-Y292 WeakPolarHBondContact O-CD2 3.28Å; S288-Y292 PolarHBondContact O-N 2.85Å; A289-Y292 PolarHBondContact O-N 3.25Å; L290-Y292 VanDerWaalsContact C-N 3.27Å; L290-Y292 PolarHBondContact O-N 2.57Å; Y292-K294 VanDerWaalsContact C-N 3.32Å; Y292-K294 PolarHBondContact O-N 3.43Å; Y292-L295 HydrophobicContact CD1-CD2 4.16Å; Y292-L295 HydrophobicContact CE1-CD2 4.44Å; Y292-L295 WeakPolarHBondContact O-CB 3.36Å; Y292-L295 PolarHBondContact O-N 3.4Å; Y292-L296 WeakPolarHBondContact O-CB 3.46Å; Y292-L296 PolarHBondContact O-N 3.15Å
293	C	98.6	Very high	96.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.6	-43	170.9	-72.3	0	0	0	0	111.6	A289 L290 L295 L296 L297 V308 I312 Y315	A289-C293 PolarHBondContact O-N 3.47Å; A289-C293 PolarHBondContact O-SG 3.29Å; A289-C293 VanDerWaalsContact O-SG 3.37Å; L290-C293 WeakPolarHBondContact O-CB 3.07Å; L290-C293 PolarHBondContact O-N 3.48Å; L290-C293 VanDerWaalsContact O-N 3.15Å; C293-L295 VanDerWaalsContact C-N 3.35Å; C293-L296 PolarHBondContact O-N 2.88Å; C293-L297 VanDerWaalsContact O-CB 3.26Å; C293-L297 WeakPolarHBondContact O-CB 3.35Å; C293-L297 PolarHBondContact O-N 2.93Å; C293-V308 HydrophobicContact CB-CG2 3.86Å; C293-I312 HydrophobicContact CB-CB 4.29Å; C293-I312 HydrophobicContact CB-CD1 4Å; C293-I312 HydrophobicContact CB-CG1 3.81Å; C293-Y315 VanDerWaalsContact SG-CD2 3.52Å
294	K	98.1	Very high	96.6	Very high	23 Å²	23	16.5 Å²	16.5	10%	0.1	8%	0.08	C	C	.	.	H	α-helix	trans	-60.2	-45.6	174.7	-70.5	173.8	137.5	-151.8	0	111.5	L107 K109 V110 L290 E291 Y292 L297 S298 F324	L107-K294 WeakPolarHBondContact O-CE 3.42Å; L107-K294 PolarHBondContact O-NZ 2.98Å; K109-K294 PolarHBondContact O-NZ 2.98Å; V110-K294 HydrophobicContact CG2-CB 4.15Å; L290-K294 WeakPolarHBondContact O-CG 3.18Å; L290-K294 PolarHBondContact O-N 3Å; E291-K294 WeakPolarHBondContact O-CB 3.26Å; E291-K294 PolarHBondContact O-N 3.49Å; Y292-K294 VanDerWaalsContact C-N 3.32Å; Y292-K294 PolarHBondContact O-N 3.43Å; K294-L297 PolarHBondContact O-N 3.17Å; K294-S298 VanDerWaalsContact O-CB 3.29Å; K294-S298 WeakPolarHBondContact O-CB 3.38Å; K294-S298 PolarHBondContact O-N 3Å; K294-F324 HydrophobicContact CD-CE2 4.33Å; K294-F324 HydrophobicContact CD-CZ 4.28Å; K294-F324 VanDerWaalsContact CE-CZ 3.43Å; K294-F324 HydrophobicContact CG-CE2 4.39Å; K294-F324 HydrophobicContact CG-CZ 3.97Å
295	L	97.8	Very high	96.7	Very high	3 Å²	3	16 Å²	16	2%	0.016	7%	0.073	C	C	.	.	H	α-helix	trans	-59.8	-50	176.3	178.6	62.3	0	0	0	111.6	V110 L149 P252 F253 L273 E291 Y292 C293 L297 S298 L299	V110-L295 HydrophobicContact CG2-CB 3.91Å; V110-L295 HydrophobicContact CG2-CD1 4.41Å; L149-L295 HydrophobicContact CD2-CD2 3.39Å; P252-L295 HydrophobicContact CB-CD1 3.64Å; P252-L295 HydrophobicContact CG-CD1 3.98Å; F253-L295 HydrophobicContact CD1-CD1 4.44Å; L273-L295 HydrophobicContact CD1-CD2 4.38Å; L273-L295 HydrophobicContact CD1-CG 4.32Å; L273-L295 HydrophobicContact CD2-CD2 3.76Å; L273-L295 HydrophobicContact CD2-CG 4.49Å; E291-L295 PolarHBondContact O-N 2.98Å; Y292-L295 HydrophobicContact CD1-CD2 4.16Å; Y292-L295 HydrophobicContact CE1-CD2 4.44Å; Y292-L295 WeakPolarHBondContact O-CB 3.36Å; Y292-L295 PolarHBondContact O-N 3.4Å; C293-L295 VanDerWaalsContact C-N 3.35Å; L295-L297 PolarHBondContact O-N 3.29Å; L295-S298 PolarHBondContact O-N 2.84Å; L295-S298 PolarHBondContact O-OG 2.85Å; L295-L299 WeakPolarHBondContact O-CG 3.5Å; L295-L299 PolarHBondContact O-N 3.07Å
296	L	98.3	Very high	96.8	Very high	6 Å²	6	16.1 Å²	16.1	3%	0.031	7%	0.074	C	C	.	.	H	α-helix	trans	-62.6	-43.9	180	178.7	56.9	0	0	0	111.6	F270 L273 F274 I277 Y292 C293 S298 L299 V308	F270-L296 HydrophobicContact CB-CD1 4.04Å; F270-L296 HydrophobicContact CD1-CD1 3.55Å; F270-L296 HydrophobicContact CE1-CD1 4.4Å; F270-L296 HydrophobicContact CG-CD1 4.11Å; L273-L296 HydrophobicContact CB-CB 4.41Å; L273-L296 HydrophobicContact CB-CD1 4.13Å; L273-L296 HydrophobicContact CD1-CD1 4.23Å; F274-L296 HydrophobicContact CB-CD2 3.97Å; F274-L296 HydrophobicContact CD2-CD2 4.02Å; F274-L296 HydrophobicContact CG-CD2 4.46Å; I277-L296 HydrophobicContact CD1-CB 4.23Å; I277-L296 HydrophobicContact CD1-CD2 3.9Å; Y292-L296 WeakPolarHBondContact O-CB 3.46Å; Y292-L296 PolarHBondContact O-N 3.15Å; C293-L296 PolarHBondContact O-N 2.88Å; L296-S298 VanDerWaalsContact C-N 3.32Å; L296-S298 PolarHBondContact O-N 2.87Å; L296-L299 PolarHBondContact O-N 3.37Å; L296-V308 HydrophobicContact CD2-CB 4.01Å; L296-V308 HydrophobicContact CD2-CG2 3.96Å; L296-V308 HydrophobicContact CG-CB 4.34Å; L296-V308 HydrophobicContact CG-CG2 4.47Å
297	L	97.4	Very high	96.8	Very high	1 Å²	1	13 Å²	13	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-65.1	-36.4	177	-172.1	55.5	0	0	0	111.4	L108 C293 K294 L295 L299 D300 Y301 D304 V308 L309 I312	L108-L297 HydrophobicContact CD1-CG 4.21Å; L108-L297 HydrophobicContact CD2-CB 4.23Å; L108-L297 HydrophobicContact CD2-CD2 3.68Å; L108-L297 HydrophobicContact CD2-CG 4.05Å; C293-L297 VanDerWaalsContact O-CB 3.26Å; C293-L297 WeakPolarHBondContact O-CB 3.35Å; C293-L297 PolarHBondContact O-N 2.93Å; K294-L297 PolarHBondContact O-N 3.17Å; L295-L297 PolarHBondContact O-N 3.29Å; L297-L299 VanDerWaalsContact C-N 3.28Å; L297-L299 PolarHBondContact O-N 2.62Å; L297-D300 CarbonylContact O-C 3.24Å; L297-D300 VanDerWaalsContact O-C 3.22Å; L297-D300 PolarHBondContact O-N 3.2Å; L297-Y301 WeakPolarHBondContact O-CA 3.26Å; L297-Y301 VanDerWaalsContact O-CB 3.23Å; L297-Y301 WeakPolarHBondContact O-CB 3.36Å; L297-Y301 PolarHBondContact O-N 3.34Å; L297-D304 HydrophobicContact CD1-CB 4.09Å; L297-V308 HydrophobicContact CB-CG1 3.62Å; L297-V308 HydrophobicContact CD1-CG1 3.85Å; L297-V308 HydrophobicContact CD2-CG1 4.49Å; L297-V308 HydrophobicContact CG-CG1 4.18Å; L297-L309 HydrophobicContact CD1-CD2 4.46Å; L297-L309 HydrophobicContact CD1-CG 4.31Å; L297-L309 HydrophobicContact CD2-CD2 3.6Å; L297-L309 HydrophobicContact CD2-CG 4.32Å; L297-I312 HydrophobicContact CD2-CD1 4.31Å
298	S	96.1	Very high	96.8	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-68.5	-25.5	-178	80.1	0	0	0	0	113.7	P252 R258 K294 L295 L296 D300	P252-S298 PolarHBondContact O-OG 3.13Å; R258-S298 WeakPolarHBondContact CD-O 3.5Å; R258-S298 PolarHBondContact NH1-O 3.31Å; K294-S298 VanDerWaalsContact O-CB 3.29Å; K294-S298 WeakPolarHBondContact O-CB 3.38Å; K294-S298 PolarHBondContact O-N 3Å; L295-S298 PolarHBondContact O-N 2.84Å; L295-S298 PolarHBondContact O-OG 2.85Å; L296-S298 VanDerWaalsContact C-N 3.32Å; L296-S298 PolarHBondContact O-N 2.87Å; S298-D300 VanDerWaalsContact C-N 3.3Å; S298-D300 PolarHBondContact O-N 3.42Å
299	L	97.1	Very high	96.8	Very high	2 Å²	2	11 Å²	11	1%	0.01	5%	0.054	C	C	.	.	H	α-helix	trans	-63.7	-36.1	176.6	-64.8	177.6	0	0	0	112.1	F250 P252 R258 L259 L269 F270 L273 L295 L296 L297	F250-L299 HydrophobicContact CZ-CD2 4.1Å; P252-L299 HydrophobicContact CB-CD2 4.15Å; R258-L299 CarbonylContact C-O 3.41Å; R258-L299 VanDerWaalsContact CA-O 3.28Å; R258-L299 WeakPolarHBondContact CA-O 3.19Å; R258-L299 WeakPolarHBondContact CD-O 3.34Å; L259-L299 HydrophobicContact CD1-CD1 4.3Å; L259-L299 HydrophobicContact CD1-CD2 3.99Å; L259-L299 HydrophobicContact CG-CD2 4.2Å; L259-L299 PolarHBondContact N-O 3.29Å; L269-L299 HydrophobicContact CD2-CD1 4.06Å; L269-L299 HydrophobicContact CG-CD1 4.29Å; F270-L299 HydrophobicContact CE1-CB 3.74Å; F270-L299 HydrophobicContact CE1-CD1 4.36Å; F270-L299 HydrophobicContact CZ-CB 3.71Å; F270-L299 HydrophobicContact CZ-CD1 4.37Å; L273-L299 HydrophobicContact CD1-CD1 3.6Å; L295-L299 WeakPolarHBondContact O-CG 3.5Å; L295-L299 PolarHBondContact O-N 3.07Å; L296-L299 PolarHBondContact O-N 3.37Å; L297-L299 VanDerWaalsContact C-N 3.28Å; L297-L299 PolarHBondContact O-N 2.62Å
300	D	95.4	Very high	96.8	Very high	19 Å²	19	11.4 Å²	11.4	10%	0.102	6%	0.057	C	C	.	.	S	Bend	trans	-154.7	75.9	177.5	-172.2	-3.4	0	0	0	110.4	F270 L297 S298 E302 D303 D304 P305	F270-D300 HydrophobicContact CE1-CB 3.93Å; F270-D300 HydrophobicContact CZ-CB 4.06Å; L297-D300 CarbonylContact O-C 3.24Å; L297-D300 VanDerWaalsContact O-C 3.22Å; L297-D300 PolarHBondContact O-N 3.2Å; S298-D300 VanDerWaalsContact C-N 3.3Å; S298-D300 PolarHBondContact O-N 3.42Å; D300-E302 VanDerWaalsContact C-N 3.29Å; D300-E302 PolarHBondContact O-N 3Å; D300-D303 PolarHBondContact OD1-N 3.26Å; D300-D304 WeakPolarHBondContact O-CA 3.4Å; D300-D304 PolarHBondContact O-N 3.39Å; D300-P305 HydrophobicContact CB-CG 4.36Å
301	Y	91.5	Very high	96.8	Very high	28 Å²	28	11.3 Å²	11.3	11%	0.11	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-20.7	-174.2	79	-89.9	0	0	0	113.1	V104 L108 R258 L297 R336	V104-Y301 HydrophobicContact CG1-CD2 4.12Å; L108-Y301 HydrophobicContact CD1-CG 4.37Å; R258-Y301 VanDerWaalsContact NE-CD1 3.34Å; R258-Y301 VanDerWaalsContact NH2-CD1 3.32Å; L297-Y301 WeakPolarHBondContact O-CA 3.26Å; L297-Y301 VanDerWaalsContact O-CB 3.23Å; L297-Y301 WeakPolarHBondContact O-CB 3.36Å; L297-Y301 PolarHBondContact O-N 3.34Å; Y301-R336 PolarHBondContact O-NH1 2.63Å; Y301-R336 VanDerWaalsContact O-NH1 3.13Å
302	E	89.9	Confident	96.8	Very high	63 Å²	63	11.3 Å²	11.3	29%	0.294	6%	0.056	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-58.6	-179.5	-68.6	-69	168.7	0	0	110.2	L91 D300	L91-E302 WeakPolarHBondContact CD1-OE2 3.49Å; D300-E302 VanDerWaalsContact C-N 3.29Å; D300-E302 PolarHBondContact O-N 3Å
303	D	93.4	Very high	96.8	Very high	62 Å²	62	11.4 Å²	11.4	33%	0.332	6%	0.056	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-31.9	-176.8	-79.7	-28.8	0	0	0	112.2	D300 K486	D300-D303 PolarHBondContact OD1-N 3.26Å; D303-K486 PolarHBondContact O-NZ 3.34Å
304	D	96.7	Very high	96.8	Very high	3 Å²	3	11.7 Å²	11.7	2%	0.016	6%	0.058	C	C	.	.			trans	47.9	68.9	-173.4	-177.9	14.9	0	0	0	111.5	L297 D300 L306 T307 V308 L309 R336	L297-D304 HydrophobicContact CD1-CB 4.09Å; D300-D304 WeakPolarHBondContact O-CA 3.4Å; D300-D304 PolarHBondContact O-N 3.39Å; D304-L306 VanDerWaalsContact C-N 3.29Å; D304-L306 PolarHBondContact O-N 2.87Å; D304-T307 VanDerWaalsContact CG-CA 3.42Å; D304-T307 PolarHBondContact O-N 3.42Å; D304-T307 WeakPolarHBondContact OD1-CA 3.22Å; D304-T307 PolarHBondContact OD1-N 2.87Å; D304-T307 VanDerWaalsContact OD1-N 3.16Å; D304-T307 VanDerWaalsContact OD2-CA 3.28Å; D304-T307 WeakPolarHBondContact OD2-CA 3.34Å; D304-V308 PolarHBondContact OD1-N 3.19Å; D304-V308 PolarHBondContact OD2-N 3.1Å; D304-L309 WeakPolarHBondContact OD2-CB 3.46Å; D304-L309 VanDerWaalsContact OD2-CG 3.31Å; D304-L309 WeakPolarHBondContact OD2-CG 3.29Å; D304-L309 PolarHBondContact OD2-N 3.42Å; D304-R336 IonicContact OD2-NH2 2.88Å
305	P	97.3	Very high	96.8	Very high	10 Å²	10	11 Å²	11	7%	0.065	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-23.8	-161.8	25.5	-36.9	0	0	0	115	F261 F270 D300 K486 R489	F261-P305 HydrophobicContact CB-CB 3.73Å; F261-P305 HydrophobicContact CB-CG 3.72Å; F261-P305 HydrophobicContact CD1-CB 3.42Å; F261-P305 VanDerWaalsContact CD1-CB 3.42Å; F261-P305 HydrophobicContact CD1-CG 4.24Å; F261-P305 HydrophobicContact CD2-CB 3.61Å; F261-P305 HydrophobicContact CD2-CG 3.55Å; F261-P305 HydrophobicContact CE1-CB 3.89Å; F261-P305 HydrophobicContact CE2-CB 4.05Å; F261-P305 HydrophobicContact CE2-CG 4.22Å; F261-P305 HydrophobicContact CG-CB 3.28Å; F261-P305 HydrophobicContact CG-CG 3.57Å; F261-P305 HydrophobicContact CZ-CB 4.18Å; F270-P305 HydrophobicContact CD1-CG 3.82Å; F270-P305 HydrophobicContact CE1-CG 3.73Å; D300-P305 HydrophobicContact CB-CG 4.36Å; P305-K486 WeakPolarHBondContact O-CA 3.38Å; P305-K486 VanDerWaalsContact O-CB 3.25Å; P305-K486 WeakPolarHBondContact O-CB 3.49Å; P305-R489 PolarHBondContact O-NH1 3.48Å; P305-R489 VanDerWaalsContact O-NH1 3.07Å
306	L	97.8	Very high	96.8	Very high	2 Å²	2	10.8 Å²	10.8	1%	0.01	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	7.4	174.3	-58.7	-172.3	0	0	0	112.4	F261 F270 F274 D304 V308 R489 H490 L493	F261-L306 HydrophobicContact CE2-CD2 4.02Å; F261-L306 HydrophobicContact CE2-CG 4.3Å; F261-L306 HydrophobicContact CZ-CD2 3.93Å; F270-L306 HydrophobicContact CB-CD1 3.75Å; F270-L306 HydrophobicContact CB-CG 4.32Å; F270-L306 WeakPolarHBondContact O-CD1 3.28Å; F274-L306 HydrophobicContact CB-CD1 3.75Å; F274-L306 HydrophobicContact CD2-CB 3.69Å; F274-L306 HydrophobicContact CD2-CD1 3.82Å; F274-L306 HydrophobicContact CD2-CG 4.4Å; F274-L306 HydrophobicContact CE2-CB 4Å; F274-L306 WeakPolarHBondContact CE2-O 3.38Å; F274-L306 HydrophobicContact CG-CD1 4.1Å; D304-L306 VanDerWaalsContact C-N 3.29Å; D304-L306 PolarHBondContact O-N 2.87Å; L306-V308 PolarHBondContact O-N 3.11Å; L306-R489 HydrophobicContact CD2-CB 3.86Å; L306-R489 HydrophobicContact CD2-CG 4.42Å; L306-H490 WeakPolarHBondContact O-CB 3.5Å; L306-H490 PolarHBondContact O-ND1 2.79Å; L306-H490 VanDerWaalsContact O-ND1 3.13Å; L306-L493 HydrophobicContact CD1-CD1 3.92Å; L306-L493 HydrophobicContact CD2-CD1 3.97Å; L306-L493 HydrophobicContact CG-CD1 4.48Å
307	T	97.6	Very high	96.8	Very high	6 Å²	6	10.7 Å²	10.7	4%	0.037	5%	0.054	C	C	.	.			trans	49.7	50.2	-179.4	-32.6	0	0	0	0	112.9	D304 L309 L310 K486 I487 H490	D304-T307 VanDerWaalsContact CG-CA 3.42Å; D304-T307 PolarHBondContact O-N 3.42Å; D304-T307 WeakPolarHBondContact OD1-CA 3.22Å; D304-T307 PolarHBondContact OD1-N 2.87Å; D304-T307 VanDerWaalsContact OD1-N 3.16Å; D304-T307 VanDerWaalsContact OD2-CA 3.28Å; D304-T307 WeakPolarHBondContact OD2-CA 3.34Å; T307-L309 PolarHBondContact O-N 3.23Å; T307-L309 VanDerWaalsContact O-N 3.13Å; T307-L310 HydrophobicContact CG2-CB 4.46Å; T307-L310 HydrophobicContact CG2-CD1 3.7Å; T307-L310 HydrophobicContact CG2-CG 3.61Å; T307-L310 WeakPolarHBondContact O-CB 3.5Å; T307-L310 PolarHBondContact O-N 3.26Å; T307-K486 WeakPolarHBondContact OG1-CB 3.27Å; T307-K486 WeakPolarHBondContact OG1-CG 3.26Å; T307-K486 PolarHBondContact OG1-O 3.33Å; T307-I487 HydrophobicContact CG2-CG1 4.33Å; T307-I487 PolarHBondContact OG1-N 3.32Å; T307-H490 PolarHBondContact O-CE1 2.93Å; T307-H490 PolarHBondContact O-ND1 3.49Å
308	V	98.3	Very high	96.8	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-62.1	-20.6	179.8	69.7	0	0	0	0	111.7	I277 C293 L296 L297 D304 L306 L310 M311 I312	I277-V308 HydrophobicContact CD1-CG2 4.39Å; C293-V308 HydrophobicContact CB-CG2 3.86Å; L296-V308 HydrophobicContact CD2-CB 4.01Å; L296-V308 HydrophobicContact CD2-CG2 3.96Å; L296-V308 HydrophobicContact CG-CB 4.34Å; L296-V308 HydrophobicContact CG-CG2 4.47Å; L297-V308 HydrophobicContact CB-CG1 3.62Å; L297-V308 HydrophobicContact CD1-CG1 3.85Å; L297-V308 HydrophobicContact CD2-CG1 4.49Å; L297-V308 HydrophobicContact CG-CG1 4.18Å; D304-V308 PolarHBondContact OD1-N 3.19Å; D304-V308 PolarHBondContact OD2-N 3.1Å; L306-V308 PolarHBondContact O-N 3.11Å; V308-L310 PolarHBondContact O-N 2.86Å; V308-L310 VanDerWaalsContact O-N 3.13Å; V308-M311 HydrophobicContact CG2-CE 4.11Å; V308-M311 HydrophobicContact CG2-CG 3.93Å; V308-M311 HydrophobicContact CG2-SD 4.1Å; V308-M311 WeakPolarHBondContact O-CG 3.23Å; V308-M311 PolarHBondContact O-N 2.93Å; V308-I312 PolarHBondContact O-N 3Å; V308-I312 VanDerWaalsContact O-N 3.07Å
309	L	98	Very high	96.9	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-57.5	-20.4	169.3	-74.8	-169.8	0	0	0	114.6	L297 D304 T307 M311 I312 L328 L332 R336 L338 N343 F344	L297-L309 HydrophobicContact CD1-CD2 4.46Å; L297-L309 HydrophobicContact CD1-CG 4.31Å; L297-L309 HydrophobicContact CD2-CD2 3.6Å; L297-L309 HydrophobicContact CD2-CG 4.32Å; D304-L309 WeakPolarHBondContact OD2-CB 3.46Å; D304-L309 VanDerWaalsContact OD2-CG 3.31Å; D304-L309 WeakPolarHBondContact OD2-CG 3.29Å; D304-L309 PolarHBondContact OD2-N 3.42Å; T307-L309 PolarHBondContact O-N 3.23Å; T307-L309 VanDerWaalsContact O-N 3.13Å; L309-M311 VanDerWaalsContact C-N 3.25Å; L309-M311 PolarHBondContact O-N 3.15Å; L309-I312 HydrophobicContact CD2-CG2 3.96Å; L309-L328 HydrophobicContact CD2-CD2 4.42Å; L309-L332 HydrophobicContact CD2-CD1 4.42Å; L309-R336 VanDerWaalsContact CD1-NH1 3.3Å; L309-L338 HydrophobicContact CD1-CD2 3.86Å; L309-N343 PolarHBondContact O-ND2 3.33Å; L309-F344 HydrophobicContact CB-CE2 4.06Å; L309-F344 HydrophobicContact CB-CZ 4.49Å; L309-F344 HydrophobicContact CD2-CE2 4.45Å; L309-F344 HydrophobicContact CD2-CZ 4.08Å; L309-F344 VanDerWaalsContact O-CE2 3.24Å; L309-F344 WeakPolarHBondContact O-CE2 3.28Å
310	L	98	Very high	96.9	Very high	9 Å²	9	23.4 Å²	23.4	5%	0.047	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-78	-4.3	174.3	-71.6	176.2	0	0	0	114.2	T307 V308 L341 L420 R427 I487	T307-L310 HydrophobicContact CG2-CB 4.46Å; T307-L310 HydrophobicContact CG2-CD1 3.7Å; T307-L310 HydrophobicContact CG2-CG 3.61Å; T307-L310 WeakPolarHBondContact O-CB 3.5Å; T307-L310 PolarHBondContact O-N 3.26Å; V308-L310 PolarHBondContact O-N 2.86Å; V308-L310 VanDerWaalsContact O-N 3.13Å; L310-L341 HydrophobicContact CD2-CD1 4.33Å; L310-L341 HydrophobicContact CD2-CD2 4.36Å; L310-L420 HydrophobicContact CD1-CD2 4.03Å; L310-L420 HydrophobicContact CD2-CD2 4.29Å; L310-R427 PolarHBondContact O-NH1 3.17Å; L310-I487 HydrophobicContact CD1-CG1 4.29Å; L310-I487 HydrophobicContact CD1-CG2 4.06Å
311	M	98.1	Very high	97.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.5	-17.6	178.2	66.4	170.3	103.4	0	0	114.2	F274 I277 V308 L309 D313 C314 Y315 H490	F274-M311 HydrophobicContact CD1-CE 4.19Å; F274-M311 HydrophobicContact CD2-CE 3.41Å; F274-M311 VanDerWaalsContact CD2-CE 3.41Å; F274-M311 HydrophobicContact CE1-CE 3.8Å; F274-M311 HydrophobicContact CE2-CE 2.96Å; F274-M311 HydrophobicContact CG-CE 4.02Å; F274-M311 HydrophobicContact CZ-CE 3.18Å; I277-M311 HydrophobicContact CG2-SD 3.65Å; V308-M311 HydrophobicContact CG2-CE 4.11Å; V308-M311 HydrophobicContact CG2-CG 3.93Å; V308-M311 HydrophobicContact CG2-SD 4.1Å; V308-M311 WeakPolarHBondContact O-CG 3.23Å; V308-M311 PolarHBondContact O-N 2.93Å; L309-M311 VanDerWaalsContact C-N 3.25Å; L309-M311 PolarHBondContact O-N 3.15Å; M311-D313 VanDerWaalsContact C-N 3.26Å; M311-D313 PolarHBondContact O-N 2.93Å; M311-C314 WeakPolarHBondContact O-CB 3.45Å; M311-C314 PolarHBondContact O-N 3.06Å; M311-Y315 HydrophobicContact CB-CE2 4.07Å; M311-Y315 HydrophobicContact CG-CE2 4.02Å; M311-Y315 WeakPolarHBondContact O-CD2 3.48Å; M311-Y315 HydrophobicContact SD-CE2 3.73Å; M311-H490 VanDerWaalsContact CE-CE1 3.5Å; M311-H490 WeakPolarHBondContact CE-CE1 3.17Å
312	I	98.6	Very high	97.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-34.2	-173	-164.7	166.4	0	0	0	112.9	L290 C293 L297 V308 L309 Y315 A316 F324 L328 F344	L290-I312 HydrophobicContact CD1-CG1 3.83Å; C293-I312 HydrophobicContact CB-CB 4.29Å; C293-I312 HydrophobicContact CB-CD1 4Å; C293-I312 HydrophobicContact CB-CG1 3.81Å; L297-I312 HydrophobicContact CD2-CD1 4.31Å; V308-I312 PolarHBondContact O-N 3Å; V308-I312 VanDerWaalsContact O-N 3.07Å; L309-I312 HydrophobicContact CD2-CG2 3.96Å; I312-Y315 PolarHBondContact O-N 3.16Å; I312-A316 WeakPolarHBondContact O-CB 3.24Å; I312-A316 PolarHBondContact O-N 3.23Å; I312-F324 HydrophobicContact CD1-CE1 4.18Å; I312-F324 HydrophobicContact CD1-CZ 4.1Å; I312-F324 HydrophobicContact CG1-CE1 4.34Å; I312-L328 HydrophobicContact CD1-CD2 3.85Å; I312-L328 HydrophobicContact CG2-CD2 4.28Å; I312-F344 HydrophobicContact CG2-CZ 4.05Å
313	D	98.5	Very high	97.8	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.011	13%	0.129	C	C	.	.	H	α-helix	trans	-64.6	-41.2	179.7	63.8	-60.4	0	0	0	111.7	M311 Y315 A316 I317 L325 N343 S347 Y424	M311-D313 VanDerWaalsContact C-N 3.26Å; M311-D313 PolarHBondContact O-N 2.93Å; D313-Y315 PolarHBondContact O-N 3.26Å; D313-A316 PolarHBondContact O-N 2.99Å; D313-I317 WeakPolarHBondContact O-CB 3.43Å; D313-I317 VanDerWaalsContact O-CG1 3.3Å; D313-I317 WeakPolarHBondContact O-CG1 3.44Å; D313-I317 PolarHBondContact O-N 3.38Å; D313-L325 HydrophobicContact CB-CD1 3.82Å; D313-L325 HydrophobicContact CB-CD2 3.88Å; D313-N343 PolarHBondContact OD1-ND2 2.93Å; D313-S347 WeakPolarHBondContact OD2-CB 3.49Å; D313-S347 PolarHBondContact OD2-OG 3.39Å; D313-Y424 WeakPolarHBondContact OD2-CE2 3.4Å
314	C	98.1	Very high	98	Very high	6 Å²	6	28.2 Å²	28.2	4%	0.041	12%	0.117	C	C	.	.	H	α-helix	trans	-55	-55.6	175.8	172.9	0	0	0	0	110.8	M311 A316 I317 Y318 M428	M311-C314 WeakPolarHBondContact O-CB 3.45Å; M311-C314 PolarHBondContact O-N 3.06Å; C314-A316 PolarHBondContact O-N 2.96Å; C314-I317 PolarHBondContact O-N 3.14Å; C314-Y318 VanDerWaalsContact O-CD2 3.23Å; C314-Y318 WeakPolarHBondContact O-CD2 3.43Å; C314-Y318 PolarHBondContact O-N 3.43Å; C314-Y318 WeakPolarHBondContact SG-CD2 3.28Å; C314-Y318 WeakPolarHBondContact SG-CE2 3.38Å; C314-M428 VanDerWaalsContact CA-SD 3.59Å; C314-M428 HydrophobicContact CB-SD 3.69Å; C314-M428 VanDerWaalsContact SG-SD 3.69Å
315	Y	98.6	Very high	98.1	Very high	8 Å²	8	28 Å²	28	3%	0.031	12%	0.116	C	C	.	.	H	α-helix	trans	-70.8	-32	-177.5	-53.7	-45.5	0	0	0	113.2	I277 S281 Y286 A289 C293 M311 I312 D313 I317 S319	I277-Y315 HydrophobicContact CG2-CD2 4.08Å; I277-Y315 HydrophobicContact CG2-CE2 3.32Å; S281-Y315 WeakPolarHBondContact CB-OH 3.27Å; S281-Y315 PolarHBondContact OG-OH 3.47Å; Y286-Y315 AromaticContact CD1-CD1 3.93Å; Y286-Y315 HydrophobicContact CD1-CD1 3.93Å; Y286-Y315 HydrophobicContact CD1-CE1 4.38Å; A289-Y315 HydrophobicContact CB-CD1 3.98Å; A289-Y315 HydrophobicContact CB-CD2 3.97Å; A289-Y315 HydrophobicContact CB-CE1 4.3Å; A289-Y315 HydrophobicContact CB-CE2 4.27Å; A289-Y315 HydrophobicContact CB-CG 3.79Å; C293-Y315 VanDerWaalsContact SG-CD2 3.52Å; M311-Y315 HydrophobicContact CB-CE2 4.07Å; M311-Y315 HydrophobicContact CG-CE2 4.02Å; M311-Y315 WeakPolarHBondContact O-CD2 3.48Å; M311-Y315 HydrophobicContact SD-CE2 3.73Å; I312-Y315 PolarHBondContact O-N 3.16Å; D313-Y315 PolarHBondContact O-N 3.26Å; Y315-I317 VanDerWaalsContact C-N 3.32Å; Y315-I317 PolarHBondContact O-N 3.39Å; Y315-S319 VanDerWaalsContact O-CB 3.26Å; Y315-S319 WeakPolarHBondContact O-CB 3.19Å; Y315-S319 PolarHBondContact O-N 2.85Å; Y315-S319 PolarHBondContact O-OG 3.39Å
316	A	98.7	Very high	98.1	Very high	0 Å²	0	28 Å²	28	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.7	-43	173.1	0	0	0	0	0	111.2	L290 I312 D313 C314 S319 R320 Q321 F324 L325	L290-A316 HydrophobicContact CD1-CB 3.87Å; L290-A316 HydrophobicContact CD2-CB 4.39Å; I312-A316 WeakPolarHBondContact O-CB 3.24Å; I312-A316 PolarHBondContact O-N 3.23Å; D313-A316 PolarHBondContact O-N 2.99Å; C314-A316 PolarHBondContact O-N 2.96Å; A316-S319 PolarHBondContact O-OG 3.2Å; A316-R320 PolarHBondContact O-N 2.94Å; A316-Q321 WeakPolarHBondContact O-CA 3.41Å; A316-Q321 PolarHBondContact O-N 3.13Å; A316-F324 HydrophobicContact CB-CD1 4.16Å; A316-F324 HydrophobicContact CB-CE1 4.49Å; A316-L325 HydrophobicContact CB-CB 3.86Å; A316-L325 HydrophobicContact CB-CD1 4.42Å; A316-L325 HydrophobicContact CB-CD2 4.3Å; A316-L325 HydrophobicContact CB-CG 4.41Å
317	I	98.5	Very high	98.1	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.015	12%	0.124	C	C	.	.	H	α-helix	trans	-71.7	-48.5	179.6	-69.5	173.2	0	0	0	111.4	D313 C314 Y315 S319 R320 Y322 L325 L350 A351 L354 M428 L431	D313-I317 WeakPolarHBondContact O-CB 3.43Å; D313-I317 VanDerWaalsContact O-CG1 3.3Å; D313-I317 WeakPolarHBondContact O-CG1 3.44Å; D313-I317 PolarHBondContact O-N 3.38Å; C314-I317 PolarHBondContact O-N 3.14Å; Y315-I317 VanDerWaalsContact C-N 3.32Å; Y315-I317 PolarHBondContact O-N 3.39Å; I317-S319 PolarHBondContact O-N 2.91Å; I317-R320 PolarHBondContact O-N 3.35Å; I317-Y322 HydrophobicContact CB-CE1 4.4Å; I317-Y322 HydrophobicContact CG1-CD1 4.38Å; I317-Y322 HydrophobicContact CG2-CE1 4.03Å; I317-Y322 WeakPolarHBondContact O-CE1 3.47Å; I317-L325 HydrophobicContact CD1-CD2 3.87Å; I317-L325 HydrophobicContact CG1-CD2 3.75Å; I317-L350 HydrophobicContact CD1-CD2 4.29Å; I317-A351 HydrophobicContact CD1-CB 4.5Å; I317-A351 HydrophobicContact CG1-CB 4.42Å; I317-L354 HydrophobicContact CG2-CD1 3.89Å; I317-M428 HydrophobicContact CB-CE 4.21Å; I317-M428 HydrophobicContact CD1-CE 3.76Å; I317-M428 HydrophobicContact CG2-CE 4.13Å; I317-L431 HydrophobicContact CB-CD2 4.43Å; I317-L431 HydrophobicContact CG2-CD2 3.12Å
318	Y	97.7	Very high	98.1	Very high	61 Å²	61	29.4 Å²	29.4	24%	0.239	12%	0.123	C	C	.	.	H	α-helix	trans	-60.8	-32.9	178.7	-83.7	-68.2	0	0	0	113	Y286 C314 R320 R427 M428	Y286-Y318 HydrophobicContact CD1-CD2 4.48Å; Y286-Y318 HydrophobicContact CD1-CG 4.27Å; Y286-Y318 HydrophobicContact CD2-CD1 4.33Å; Y286-Y318 HydrophobicContact CD2-CG 4.13Å; Y286-Y318 HydrophobicContact CE1-CD2 4.38Å; Y286-Y318 HydrophobicContact CE1-CG 4.28Å; Y286-Y318 AromaticContact CE2-CD1 3.99Å; Y286-Y318 HydrophobicContact CE2-CD1 3.99Å; Y286-Y318 HydrophobicContact CE2-CG 4.12Å; Y286-Y318 VanDerWaalsContact CG-CB 3.47Å; Y286-Y318 HydrophobicContact CG-CG 4.18Å; C314-Y318 VanDerWaalsContact O-CD2 3.23Å; C314-Y318 WeakPolarHBondContact O-CD2 3.43Å; C314-Y318 PolarHBondContact O-N 3.43Å; C314-Y318 WeakPolarHBondContact SG-CD2 3.28Å; C314-Y318 WeakPolarHBondContact SG-CE2 3.38Å; Y318-R320 VanDerWaalsContact C-N 3.31Å; Y318-R427 PolarHBondContact OH-O 3.28Å; Y318-M428 HydrophobicContact CD2-SD 4.43Å; Y318-M428 HydrophobicContact CE2-SD 3.88Å
319	S	97.4	Very high	98	Very high	17 Å²	17	31 Å²	31	12%	0.119	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	10.3	175	68	0	0	0	0	114.4	Y315 A316 I317 Q321	Y315-S319 VanDerWaalsContact O-CB 3.26Å; Y315-S319 WeakPolarHBondContact O-CB 3.19Å; Y315-S319 PolarHBondContact O-N 2.85Å; Y315-S319 PolarHBondContact O-OG 3.39Å; A316-S319 PolarHBondContact O-OG 3.2Å; I317-S319 PolarHBondContact O-N 2.91Å; S319-Q321 PolarHBondContact O-N 3.31Å; S319-Q321 PolarHBondContact O-NE2 3.05Å; S319-Q321 WeakPolarHBondContact OG-CG 3.44Å
320	R	97.7	Very high	97.9	Very high	192 Å²	192	34.6 Å²	34.6	73%	0.725	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	26.6	178.4	-48.6	-176.7	-178.8	-164	-0.1	114.3	A316 I317 Y318 Y322	A316-R320 PolarHBondContact O-N 2.94Å; I317-R320 PolarHBondContact O-N 3.35Å; Y318-R320 VanDerWaalsContact C-N 3.31Å; R320-Y322 HydrophobicContact CB-CE2 4.01Å; R320-Y322 PolarHBondContact O-N 3.02Å
321	Q	98.1	Very high	97.7	Very high	59 Å²	59	34.6 Å²	34.6	28%	0.276	15%	0.149	S	C	.	.			trans	-89.3	50.8	174.3	-59.8	-51.9	-69.8	0	0	111.2	L290 A316 S319 R323 F324 L325	L290-Q321 HydrophobicContact CD2-CB 3.69Å; L290-Q321 HydrophobicContact CD2-CG 3.56Å; A316-Q321 WeakPolarHBondContact O-CA 3.41Å; A316-Q321 PolarHBondContact O-N 3.13Å; S319-Q321 PolarHBondContact O-N 3.31Å; S319-Q321 PolarHBondContact O-NE2 3.05Å; S319-Q321 WeakPolarHBondContact OG-CG 3.44Å; Q321-R323 VanDerWaalsContact C-N 3.34Å; Q321-R323 PolarHBondContact O-N 2.87Å; Q321-F324 HydrophobicContact CB-CB 4.18Å; Q321-F324 PolarHBondContact O-N 3.33Å; Q321-L325 PolarHBondContact O-N 2.99Å
322	Y	98.4	Very high	97.6	Very high	38 Å²	38	35 Å²	35	15%	0.149	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-43.4	-176.7	-46.9	-52.5	0	0	0	111.9	I317 R320 F324 L325 I326 A351 L354 I355	I317-Y322 HydrophobicContact CB-CE1 4.4Å; I317-Y322 HydrophobicContact CG1-CD1 4.38Å; I317-Y322 HydrophobicContact CG2-CE1 4.03Å; I317-Y322 WeakPolarHBondContact O-CE1 3.47Å; R320-Y322 HydrophobicContact CB-CE2 4.01Å; R320-Y322 PolarHBondContact O-N 3.02Å; Y322-F324 PolarHBondContact O-N 3.16Å; Y322-L325 PolarHBondContact O-N 3.48Å; Y322-L325 VanDerWaalsContact O-N 3.14Å; Y322-I326 WeakPolarHBondContact O-CG1 3.33Å; Y322-I326 PolarHBondContact O-N 3.45Å; Y322-A351 HydrophobicContact CD1-CB 4.45Å; Y322-L354 HydrophobicContact CD1-CB 4.08Å; Y322-L354 HydrophobicContact CD1-CD1 4.44Å; Y322-L354 HydrophobicContact CD2-CB 4.14Å; Y322-L354 HydrophobicContact CE1-CB 3.74Å; Y322-L354 HydrophobicContact CE1-CD1 3.72Å; Y322-L354 HydrophobicContact CE1-CG 4.38Å; Y322-L354 HydrophobicContact CE2-CB 3.78Å; Y322-L354 WeakPolarHBondContact CE2-O 3.48Å; Y322-L354 HydrophobicContact CG-CB 4.27Å; Y322-I355 HydrophobicContact CD2-CB 4.12Å; Y322-I355 HydrophobicContact CG-CB 4.42Å
323	R	97.9	Very high	97.3	Very high	156 Å²	156	36.5 Å²	36.5	59%	0.589	16%	0.159	S	C	*	.	H	α-helix	trans	-58.9	-45.9	179.1	-175.1	55	136.4	102.4	-0.6	112.1	Q321 L325 I326 D327 I355	Q321-R323 VanDerWaalsContact C-N 3.34Å; Q321-R323 PolarHBondContact O-N 2.87Å; R323-L325 VanDerWaalsContact C-N 3.32Å; R323-L325 PolarHBondContact O-N 3.49Å; R323-I326 PolarHBondContact O-N 3.43Å; R323-D327 IonicContact CZ-OD1 3.33Å; R323-D327 VanDerWaalsContact NH1-CG 3.35Å; R323-D327 IonicContact NH1-OD1 3.99Å; R323-D327 PolarHBondContact NH1-OD1 2.71Å; R323-D327 IonicContact NH1-OD2 3.64Å; R323-D327 PolarHBondContact NH1-OD2 3.33Å; R323-D327 WeakPolarHBondContact O-CB 3.4Å; R323-D327 PolarHBondContact O-N 2.85Å; R323-I355 HydrophobicContact CB-CD1 3.83Å
324	F	98.3	Very high	97	Very high	20 Å²	20	39.8 Å²	39.8	9%	0.088	19%	0.193	C	C	.	.	H	α-helix	trans	-57.7	-45.7	175.6	161.7	-98.4	0	0	0	111.7	L107 L290 K294 I312 A316 Q321 Y322 I326 D327 L328	L107-F324 HydrophobicContact CB-CE2 4.28Å; L107-F324 HydrophobicContact CD2-CD2 4.31Å; L107-F324 WeakPolarHBondContact O-CE2 3.28Å; L290-F324 HydrophobicContact CD1-CD1 4.15Å; L290-F324 HydrophobicContact CD1-CE1 3.7Å; L290-F324 HydrophobicContact CD2-CD1 4.24Å; L290-F324 HydrophobicContact CG-CE1 4.46Å; K294-F324 HydrophobicContact CD-CE2 4.33Å; K294-F324 HydrophobicContact CD-CZ 4.28Å; K294-F324 VanDerWaalsContact CE-CZ 3.43Å; K294-F324 HydrophobicContact CG-CE2 4.39Å; K294-F324 HydrophobicContact CG-CZ 3.97Å; I312-F324 HydrophobicContact CD1-CE1 4.18Å; I312-F324 HydrophobicContact CD1-CZ 4.1Å; I312-F324 HydrophobicContact CG1-CE1 4.34Å; A316-F324 HydrophobicContact CB-CD1 4.16Å; A316-F324 HydrophobicContact CB-CE1 4.49Å; Q321-F324 HydrophobicContact CB-CB 4.18Å; Q321-F324 PolarHBondContact O-N 3.33Å; Y322-F324 PolarHBondContact O-N 3.16Å; F324-I326 PolarHBondContact O-N 2.9Å; F324-D327 PolarHBondContact O-N 2.98Å; F324-L328 HydrophobicContact CE1-CD2 4.18Å; F324-L328 HydrophobicContact CE2-CB 4.47Å; F324-L328 HydrophobicContact CZ-CB 4.39Å; F324-L328 HydrophobicContact CZ-CD2 3.88Å; F324-L328 VanDerWaalsContact O-CB 3.26Å; F324-L328 WeakPolarHBondContact O-CB 3.45Å; F324-L328 PolarHBondContact O-N 3.27Å
325	L	98.5	Very high	96.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.7	-42.3	-179.7	-178.9	59.4	0	0	0	111.8	D313 A316 I317 Q321 Y322 R323 L328 Y329 F344 I348 A351	D313-L325 HydrophobicContact CB-CD1 3.82Å; D313-L325 HydrophobicContact CB-CD2 3.88Å; A316-L325 HydrophobicContact CB-CB 3.86Å; A316-L325 HydrophobicContact CB-CD1 4.42Å; A316-L325 HydrophobicContact CB-CD2 4.3Å; A316-L325 HydrophobicContact CB-CG 4.41Å; I317-L325 HydrophobicContact CD1-CD2 3.87Å; I317-L325 HydrophobicContact CG1-CD2 3.75Å; Q321-L325 PolarHBondContact O-N 2.99Å; Y322-L325 PolarHBondContact O-N 3.48Å; Y322-L325 VanDerWaalsContact O-N 3.14Å; R323-L325 VanDerWaalsContact C-N 3.32Å; R323-L325 PolarHBondContact O-N 3.49Å; L325-L328 PolarHBondContact O-N 2.82Å; L325-Y329 WeakPolarHBondContact O-CB 3.45Å; L325-Y329 PolarHBondContact O-N 2.76Å; L325-F344 HydrophobicContact CD1-CE1 3.91Å; L325-I348 HydrophobicContact CD1-CD1 4.39Å; L325-I348 HydrophobicContact CD2-CD1 4.36Å; L325-I348 HydrophobicContact CG-CD1 3.87Å; L325-A351 HydrophobicContact CD2-CB 4.1Å
326	I	97.7	Very high	96.2	Very high	10 Å²	10	40.3 Å²	40.3	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-63.2	-48	177.3	-65.6	162.1	0	0	0	110.2	Y322 R323 F324 L328 Y329 D330 A351 R352 I355	Y322-I326 WeakPolarHBondContact O-CG1 3.33Å; Y322-I326 PolarHBondContact O-N 3.45Å; R323-I326 PolarHBondContact O-N 3.43Å; F324-I326 PolarHBondContact O-N 2.9Å; I326-L328 VanDerWaalsContact C-N 3.33Å; I326-L328 PolarHBondContact O-N 3.43Å; I326-Y329 PolarHBondContact O-N 2.83Å; I326-D330 WeakPolarHBondContact O-CB 3.25Å; I326-D330 PolarHBondContact O-N 2.76Å; I326-A351 HydrophobicContact CD1-CB 4.44Å; I326-A351 HydrophobicContact CG1-CB 4.25Å; I326-R352 HydrophobicContact CD1-CG 3.74Å; I326-R352 HydrophobicContact CG1-CG 4.08Å; I326-I355 HydrophobicContact CD1-CG2 4.13Å
327	D	97.6	Very high	96	Very high	36 Å²	36	43.5 Å²	43.5	19%	0.193	21%	0.214	C	C	.	.	H	α-helix	trans	-64.5	-37.9	179.6	-63	-21.4	0	0	0	111.8	L107 R323 F324 S331	L107-D327 HydrophobicContact CD1-CB 4.12Å; L107-D327 WeakPolarHBondContact CD1-O 3.38Å; L107-D327 HydrophobicContact CD2-CB 3.74Å; R323-D327 IonicContact CZ-OD1 3.33Å; R323-D327 VanDerWaalsContact NH1-CG 3.35Å; R323-D327 IonicContact NH1-OD1 3.99Å; R323-D327 PolarHBondContact NH1-OD1 2.71Å; R323-D327 IonicContact NH1-OD2 3.64Å; R323-D327 PolarHBondContact NH1-OD2 3.33Å; R323-D327 WeakPolarHBondContact O-CB 3.4Å; R323-D327 PolarHBondContact O-N 2.85Å; F324-D327 PolarHBondContact O-N 2.98Å; D327-S331 WeakPolarHBondContact O-CB 3.45Å; D327-S331 PolarHBondContact O-N 3.14Å; D327-S331 PolarHBondContact O-OG 3.24Å
328	L	97.4	Very high	95.9	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-43.7	174.1	-178.1	68.9	0	0	0	111.5	L108 L309 I312 F324 L325 I326 S331 L332	L108-L328 HydrophobicContact CD2-CD1 4.44Å; L309-L328 HydrophobicContact CD2-CD2 4.42Å; I312-L328 HydrophobicContact CD1-CD2 3.85Å; I312-L328 HydrophobicContact CG2-CD2 4.28Å; F324-L328 HydrophobicContact CE1-CD2 4.18Å; F324-L328 HydrophobicContact CE2-CB 4.47Å; F324-L328 HydrophobicContact CZ-CB 4.39Å; F324-L328 HydrophobicContact CZ-CD2 3.88Å; F324-L328 VanDerWaalsContact O-CB 3.26Å; F324-L328 WeakPolarHBondContact O-CB 3.45Å; F324-L328 PolarHBondContact O-N 3.27Å; L325-L328 PolarHBondContact O-N 2.82Å; I326-L328 VanDerWaalsContact C-N 3.33Å; I326-L328 PolarHBondContact O-N 3.43Å; L328-S331 WeakPolarHBondContact CA-OG 3.34Å; L328-S331 PolarHBondContact O-OG 3.01Å; L328-L332 HydrophobicContact CD1-CD1 3.58Å; L328-L332 HydrophobicContact CD1-CG 4.24Å; L328-L332 HydrophobicContact CG-CD1 4.02Å; L328-L332 WeakPolarHBondContact O-CB 3.36Å; L328-L332 WeakPolarHBondContact O-CG 3.18Å; L328-L332 PolarHBondContact O-N 3.29Å; L328-L332 VanDerWaalsContact O-N 3.1Å
329	Y	96.9	Very high	95.8	Very high	33 Å²	33	44.2 Å²	44.2	13%	0.129	22%	0.216	C	C	.	.	H	α-helix	trans	-64.9	-49.6	176.7	171.2	-97.6	0	0	0	111.4	L325 I326 S331 L332 N333 L338 Y339 F344 I348	L325-Y329 WeakPolarHBondContact O-CB 3.45Å; L325-Y329 PolarHBondContact O-N 2.76Å; I326-Y329 PolarHBondContact O-N 2.83Å; Y329-S331 PolarHBondContact O-N 3.27Å; Y329-L332 PolarHBondContact O-N 2.96Å; Y329-N333 HydrophobicContact CD1-CB 4.43Å; Y329-N333 HydrophobicContact CD2-CB 4.02Å; Y329-N333 HydrophobicContact CE1-CB 4.23Å; Y329-N333 HydrophobicContact CE2-CB 3.8Å; Y329-N333 WeakPolarHBondContact CE2-OD1 3.49Å; Y329-N333 HydrophobicContact CG-CB 4.34Å; Y329-N333 VanDerWaalsContact CZ-CG 3.48Å; Y329-N333 WeakPolarHBondContact O-CA 3.42Å; Y329-N333 WeakPolarHBondContact O-CB 3.36Å; Y329-N333 PolarHBondContact O-N 3.31Å; Y329-N333 PolarHBondContact OH-ND2 2.9Å; Y329-L338 HydrophobicContact CD2-CB 3.89Å; Y329-L338 HydrophobicContact CD2-CD1 4.28Å; Y329-L338 HydrophobicContact CE2-CB 3.97Å; Y329-Y339 WeakPolarHBondContact OH-CB 3.38Å; Y329-F344 HydrophobicContact CD2-CB 4.29Å; Y329-F344 AromaticContact CD2-CD1 3.8Å; Y329-F344 HydrophobicContact CD2-CD1 3.8Å; Y329-F344 HydrophobicContact CD2-CG 4.32Å; Y329-F344 HydrophobicContact CE2-CB 4.38Å; Y329-I348 HydrophobicContact CD1-CD1 4.14Å; Y329-I348 HydrophobicContact CD1-CG1 4.03Å; Y329-I348 HydrophobicContact CD1-CG2 3.96Å; Y329-I348 HydrophobicContact CD2-CD1 4.02Å; Y329-I348 HydrophobicContact CD2-CG1 3.66Å; Y329-I348 HydrophobicContact CE1-CG1 4.42Å; Y329-I348 HydrophobicContact CE1-CG2 4.06Å; Y329-I348 HydrophobicContact CE2-CG1 4.08Å; Y329-I348 HydrophobicContact CG-CD1 3.58Å; Y329-I348 HydrophobicContact CG-CG1 3.62Å; Y329-I348 HydrophobicContact CG-CG2 4.42Å
330	D	94.9	Very high	95.7	Very high	77 Å²	77	44.5 Å²	44.5	41%	0.412	22%	0.216	S	C	.	.	H	α-helix	trans	-61.3	-34.4	-178.5	-75.2	-10	0	0	0	111.7	I326 R352	I326-D330 WeakPolarHBondContact O-CB 3.25Å; I326-D330 PolarHBondContact O-N 2.76Å; D330-R352 IonicContact OD1-NH2 3.16Å
331	S	94.7	Very high	95.7	Very high	8 Å²	8	35.7 Å²	35.7	6%	0.056	18%	0.184	C	C	.	.	H	α-helix	trans	-75.4	-33.9	177	57	0	0	0	0	114.3	L107 D327 L328 Y329	L107-S331 WeakPolarHBondContact CD1-OG 3.41Å; D327-S331 WeakPolarHBondContact O-CB 3.45Å; D327-S331 PolarHBondContact O-N 3.14Å; D327-S331 PolarHBondContact O-OG 3.24Å; L328-S331 WeakPolarHBondContact CA-OG 3.34Å; L328-S331 PolarHBondContact O-OG 3.01Å; Y329-S331 PolarHBondContact O-N 3.27Å
332	L	94.8	Very high	95.6	Very high	8 Å²	8	33 Å²	33	4%	0.042	17%	0.171	C	C	.	.	H	α-helix	trans	-99.9	-23.1	-175.4	-68.8	179.9	0	0	0	114.3	V104 L309 L328 Y329 G334 S335 R336 L338	V104-L332 HydrophobicContact CG1-CD2 4.06Å; V104-L332 HydrophobicContact CG2-CD2 3.59Å; V104-L332 HydrophobicContact CG2-CG 4.17Å; L309-L332 HydrophobicContact CD2-CD1 4.42Å; L328-L332 HydrophobicContact CD1-CD1 3.58Å; L328-L332 HydrophobicContact CD1-CG 4.24Å; L328-L332 HydrophobicContact CG-CD1 4.02Å; L328-L332 WeakPolarHBondContact O-CB 3.36Å; L328-L332 WeakPolarHBondContact O-CG 3.18Å; L328-L332 PolarHBondContact O-N 3.29Å; L328-L332 VanDerWaalsContact O-N 3.1Å; Y329-L332 PolarHBondContact O-N 2.96Å; L332-G334 VanDerWaalsContact C-N 3.29Å; L332-G334 PolarHBondContact O-N 3.43Å; L332-S335 PolarHBondContact O-N 3.25Å; L332-S335 PolarHBondContact O-OG 3.07Å; L332-R336 WeakPolarHBondContact O-CB 3.17Å; L332-R336 PolarHBondContact O-N 3.18Å; L332-L338 HydrophobicContact CB-CD1 3.62Å; L332-L338 HydrophobicContact CB-CG 4.34Å; L332-L338 HydrophobicContact CD1-CD1 4.42Å
333	N	94	Very high	95.6	Very high	33 Å²	33	31.4 Å²	31.4	18%	0.176	17%	0.165	C	C	.	.	H	α-helix	trans	-63.8	-34.7	-170.7	-173.8	60.8	0	0	0	112.5	Y329 S335 N337 L338 Y339	Y329-N333 HydrophobicContact CD1-CB 4.43Å; Y329-N333 HydrophobicContact CD2-CB 4.02Å; Y329-N333 HydrophobicContact CE1-CB 4.23Å; Y329-N333 HydrophobicContact CE2-CB 3.8Å; Y329-N333 WeakPolarHBondContact CE2-OD1 3.49Å; Y329-N333 HydrophobicContact CG-CB 4.34Å; Y329-N333 VanDerWaalsContact CZ-CG 3.48Å; Y329-N333 WeakPolarHBondContact O-CA 3.42Å; Y329-N333 WeakPolarHBondContact O-CB 3.36Å; Y329-N333 PolarHBondContact O-N 3.31Å; Y329-N333 PolarHBondContact OH-ND2 2.9Å; N333-S335 VanDerWaalsContact C-N 3.33Å; N333-S335 PolarHBondContact O-N 2.97Å; N333-N337 VanDerWaalsContact O-CA 3.27Å; N333-N337 WeakPolarHBondContact O-CA 3.5Å; N333-N337 PolarHBondContact O-N 3.32Å; N333-L338 HydrophobicContact CB-CB 4.43Å; N333-L338 WeakPolarHBondContact OD1-CA 3.28Å; N333-L338 PolarHBondContact OD1-N 3.21Å; N333-Y339 WeakPolarHBondContact OD1-CD1 3.26Å; N333-Y339 PolarHBondContact OD1-N 3.06Å
334	G	90.7	Very high	95.6	Very high	70 Å²	70	24 Å²	24	72%	0.722	14%	0.137	S	C	*	.	H	α-helix	trans	-63.7	-33.5	179.1	0	0	0	0	0	114.2	L332	L332-G334 VanDerWaalsContact C-N 3.29Å; L332-G334 PolarHBondContact O-N 3.43Å
335	S	90.5	Very high	95.6	Very high	16 Å²	16	23.5 Å²	23.5	11%	0.112	14%	0.138	C	C	.	.	H	α-helix	trans	-98	-31	179.8	58.3	0	0	0	0	113	L332 N333	L332-S335 PolarHBondContact O-N 3.25Å; L332-S335 PolarHBondContact O-OG 3.07Å; N333-S335 VanDerWaalsContact C-N 3.33Å; N333-S335 PolarHBondContact O-N 2.97Å
336	R	90.8	Very high	95.6	Very high	9 Å²	9	23.5 Å²	23.5	3%	0.034	14%	0.138	C	C	.	.	H	α-helix	trans	-106.5	-5.8	-172.3	-64.1	-167.5	63.3	166.3	-2.9	114.8	I89 Y301 D304 L309 L332 L338	I89-R336 HydrophobicContact CG2-CB 3.67Å; I89-R336 HydrophobicContact CG2-CG 3.71Å; Y301-R336 PolarHBondContact O-NH1 2.63Å; Y301-R336 VanDerWaalsContact O-NH1 3.13Å; D304-R336 IonicContact OD2-NH2 2.88Å; L309-R336 VanDerWaalsContact CD1-NH1 3.3Å; L332-R336 WeakPolarHBondContact O-CB 3.17Å; L332-R336 PolarHBondContact O-N 3.18Å; R336-L338 VanDerWaalsContact C-N 3.27Å; R336-L338 HydrophobicContact CB-CD2 3.75Å; R336-L338 HydrophobicContact CB-CG 4.09Å; R336-L338 PolarHBondContact O-N 3.01Å
337	N	94.2	Very high	95.6	Very high	68 Å²	68	23 Å²	23	36%	0.364	14%	0.135	S	C	.	.			trans	49.4	47.6	-177.2	-59.4	-67.3	0	0	0	112.2	N333 Y339 L340	N333-N337 VanDerWaalsContact O-CA 3.27Å; N333-N337 WeakPolarHBondContact O-CA 3.5Å; N333-N337 PolarHBondContact O-N 3.32Å; N337-Y339 HydrophobicContact CB-CD1 4.18Å; N337-Y339 HydrophobicContact CB-CE1 3.7Å; N337-Y339 PolarHBondContact O-N 3.45Å; N337-Y339 VanDerWaalsContact O-N 3.14Å; N337-L340 HydrophobicContact CB-CD1 3.64Å; N337-L340 HydrophobicContact CB-CG 4.15Å; N337-L340 WeakPolarHBondContact O-CB 3.45Å; N337-L340 PolarHBondContact O-N 3.36Å
338	L	96	Very high	95.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-57.8	-29.1	-174.8	-64.2	-174.5	0	0	0	112.9	L309 Y329 L332 N333 R336 L340 L341 F344	L309-L338 HydrophobicContact CD1-CD2 3.86Å; Y329-L338 HydrophobicContact CD2-CB 3.89Å; Y329-L338 HydrophobicContact CD2-CD1 4.28Å; Y329-L338 HydrophobicContact CE2-CB 3.97Å; L332-L338 HydrophobicContact CB-CD1 3.62Å; L332-L338 HydrophobicContact CB-CG 4.34Å; L332-L338 HydrophobicContact CD1-CD1 4.42Å; N333-L338 HydrophobicContact CB-CB 4.43Å; N333-L338 WeakPolarHBondContact OD1-CA 3.28Å; N333-L338 PolarHBondContact OD1-N 3.21Å; R336-L338 VanDerWaalsContact C-N 3.27Å; R336-L338 HydrophobicContact CB-CD2 3.75Å; R336-L338 HydrophobicContact CB-CG 4.09Å; R336-L338 PolarHBondContact O-N 3.01Å; L338-L340 PolarHBondContact O-N 3.37Å; L338-L341 HydrophobicContact CD2-CD1 4.23Å; L338-L341 WeakPolarHBondContact O-CB 3.48Å; L338-L341 PolarHBondContact O-N 3.49Å; L338-F344 HydrophobicContact CB-CB 4.15Å; L338-F344 HydrophobicContact CB-CD1 4.36Å; L338-F344 HydrophobicContact CB-CD2 4.01Å; L338-F344 HydrophobicContact CB-CG 3.91Å; L338-F344 HydrophobicContact CD1-CD1 4.22Å; L338-F344 HydrophobicContact CD1-CD2 4.36Å; L338-F344 HydrophobicContact CD1-CE1 3.98Å; L338-F344 HydrophobicContact CD1-CE2 4.13Å; L338-F344 HydrophobicContact CD1-CG 4.41Å; L338-F344 HydrophobicContact CD1-CZ 3.94Å; L338-F344 HydrophobicContact CD2-CD2 4.31Å; L338-F344 HydrophobicContact CD2-CE2 4.19Å; L338-F344 HydrophobicContact CG-CD2 4.46Å; L338-F344 VanDerWaalsContact O-CB 3.3Å; L338-F344 WeakPolarHBondContact O-CB 3.44Å
339	Y	94.9	Very high	95.6	Very high	78 Å²	78	21.5 Å²	21.5	31%	0.306	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-55.9	-20.6	173.8	75.8	-83.9	0	0	0	114.1	Y329 N333 N337 L341	Y329-Y339 WeakPolarHBondContact OH-CB 3.38Å; N333-Y339 WeakPolarHBondContact OD1-CD1 3.26Å; N333-Y339 PolarHBondContact OD1-N 3.06Å; N337-Y339 HydrophobicContact CB-CD1 4.18Å; N337-Y339 HydrophobicContact CB-CE1 3.7Å; N337-Y339 PolarHBondContact O-N 3.45Å; N337-Y339 VanDerWaalsContact O-N 3.14Å; Y339-L341 VanDerWaalsContact C-N 3.3Å
340	L	95.7	Very high	95.7	Very high	23 Å²	23	19.9 Å²	19.9	12%	0.12	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-81.2	-6.3	174.3	-58.9	173.9	0	0	0	113	N337 L338 M379 L479 Y480	N337-L340 HydrophobicContact CB-CD1 3.64Å; N337-L340 HydrophobicContact CB-CG 4.15Å; N337-L340 WeakPolarHBondContact O-CB 3.45Å; N337-L340 PolarHBondContact O-N 3.36Å; L338-L340 PolarHBondContact O-N 3.37Å; L340-M379 HydrophobicContact CD2-CE 4.11Å; L340-L479 HydrophobicContact CD1-CD1 3.83Å; L340-L479 HydrophobicContact CD2-CD1 3.78Å; L340-L479 HydrophobicContact CG-CD1 4.26Å; L340-Y480 PolarHBondContact O-OH 3.01Å
341	L	96.8	Very high	95.8	Very high	7 Å²	7	16.2 Å²	16.2	4%	0.037	10%	0.102	C	C	.	.	S	Bend	trans	-94.3	127.6	171.3	-60.9	175.9	0	0	0	108.7	L86 L310 L338 Y339 N343 F344 G345	L86-L341 HydrophobicContact CD2-CD2 4.45Å; L310-L341 HydrophobicContact CD2-CD1 4.33Å; L310-L341 HydrophobicContact CD2-CD2 4.36Å; L338-L341 HydrophobicContact CD2-CD1 4.23Å; L338-L341 WeakPolarHBondContact O-CB 3.48Å; L338-L341 PolarHBondContact O-N 3.49Å; Y339-L341 VanDerWaalsContact C-N 3.3Å; L341-N343 VanDerWaalsContact CB-OD1 3.25Å; L341-N343 WeakPolarHBondContact CB-OD1 3.39Å; L341-N343 PolarHBondContact O-N 3.07Å; L341-N343 VanDerWaalsContact O-N 3.1Å; L341-F344 HydrophobicContact CB-CD2 4.32Å; L341-F344 HydrophobicContact CD1-CD2 4.19Å; L341-F344 PolarHBondContact O-N 3.03Å; L341-F344 VanDerWaalsContact O-N 3.12Å; L341-G345 PolarHBondContact O-N 3.21Å
342	P	97.5	Very high	96	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.013	10%	0.104	C	C	.	.	H	α-helix	trans	-53.4	-37.1	-177.3	-28.5	34	0	0	0	113.8	L346 F380 L417 L420 L421	P342-L346 WeakPolarHBondContact O-CB 3.47Å; P342-L346 WeakPolarHBondContact O-CD1 3.48Å; P342-L346 VanDerWaalsContact O-CG 3.31Å; P342-L346 WeakPolarHBondContact O-CG 3.42Å; P342-L346 PolarHBondContact O-N 2.88Å; P342-F380 HydrophobicContact CB-CD1 4.3Å; P342-F380 HydrophobicContact CB-CE1 4.4Å; P342-F380 HydrophobicContact CB-CG 4.37Å; P342-F380 HydrophobicContact CG-CD1 3.91Å; P342-F380 HydrophobicContact CG-CE1 3.78Å; P342-F380 HydrophobicContact CG-CG 4.47Å; P342-F380 HydrophobicContact CG-CZ 4.24Å; P342-L417 HydrophobicContact CG-CD1 3.73Å; P342-L420 HydrophobicContact CG-CB 4.12Å; P342-L421 HydrophobicContact CB-CD2 3.6Å; P342-L421 HydrophobicContact CB-CG 4.29Å; P342-L421 HydrophobicContact CG-CD2 3.96Å; P342-L421 HydrophobicContact CG-CG 4.18Å
343	N	98	Very high	96	Very high	5 Å²	5	18.8 Å²	18.8	3%	0.027	11%	0.11	C	C	.	.	H	α-helix	trans	-63.9	-46	-179.3	71	-56.8	0	0	0	111.8	L309 D313 L341 S347 Y424	L309-N343 PolarHBondContact O-ND2 3.33Å; D313-N343 PolarHBondContact OD1-ND2 2.93Å; L341-N343 VanDerWaalsContact CB-OD1 3.25Å; L341-N343 WeakPolarHBondContact CB-OD1 3.39Å; L341-N343 PolarHBondContact O-N 3.07Å; L341-N343 VanDerWaalsContact O-N 3.1Å; N343-S347 WeakPolarHBondContact O-CA 3.46Å; N343-S347 WeakPolarHBondContact O-CB 3.23Å; N343-S347 PolarHBondContact O-N 3.12Å; N343-S347 PolarHBondContact O-OG 2.87Å; N343-Y424 VanDerWaalsContact CA-CD2 3.44Å; N343-Y424 HydrophobicContact CB-CD2 3.48Å; N343-Y424 VanDerWaalsContact CB-CD2 3.48Å; N343-Y424 HydrophobicContact CB-CE2 3.94Å; N343-Y424 HydrophobicContact CB-CG 4.3Å
344	F	98.4	Very high	96.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-71.4	-43.9	175.3	-79.8	-78	0	0	0	112.7	L309 I312 L325 Y329 L338 L341 L346 S347 I348	L309-F344 HydrophobicContact CB-CE2 4.06Å; L309-F344 HydrophobicContact CB-CZ 4.49Å; L309-F344 HydrophobicContact CD2-CE2 4.45Å; L309-F344 HydrophobicContact CD2-CZ 4.08Å; L309-F344 VanDerWaalsContact O-CE2 3.24Å; L309-F344 WeakPolarHBondContact O-CE2 3.28Å; I312-F344 HydrophobicContact CG2-CZ 4.05Å; L325-F344 HydrophobicContact CD1-CE1 3.91Å; Y329-F344 HydrophobicContact CD2-CB 4.29Å; Y329-F344 AromaticContact CD2-CD1 3.8Å; Y329-F344 HydrophobicContact CD2-CD1 3.8Å; Y329-F344 HydrophobicContact CD2-CG 4.32Å; Y329-F344 HydrophobicContact CE2-CB 4.38Å; L338-F344 HydrophobicContact CB-CB 4.15Å; L338-F344 HydrophobicContact CB-CD1 4.36Å; L338-F344 HydrophobicContact CB-CD2 4.01Å; L338-F344 HydrophobicContact CB-CG 3.91Å; L338-F344 HydrophobicContact CD1-CD1 4.22Å; L338-F344 HydrophobicContact CD1-CD2 4.36Å; L338-F344 HydrophobicContact CD1-CE1 3.98Å; L338-F344 HydrophobicContact CD1-CE2 4.13Å; L338-F344 HydrophobicContact CD1-CG 4.41Å; L338-F344 HydrophobicContact CD1-CZ 3.94Å; L338-F344 HydrophobicContact CD2-CD2 4.31Å; L338-F344 HydrophobicContact CD2-CE2 4.19Å; L338-F344 HydrophobicContact CG-CD2 4.46Å; L338-F344 VanDerWaalsContact O-CB 3.3Å; L338-F344 WeakPolarHBondContact O-CB 3.44Å; L341-F344 HydrophobicContact CB-CD2 4.32Å; L341-F344 HydrophobicContact CD1-CD2 4.19Å; L341-F344 PolarHBondContact O-N 3.03Å; L341-F344 VanDerWaalsContact O-N 3.12Å; F344-L346 PolarHBondContact O-N 3.45Å; F344-L346 VanDerWaalsContact O-N 3.17Å; F344-S347 PolarHBondContact O-N 3.4Å; F344-I348 HydrophobicContact CB-CG1 4.49Å; F344-I348 HydrophobicContact CD1-CD1 4.14Å; F344-I348 HydrophobicContact CD1-CG1 4.14Å; F344-I348 WeakPolarHBondContact O-CB 3.45Å; F344-I348 WeakPolarHBondContact O-CG1 3.28Å; F344-I348 PolarHBondContact O-N 2.9Å
345	G	97.2	Very high	96.4	Very high	10 Å²	10	19.4 Å²	19.4	10%	0.103	10%	0.096	C	C	.	.	H	α-helix	trans	-54	-38	178.7	0	0	0	0	0	112.5	L341 P349 A376	L341-G345 PolarHBondContact O-N 3.21Å; G345-P349 WeakPolarHBondContact O-CD 3.48Å; G345-P349 WeakPolarHBondContact O-CG 3.48Å; G345-A376 WeakPolarHBondContact O-CB 3.24Å
346	L	98.5	Very high	96.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-91.6	-38.7	-179.6	-63.6	165.8	0	0	0	113.2	P342 F344 P349 L350 A376 F383 Y424 W432	P342-L346 WeakPolarHBondContact O-CB 3.47Å; P342-L346 WeakPolarHBondContact O-CD1 3.48Å; P342-L346 VanDerWaalsContact O-CG 3.31Å; P342-L346 WeakPolarHBondContact O-CG 3.42Å; P342-L346 PolarHBondContact O-N 2.88Å; F344-L346 PolarHBondContact O-N 3.45Å; F344-L346 VanDerWaalsContact O-N 3.17Å; L346-P349 WeakPolarHBondContact O-CG 3.28Å; L346-L350 WeakPolarHBondContact O-CB 3.32Å; L346-L350 PolarHBondContact O-N 2.81Å; L346-A376 HydrophobicContact CD2-CB 4.14Å; L346-F383 HydrophobicContact CD1-CB 3.99Å; L346-F383 HydrophobicContact CD1-CD1 4.12Å; L346-F383 HydrophobicContact CD1-CD2 3.48Å; L346-F383 VanDerWaalsContact CD1-CD2 3.48Å; L346-F383 HydrophobicContact CD1-CE2 3.93Å; L346-F383 HydrophobicContact CD1-CG 3.59Å; L346-F383 HydrophobicContact CD1-CZ 4.42Å; L346-F383 HydrophobicContact CD2-CD1 3.88Å; L346-F383 HydrophobicContact CD2-CE1 4.16Å; L346-F383 HydrophobicContact CD2-CG 4.16Å; L346-Y424 HydrophobicContact CB-CD1 4.48Å; L346-Y424 HydrophobicContact CB-CE1 3.6Å; L346-Y424 HydrophobicContact CD1-CD1 3.62Å; L346-Y424 HydrophobicContact CD1-CE1 3.46Å; L346-Y424 VanDerWaalsContact CD1-CE1 3.46Å; L346-Y424 HydrophobicContact CG-CE1 4.18Å; L346-W432 HydrophobicContact CB-CZ2 4.12Å
347	S	98.4	Very high	96.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-75.3	-26.7	-176.1	-72.3	0	0	0	0	114.1	D313 N343 F344 L350 A351 Y424	D313-S347 WeakPolarHBondContact OD2-CB 3.49Å; D313-S347 PolarHBondContact OD2-OG 3.39Å; N343-S347 WeakPolarHBondContact O-CA 3.46Å; N343-S347 WeakPolarHBondContact O-CB 3.23Å; N343-S347 PolarHBondContact O-N 3.12Å; N343-S347 PolarHBondContact O-OG 2.87Å; F344-S347 PolarHBondContact O-N 3.4Å; S347-L350 PolarHBondContact O-N 3.04Å; S347-A351 VanDerWaalsContact O-CB 3.28Å; S347-A351 WeakPolarHBondContact O-CB 3.48Å; S347-A351 PolarHBondContact O-N 3.18Å; S347-Y424 PolarHBondContact N-OH 3.15Å; S347-Y424 WeakPolarHBondContact OG-CE2 3.47Å; S347-Y424 PolarHBondContact OG-OH 3.04Å
348	I	98	Very high	96.5	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-69.1	-52.3	179.5	-64	-60.9	0	0	0	113.2	L325 Y329 F344 L350 A351 R352	L325-I348 HydrophobicContact CD1-CD1 4.39Å; L325-I348 HydrophobicContact CD2-CD1 4.36Å; L325-I348 HydrophobicContact CG-CD1 3.87Å; Y329-I348 HydrophobicContact CD1-CD1 4.14Å; Y329-I348 HydrophobicContact CD1-CG1 4.03Å; Y329-I348 HydrophobicContact CD1-CG2 3.96Å; Y329-I348 HydrophobicContact CD2-CD1 4.02Å; Y329-I348 HydrophobicContact CD2-CG1 3.66Å; Y329-I348 HydrophobicContact CE1-CG1 4.42Å; Y329-I348 HydrophobicContact CE1-CG2 4.06Å; Y329-I348 HydrophobicContact CE2-CG1 4.08Å; Y329-I348 HydrophobicContact CG-CD1 3.58Å; Y329-I348 HydrophobicContact CG-CG1 3.62Å; Y329-I348 HydrophobicContact CG-CG2 4.42Å; F344-I348 HydrophobicContact CB-CG1 4.49Å; F344-I348 HydrophobicContact CD1-CD1 4.14Å; F344-I348 HydrophobicContact CD1-CG1 4.14Å; F344-I348 WeakPolarHBondContact O-CB 3.45Å; F344-I348 WeakPolarHBondContact O-CG1 3.28Å; F344-I348 PolarHBondContact O-N 2.9Å; I348-L350 PolarHBondContact O-N 3.22Å; I348-A351 PolarHBondContact O-N 3.25Å; I348-R352 WeakPolarHBondContact O-CG 3.46Å; I348-R352 PolarHBondContact O-N 2.98Å
349	P	97.6	Very high	96.1	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-59.8	-36.5	172.7	21	-30.8	0	0	0	111.6	G345 L346 A351 R352 K353 V369 L373 W440	G345-P349 WeakPolarHBondContact O-CD 3.48Å; G345-P349 WeakPolarHBondContact O-CG 3.48Å; L346-P349 WeakPolarHBondContact O-CG 3.28Å; P349-A351 PolarHBondContact O-N 3.31Å; P349-R352 PolarHBondContact O-N 3.3Å; P349-K353 PolarHBondContact O-N 3.47Å; P349-V369 HydrophobicContact CB-CG1 4.19Å; P349-V369 WeakPolarHBondContact O-CG1 3.42Å; P349-L373 HydrophobicContact CB-CB 3.93Å; P349-L373 HydrophobicContact CG-CB 4.19Å; P349-L373 HydrophobicContact CG-CD1 4.24Å; P349-W440 HydrophobicContact CB-CH2 4.48Å
350	L	98	Very high	95.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-45.2	174.7	-178.6	59.6	0	0	0	112.4	I317 L346 S347 I348 K353 L354 M428 L431 W432 V437 W440	I317-L350 HydrophobicContact CD1-CD2 4.29Å; L346-L350 WeakPolarHBondContact O-CB 3.32Å; L346-L350 PolarHBondContact O-N 2.81Å; S347-L350 PolarHBondContact O-N 3.04Å; I348-L350 PolarHBondContact O-N 3.22Å; L350-K353 PolarHBondContact O-N 3.25Å; L350-L354 HydrophobicContact CD1-CD1 3.99Å; L350-L354 HydrophobicContact CD1-CG 4.19Å; L350-L354 HydrophobicContact CG-CD1 3.93Å; L350-L354 WeakPolarHBondContact O-CB 3.49Å; L350-L354 VanDerWaalsContact O-CG 3.24Å; L350-L354 WeakPolarHBondContact O-CG 3.47Å; L350-L354 PolarHBondContact O-N 3.49Å; L350-M428 HydrophobicContact CD2-CE 4.27Å; L350-L431 HydrophobicContact CD2-CD2 3.51Å; L350-L431 HydrophobicContact CD2-CG 4.15Å; L350-L431 HydrophobicContact CG-CD2 4.3Å; L350-W432 HydrophobicContact CB-CH2 3.93Å; L350-W432 HydrophobicContact CB-CZ2 4.02Å; L350-W432 HydrophobicContact CD1-CH2 4.27Å; L350-W432 HydrophobicContact CD1-CZ3 4.25Å; L350-W432 HydrophobicContact CD2-CD2 4.31Å; L350-W432 HydrophobicContact CD2-CH2 4.17Å; L350-W432 HydrophobicContact CD2-CZ2 3.7Å; L350-W432 HydrophobicContact CG-CH2 4.36Å; L350-W432 HydrophobicContact CG-CZ2 4.33Å; L350-V437 HydrophobicContact CD1-CG1 3.68Å; L350-V437 HydrophobicContact CD1-CG2 4.13Å; L350-W440 HydrophobicContact CD1-CZ3 3.95Å
351	A	98	Very high	95.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.7	-41.5	177.8	0	0	0	0	0	112.2	I317 Y322 L325 I326 S347 I348 P349 L354 I355	I317-A351 HydrophobicContact CD1-CB 4.5Å; I317-A351 HydrophobicContact CG1-CB 4.42Å; Y322-A351 HydrophobicContact CD1-CB 4.45Å; L325-A351 HydrophobicContact CD2-CB 4.1Å; I326-A351 HydrophobicContact CD1-CB 4.44Å; I326-A351 HydrophobicContact CG1-CB 4.25Å; S347-A351 VanDerWaalsContact O-CB 3.28Å; S347-A351 WeakPolarHBondContact O-CB 3.48Å; S347-A351 PolarHBondContact O-N 3.18Å; I348-A351 PolarHBondContact O-N 3.25Å; P349-A351 PolarHBondContact O-N 3.31Å; A351-L354 PolarHBondContact O-N 3.46Å; A351-I355 WeakPolarHBondContact O-CG2 3.42Å; A351-I355 PolarHBondContact O-N 2.75Å
352	R	97.1	Very high	94.4	Very high	30 Å²	30	38 Å²	38	11%	0.113	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-40.6	175.3	-74.4	-175.4	178	180	3.3	112.4	I326 D330 I348 P349 I355 G356 E357 V369	I326-R352 HydrophobicContact CD1-CG 3.74Å; I326-R352 HydrophobicContact CG1-CG 4.08Å; D330-R352 IonicContact OD1-NH2 3.16Å; I348-R352 WeakPolarHBondContact O-CG 3.46Å; I348-R352 PolarHBondContact O-N 2.98Å; P349-R352 PolarHBondContact O-N 3.3Å; R352-I355 WeakPolarHBondContact O-CG2 3.48Å; R352-G356 PolarHBondContact O-N 2.76Å; R352-E357 WeakPolarHBondContact CB-OE2 3.14Å; R352-E357 VanDerWaalsContact CD-OE2 3.29Å; R352-E357 WeakPolarHBondContact CD-OE2 3.44Å; R352-E357 WeakPolarHBondContact CG-OE2 3.38Å; R352-E357 WeakPolarHBondContact O-CB 3.38Å; R352-E357 PolarHBondContact O-N 3.07Å; R352-V369 HydrophobicContact CB-CG1 3.9Å; R352-V369 HydrophobicContact CB-CG2 3.98Å
353	K	96.5	Very high	93.3	Very high	39 Å²	39	42.5 Å²	42.5	17%	0.17	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-46.9	170.9	172.2	164	174.8	-97.5	0	112.3	P349 L350 I355 G356 V369 N436 W440	P349-K353 PolarHBondContact O-N 3.47Å; L350-K353 PolarHBondContact O-N 3.25Å; K353-I355 VanDerWaalsContact C-N 3.32Å; K353-I355 PolarHBondContact O-N 3.02Å; K353-G356 PolarHBondContact O-N 2.91Å; K353-G356 VanDerWaalsContact O-N 3.07Å; K353-V369 HydrophobicContact CB-CG1 4.17Å; K353-N436 PolarHBondContact NZ-O 3.29Å; K353-W440 HydrophobicContact CB-CH2 4.06Å; K353-W440 HydrophobicContact CB-CZ2 4.1Å; K353-W440 HydrophobicContact CB-CZ3 4.5Å; K353-W440 HydrophobicContact CD-CB 4.21Å; K353-W440 HydrophobicContact CD-CD2 3.09Å; K353-W440 HydrophobicContact CD-CE3 3.4Å; K353-W440 HydrophobicContact CD-CG 3.48Å; K353-W440 VanDerWaalsContact CD-CG 3.48Å; K353-W440 HydrophobicContact CD-CH2 3.87Å; K353-W440 HydrophobicContact CD-CZ2 3.69Å; K353-W440 HydrophobicContact CD-CZ3 3.74Å; K353-W440 VanDerWaalsContact CE-CB 3.49Å; K353-W440 VanDerWaalsContact CE-CD2 3.47Å
354	L	96.8	Very high	92.3	Very high	47 Å²	47	45.8 Å²	45.8	25%	0.246	27%	0.269	C	S	.	.	H	α-helix	trans	-70.9	-24.9	-174.6	-70.6	172.9	0	0	0	113.6	I317 Y322 L350 A351 G356 L431 V437	I317-L354 HydrophobicContact CG2-CD1 3.89Å; Y322-L354 HydrophobicContact CD1-CB 4.08Å; Y322-L354 HydrophobicContact CD1-CD1 4.44Å; Y322-L354 HydrophobicContact CD2-CB 4.14Å; Y322-L354 HydrophobicContact CE1-CB 3.74Å; Y322-L354 HydrophobicContact CE1-CD1 3.72Å; Y322-L354 HydrophobicContact CE1-CG 4.38Å; Y322-L354 HydrophobicContact CE2-CB 3.78Å; Y322-L354 WeakPolarHBondContact CE2-O 3.48Å; Y322-L354 HydrophobicContact CG-CB 4.27Å; L350-L354 HydrophobicContact CD1-CD1 3.99Å; L350-L354 HydrophobicContact CD1-CG 4.19Å; L350-L354 HydrophobicContact CG-CD1 3.93Å; L350-L354 WeakPolarHBondContact O-CB 3.49Å; L350-L354 VanDerWaalsContact O-CG 3.24Å; L350-L354 WeakPolarHBondContact O-CG 3.47Å; L350-L354 PolarHBondContact O-N 3.49Å; A351-L354 PolarHBondContact O-N 3.46Å; L354-G356 VanDerWaalsContact C-N 3.27Å; L354-L431 HydrophobicContact CD1-CD1 4.46Å; L354-L431 HydrophobicContact CD1-CD2 4.19Å; L354-V437 HydrophobicContact CD2-CG2 4.27Å
355	I	96	Very high	91.3	Very high	70 Å²	70	54.3 Å²	54.3	36%	0.359	31%	0.314	S	S	.	.	H	α-helix	trans	-75.5	-18	171.1	-161.4	169.9	0	0	0	112.3	Y322 R323 I326 A351 R352 K353 E357	Y322-I355 HydrophobicContact CD2-CB 4.12Å; Y322-I355 HydrophobicContact CG-CB 4.42Å; R323-I355 HydrophobicContact CB-CD1 3.83Å; I326-I355 HydrophobicContact CD1-CG2 4.13Å; A351-I355 WeakPolarHBondContact O-CG2 3.42Å; A351-I355 PolarHBondContact O-N 2.75Å; R352-I355 WeakPolarHBondContact O-CG2 3.48Å; K353-I355 VanDerWaalsContact C-N 3.32Å; K353-I355 PolarHBondContact O-N 3.02Å; I355-E357 HydrophobicContact CG2-CG 3.98Å
356	G	94	Very high	90.4	Very high	64 Å²	64	59.8 Å²	59.8	66%	0.66	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.3	23.2	177.2	0	0	0	0	0	114.8	R352 K353 L354	R352-G356 PolarHBondContact O-N 2.76Å; K353-G356 PolarHBondContact O-N 2.91Å; K353-G356 VanDerWaalsContact O-N 3.07Å; L354-G356 VanDerWaalsContact C-N 3.27Å
357	E	93.2	Very high	89.9	Confident	79 Å²	79	64.8 Å²	64.8	37%	0.369	36%	0.36	S	S	.	.			trans	-65.2	142.6	166.8	-67.9	174.8	-155.6	0	0	110	R352 I355 P359 V369	R352-E357 WeakPolarHBondContact CB-OE2 3.14Å; R352-E357 VanDerWaalsContact CD-OE2 3.29Å; R352-E357 WeakPolarHBondContact CD-OE2 3.44Å; R352-E357 WeakPolarHBondContact CG-OE2 3.38Å; R352-E357 WeakPolarHBondContact O-CB 3.38Å; R352-E357 PolarHBondContact O-N 3.07Å; I355-E357 HydrophobicContact CG2-CG 3.98Å; E357-P359 WeakPolarHBondContact O-CD 3.24Å; E357-V369 HydrophobicContact CB-CG2 3.95Å
358	D	89.7	Confident	89.7	Confident	93 Å²	93	65.1 Å²	65.1	50%	0.497	36%	0.362	S	S	.	.			trans	-65.3	120.4	177	-176.5	-9.1	0	0	0	109.6	E360 K361	D358-E360 PolarHBondContact O-N 3.43Å; D358-E360 PolarHBondContact OD1-N 2.96Å; D358-K361 HydrophobicContact CB-CB 3.73Å; D358-K361 PolarHBondContact O-N 3Å
359	P	88.4	Confident	89.6	Confident	35 Å²	35	65.1 Å²	65.1	23%	0.227	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.6	-174.9	-23.6	33.9	0	0	0	115.2	E357 S368 V369 D370	E357-P359 WeakPolarHBondContact O-CD 3.24Å; P359-S368 WeakPolarHBondContact O-CB 3.1Å; P359-V369 PolarHBondContact O-N 2.99Å; P359-D370 WeakPolarHBondContact CB-OD1 3.26Å; P359-D370 WeakPolarHBondContact O-CB 3.04Å; P359-D370 PolarHBondContact O-N 3.41Å
360	E	86.7	Confident	89.6	Confident	129 Å²	129	65.5 Å²	65.5	60%	0.603	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-12.9	-173	-62.1	-176.5	171.6	0	0	113.1	D358 C362 K443	D358-E360 PolarHBondContact O-N 3.43Å; D358-E360 PolarHBondContact OD1-N 2.96Å; E360-C362 PolarHBondContact O-N 3.38Å; E360-K443 IonicContact OE1-NZ 2.78Å; E360-K443 PolarHBondContact OE1-NZ 3.18Å
361	K	85.9	Confident	89.5	Confident	123 Å²	123	69.2 Å²	69.2	54%	0.535	38%	0.382	S	S	.	.			trans	-75.8	117.3	-176.3	-170.7	-174.7	176.8	-146.8	0	110.9	D358 D363	D358-K361 HydrophobicContact CB-CB 3.73Å; D358-K361 PolarHBondContact O-N 3Å; K361-D363 WeakPolarHBondContact CE-OD1 3.5Å; K361-D363 IonicContact NZ-OD1 3.04Å; K361-D363 PolarHBondContact NZ-OD1 3.25Å
362	C	78.1	Confident	89.4	Confident	68 Å²	68	70.4 Å²	70.4	46%	0.459	39%	0.39	S	S	.	.			trans	-90.1	115.9	169.9	-55.2	0	0	0	0	110	E360 G364 E371	E360-C362 PolarHBondContact O-N 3.38Å; C362-G364 PolarHBondContact O-N 2.97Å; C362-E371 PolarHBondContact SG-OE2 3.28Å; C362-E371 VanDerWaalsContact SG-OE2 3.33Å
363	D	75.6	Confident	89.4	Confident	96 Å²	96	69 Å²	69	51%	0.513	39%	0.385	S	S	.	.			trans	-87.3	84.1	173.1	-78.3	-21.1	0	0	0	109.6	K361 N365 K366	K361-D363 WeakPolarHBondContact CE-OD1 3.5Å; K361-D363 IonicContact NZ-OD1 3.04Å; K361-D363 PolarHBondContact NZ-OD1 3.25Å; D363-N365 PolarHBondContact O-N 3.29Å; D363-K366 PolarHBondContact O-N 2.97Å
364	G	75.7	Confident	89.4	Confident	74 Å²	74	68.2 Å²	68.2	76%	0.763	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	-103	174.2	0	0	0	0	0	113.4	C362	C362-G364 PolarHBondContact O-N 2.97Å
365	N	77.4	Confident	89.3	Confident	179 Å²	179	67.2 Å²	67.2	96%	0.957	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-4	-178.4	-73.6	-0.2	0	0	0	114.4	D363	D363-N365 PolarHBondContact O-N 3.29Å
366	K	80	Confident	89.4	Confident	125 Å²	125	64.1 Å²	64.1	54%	0.543	36%	0.362	S	S	.	.	S	Bend	trans	-96.8	134.2	-179.9	-66.3	-174.9	-179.6	-175.3	0	110.5	D363	D363-K366 PolarHBondContact O-N 2.97Å
367	M	87.7	Confident	89.4	Confident	105 Å²	105	61.1 Å²	61.1	52%	0.517	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-55.7	139.3	167.8	-66.7	174.6	178.3	0	0	109.8	E371 D375	M367-E371 HydrophobicContact CB-CB 4.03Å; M367-E371 HydrophobicContact CG-CB 4.5Å; M367-D375 HydrophobicContact SD-CB 4.48Å
368	S	94.1	Very high	89.5	Confident	7 Å²	7	57.4 Å²	57.4	5%	0.049	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-60.4	166.9	168	62.2	0	0	0	0	111.1	P359 D370 E371 S372	P359-S368 WeakPolarHBondContact O-CB 3.1Å; S368-D370 VanDerWaalsContact C-N 3.3Å; S368-D370 PolarHBondContact O-N 3.44Å; S368-E371 PolarHBondContact N-OE2 3.38Å; S368-E371 PolarHBondContact O-N 3.01Å; S368-E371 VanDerWaalsContact OG-CB 3.32Å; S368-E371 WeakPolarHBondContact OG-CB 3.26Å; S368-E371 VanDerWaalsContact OG-CD 3.3Å; S368-E371 WeakPolarHBondContact OG-CG 3.25Å; S368-E371 PolarHBondContact OG-N 2.66Å; S368-E371 PolarHBondContact OG-OE2 3.47Å; S368-S372 VanDerWaalsContact O-CB 3.29Å; S368-S372 WeakPolarHBondContact O-CB 3.35Å; S368-S372 PolarHBondContact O-N 3.06Å
369	V	96	Very high	89.7	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.024	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-39.2	179.7	-168	0	0	0	0	110.8	P349 R352 K353 E357 P359 S372 L373 W440	P349-V369 HydrophobicContact CB-CG1 4.19Å; P349-V369 WeakPolarHBondContact O-CG1 3.42Å; R352-V369 HydrophobicContact CB-CG1 3.9Å; R352-V369 HydrophobicContact CB-CG2 3.98Å; K353-V369 HydrophobicContact CB-CG1 4.17Å; E357-V369 HydrophobicContact CB-CG2 3.95Å; P359-V369 PolarHBondContact O-N 2.99Å; V369-S372 PolarHBondContact O-N 3.48Å; V369-L373 PolarHBondContact O-N 3.07Å; V369-W440 HydrophobicContact CG1-CZ2 4.08Å
370	D	96.7	Very high	90.1	Very high	8 Å²	8	51.6 Å²	51.6	4%	0.043	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-49.8	175.1	-84.9	-3.8	0	0	0	110.7	P359 S368 S372 L373 Q374 W440 K443 N444	P359-D370 WeakPolarHBondContact CB-OD1 3.26Å; P359-D370 WeakPolarHBondContact O-CB 3.04Å; P359-D370 PolarHBondContact O-N 3.41Å; S368-D370 VanDerWaalsContact C-N 3.3Å; S368-D370 PolarHBondContact O-N 3.44Å; D370-S372 VanDerWaalsContact C-N 3.3Å; D370-S372 PolarHBondContact O-N 2.96Å; D370-L373 PolarHBondContact O-N 2.87Å; D370-Q374 WeakPolarHBondContact O-CB 3.41Å; D370-Q374 WeakPolarHBondContact O-CG 3.42Å; D370-Q374 PolarHBondContact O-N 3.42Å; D370-Q374 PolarHBondContact O-NE2 3.29Å; D370-W440 PolarHBondContact OD1-NE1 3.18Å; D370-K443 IonicContact OD2-NZ 2.74Å; D370-K443 PolarHBondContact OD2-NZ 3.04Å; D370-N444 WeakPolarHBondContact CA-OD1 3.26Å; D370-N444 WeakPolarHBondContact CB-OD1 3.49Å; D370-N444 PolarHBondContact O-OD1 2.96Å; D370-N444 PolarHBondContact OD1-ND2 3.26Å
371	E	95.4	Very high	90.4	Very high	79 Å²	79	45.5 Å²	45.5	37%	0.369	25%	0.251	S	S	.	.	H	α-helix	trans	-60.2	-38.7	177.5	-74.2	169.8	143.6	0	0	112.6	C362 M367 S368 Q374 D375	C362-E371 PolarHBondContact SG-OE2 3.28Å; C362-E371 VanDerWaalsContact SG-OE2 3.33Å; M367-E371 HydrophobicContact CB-CB 4.03Å; M367-E371 HydrophobicContact CG-CB 4.5Å; S368-E371 PolarHBondContact N-OE2 3.38Å; S368-E371 PolarHBondContact O-N 3.01Å; S368-E371 VanDerWaalsContact OG-CB 3.32Å; S368-E371 WeakPolarHBondContact OG-CB 3.26Å; S368-E371 VanDerWaalsContact OG-CD 3.3Å; S368-E371 WeakPolarHBondContact OG-CG 3.25Å; S368-E371 PolarHBondContact OG-N 2.66Å; S368-E371 PolarHBondContact OG-OE2 3.47Å; E371-Q374 PolarHBondContact O-N 3.17Å; E371-D375 WeakPolarHBondContact O-CB 3.48Å; E371-D375 PolarHBondContact O-N 3.49Å
372	S	95.7	Very high	90.8	Very high	25 Å²	25	39.6 Å²	39.6	18%	0.175	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-43.2	176.9	-179.2	0	0	0	0	111.9	S368 V369 D370 A376	S368-S372 VanDerWaalsContact O-CB 3.29Å; S368-S372 WeakPolarHBondContact O-CB 3.35Å; S368-S372 PolarHBondContact O-N 3.06Å; V369-S372 PolarHBondContact O-N 3.48Å; D370-S372 VanDerWaalsContact C-N 3.3Å; D370-S372 PolarHBondContact O-N 2.96Å; S372-A376 WeakPolarHBondContact O-CB 3.49Å; S372-A376 PolarHBondContact O-N 3.4Å; S372-A376 VanDerWaalsContact O-N 3.07Å
373	L	97.7	Very high	91.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.8	-43.7	173.5	179.5	60.1	0	0	0	111.4	P349 V369 D370 D375 A376 L377 W432 W440 L441 N444	P349-L373 HydrophobicContact CB-CB 3.93Å; P349-L373 HydrophobicContact CG-CB 4.19Å; P349-L373 HydrophobicContact CG-CD1 4.24Å; V369-L373 PolarHBondContact O-N 3.07Å; D370-L373 PolarHBondContact O-N 2.87Å; L373-D375 VanDerWaalsContact C-N 3.34Å; L373-D375 PolarHBondContact O-N 2.93Å; L373-A376 PolarHBondContact O-N 3.25Å; L373-L377 HydrophobicContact CD1-CD1 4.45Å; L373-L377 HydrophobicContact CD1-CG 4.25Å; L373-L377 HydrophobicContact CG-CD1 4.06Å; L373-L377 HydrophobicContact CG-CG 4.33Å; L373-L377 VanDerWaalsContact O-CG 3.28Å; L373-L377 WeakPolarHBondContact O-CG 3.44Å; L373-L377 PolarHBondContact O-N 3.39Å; L373-W432 HydrophobicContact CD1-CH2 3.9Å; L373-W432 HydrophobicContact CD1-CZ3 4.38Å; L373-W440 HydrophobicContact CB-CH2 4.34Å; L373-W440 HydrophobicContact CB-CZ2 4.18Å; L373-W440 HydrophobicContact CD2-CD2 4.17Å; L373-W440 HydrophobicContact CD2-CE3 4.03Å; L373-W440 HydrophobicContact CD2-CH2 3.51Å; L373-W440 HydrophobicContact CD2-CZ2 3.56Å; L373-W440 HydrophobicContact CD2-CZ3 3.73Å; L373-W440 HydrophobicContact CG-CH2 4.35Å; L373-W440 HydrophobicContact CG-CZ2 4.45Å; L373-L441 HydrophobicContact CD2-CD1 4.2Å; L373-N444 HydrophobicContact CD2-CB 3.75Å; L373-N444 HydrophobicContact CG-CB 4.27Å
374	Q	96.2	Very high	92.5	Very high	22 Å²	22	31.9 Å²	31.9	10%	0.103	18%	0.18	C	C	.	.	H	α-helix	trans	-61.1	-43.8	179	-68	161.6	27.1	0	0	111.3	D370 E371 A376 L377 I378 N444 V448	D370-Q374 WeakPolarHBondContact O-CB 3.41Å; D370-Q374 WeakPolarHBondContact O-CG 3.42Å; D370-Q374 PolarHBondContact O-N 3.42Å; D370-Q374 PolarHBondContact O-NE2 3.29Å; E371-Q374 PolarHBondContact O-N 3.17Å; Q374-A376 PolarHBondContact O-N 2.93Å; Q374-L377 PolarHBondContact O-N 2.94Å; Q374-I378 VanDerWaalsContact O-CG1 3.27Å; Q374-I378 WeakPolarHBondContact O-CG1 3.19Å; Q374-I378 PolarHBondContact O-N 2.92Å; Q374-N444 HydrophobicContact CG-CB 4.22Å; Q374-N444 WeakPolarHBondContact CG-OD1 3.27Å; Q374-N444 PolarHBondContact NE2-OD1 3.32Å; Q374-V448 HydrophobicContact CB-CG2 3.71Å; Q374-V448 HydrophobicContact CG-CG2 3.86Å
375	D	95.4	Very high	93.2	Very high	26 Å²	26	29 Å²	29	14%	0.139	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-44.1	175.5	-166.9	69.9	0	0	0	111.7	M367 E371 L373 L377 I378 M379 R468 Y472	M367-D375 HydrophobicContact SD-CB 4.48Å; E371-D375 WeakPolarHBondContact O-CB 3.48Å; E371-D375 PolarHBondContact O-N 3.49Å; L373-D375 VanDerWaalsContact C-N 3.34Å; L373-D375 PolarHBondContact O-N 2.93Å; D375-L377 VanDerWaalsContact C-N 3.35Å; D375-L377 PolarHBondContact O-N 2.94Å; D375-I378 PolarHBondContact O-N 3.03Å; D375-M379 WeakPolarHBondContact O-CB 3.43Å; D375-M379 PolarHBondContact O-N 3.23Å; D375-R468 WeakPolarHBondContact OD1-CD 3.46Å; D375-R468 IonicContact OD1-NH1 3.16Å; D375-R468 PolarHBondContact OD1-NH1 2.81Å; D375-R468 VanDerWaalsContact OD1-NH1 3.16Å; D375-Y472 VanDerWaalsContact CG-OH 3.26Å; D375-Y472 PolarHBondContact OD1-OH 2.98Å; D375-Y472 PolarHBondContact OD2-OH 3.46Å
376	A	97	Very high	93.9	Very high	6 Å²	6	21.8 Å²	21.8	5%	0.05	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-39.2	175	0	0	0	0	0	112.8	G345 L346 S372 L373 Q374 I378 M379 F380	G345-A376 WeakPolarHBondContact O-CB 3.24Å; L346-A376 HydrophobicContact CD2-CB 4.14Å; S372-A376 WeakPolarHBondContact O-CB 3.49Å; S372-A376 PolarHBondContact O-N 3.4Å; S372-A376 VanDerWaalsContact O-N 3.07Å; L373-A376 PolarHBondContact O-N 3.25Å; Q374-A376 PolarHBondContact O-N 2.93Å; A376-I378 VanDerWaalsContact C-N 3.34Å; A376-M379 PolarHBondContact O-N 3.35Å; A376-F380 WeakPolarHBondContact O-CB 3.35Å; A376-F380 PolarHBondContact O-N 3.27Å
377	L	95.9	Very high	94.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.7	-35	175.9	-72	171.2	0	0	0	112.3	L373 Q374 D375 F380 P381 F383 V384 F405 L441 N444 I445 V448	L373-L377 HydrophobicContact CD1-CD1 4.45Å; L373-L377 HydrophobicContact CD1-CG 4.25Å; L373-L377 HydrophobicContact CG-CD1 4.06Å; L373-L377 HydrophobicContact CG-CG 4.33Å; L373-L377 VanDerWaalsContact O-CG 3.28Å; L373-L377 WeakPolarHBondContact O-CG 3.44Å; L373-L377 PolarHBondContact O-N 3.39Å; Q374-L377 PolarHBondContact O-N 2.94Å; D375-L377 VanDerWaalsContact C-N 3.35Å; D375-L377 PolarHBondContact O-N 2.94Å; L377-F380 CarbonylContact O-C 3.53Å; L377-P381 WeakPolarHBondContact O-CA 3.33Å; L377-F383 HydrophobicContact CD2-CD1 3.91Å; L377-F383 HydrophobicContact CD2-CE1 4.39Å; L377-V384 HydrophobicContact CD2-CG2 3.75Å; L377-F405 HydrophobicContact CB-CZ 4.34Å; L377-L441 HydrophobicContact CD1-CD1 4.38Å; L377-L441 HydrophobicContact CD2-CD1 4.3Å; L377-N444 HydrophobicContact CD1-CB 4.31Å; L377-I445 HydrophobicContact CD1-CG1 3.95Å; L377-V448 HydrophobicContact CB-CG2 4.15Å; L377-V448 HydrophobicContact CD1-CG2 4.19Å
378	I	94.3	Very high	94.8	Very high	1 Å²	1	14 Å²	14	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-73	-37.1	174.8	-60.3	163.9	0	0	0	110.7	Q374 D375 A376 P381 L404 V448 V452 R468 L469 Y472 R476	Q374-I378 VanDerWaalsContact O-CG1 3.27Å; Q374-I378 WeakPolarHBondContact O-CG1 3.19Å; Q374-I378 PolarHBondContact O-N 2.92Å; D375-I378 PolarHBondContact O-N 3.03Å; A376-I378 VanDerWaalsContact C-N 3.34Å; I378-P381 WeakPolarHBondContact O-CD 3.47Å; I378-L404 HydrophobicContact CG1-CD2 4.38Å; I378-V448 HydrophobicContact CD1-CG1 4.38Å; I378-V448 HydrophobicContact CG1-CG1 3.7Å; I378-V448 HydrophobicContact CG1-CG2 4.31Å; I378-V452 HydrophobicContact CD1-CG1 4.31Å; I378-V452 HydrophobicContact CG1-CG1 4.25Å; I378-R468 HydrophobicContact CG2-CB 4.09Å; I378-L469 HydrophobicContact CG2-CD2 4.05Å; I378-Y472 HydrophobicContact CB-CD2 4.24Å; I378-Y472 HydrophobicContact CB-CE2 4.39Å; I378-Y472 HydrophobicContact CG2-CD2 3.79Å; I378-Y472 HydrophobicContact CG2-CE2 4.24Å; I378-R476 PolarHBondContact O-NH1 3.39Å
379	M	94.9	Very high	94.6	Very high	6 Å²	6	21.1 Å²	21.1	3%	0.03	10%	0.104	C	C	.	.	H	α-helix	trans	-69.9	-40.7	177.3	-176.4	59.1	-170.6	0	0	111.9	L340 D375 A376 P381 Y472 R475 R476 Y480	L340-M379 HydrophobicContact CD2-CE 4.11Å; D375-M379 WeakPolarHBondContact O-CB 3.43Å; D375-M379 PolarHBondContact O-N 3.23Å; A376-M379 PolarHBondContact O-N 3.35Å; M379-P381 VanDerWaalsContact O-CD 3.26Å; M379-P381 WeakPolarHBondContact O-CD 3.21Å; M379-Y472 VanDerWaalsContact CA-CD2 3.47Å; M379-Y472 HydrophobicContact CB-CD2 3.74Å; M379-Y472 HydrophobicContact CB-CE2 3.93Å; M379-Y472 HydrophobicContact CB-CG 4.4Å; M379-Y472 HydrophobicContact CG-CD2 4.42Å; M379-Y472 HydrophobicContact SD-CD1 3.9Å; M379-Y472 HydrophobicContact SD-CD2 3.95Å; M379-Y472 HydrophobicContact SD-CE1 4.48Å; M379-Y472 HydrophobicContact SD-CG 3.59Å; M379-Y472 VanDerWaalsContact SD-CG 3.59Å; M379-R475 HydrophobicContact CE-CB 4.43Å; M379-R475 HydrophobicContact CE-CG 3.94Å; M379-R476 HydrophobicContact CE-CG 4.38Å; M379-R476 WeakPolarHBondContact O-CD 3.37Å; M379-R476 PolarHBondContact O-NH1 2.85Å; M379-Y480 HydrophobicContact CE-CE2 4.29Å
380	F	95.9	Very high	94.3	Very high	1 Å²	1	24 Å²	24	0%	0.004	12%	0.117	C	C	.	.			trans	-122	60.3	-174.7	-57.2	-60.9	0	0	0	113.3	P342 A376 L377 G382 F383 L417 L421	P342-F380 HydrophobicContact CB-CD1 4.3Å; P342-F380 HydrophobicContact CB-CE1 4.4Å; P342-F380 HydrophobicContact CB-CG 4.37Å; P342-F380 HydrophobicContact CG-CD1 3.91Å; P342-F380 HydrophobicContact CG-CE1 3.78Å; P342-F380 HydrophobicContact CG-CG 4.47Å; P342-F380 HydrophobicContact CG-CZ 4.24Å; A376-F380 WeakPolarHBondContact O-CB 3.35Å; A376-F380 PolarHBondContact O-N 3.27Å; L377-F380 CarbonylContact O-C 3.53Å; F380-G382 PolarHBondContact O-N 3.01Å; F380-F383 WeakPolarHBondContact O-CB 3.32Å; F380-F383 PolarHBondContact O-N 3.42Å; F380-L417 HydrophobicContact CD1-CD1 4.05Å; F380-L417 HydrophobicContact CE1-CD1 4.08Å; F380-L421 HydrophobicContact CB-CD2 3.95Å; F380-L421 HydrophobicContact CG-CD2 4.43Å
381	P	93.6	Very high	94	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-29.6	-173.9	24.7	-34.7	0	0	0	113.9	L377 I378 M379 F383 V384 L404 F405 V409	L377-P381 WeakPolarHBondContact O-CA 3.33Å; I378-P381 WeakPolarHBondContact O-CD 3.47Å; M379-P381 VanDerWaalsContact O-CD 3.26Å; M379-P381 WeakPolarHBondContact O-CD 3.21Å; P381-F383 PolarHBondContact O-N 3.3Å; P381-F383 VanDerWaalsContact O-N 3.07Å; P381-V384 PolarHBondContact O-N 3.05Å; P381-L404 HydrophobicContact CB-CD1 3.58Å; P381-L404 HydrophobicContact CB-CG 3.72Å; P381-L404 WeakPolarHBondContact CB-O 3.36Å; P381-L404 HydrophobicContact CG-CD1 3.85Å; P381-F405 HydrophobicContact CB-CD1 4.27Å; P381-F405 HydrophobicContact CB-CE1 4.28Å; P381-V409 HydrophobicContact CB-CG1 4Å; P381-V409 HydrophobicContact CG-CG1 3.7Å
382	G	93.7	Very high	93.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64	-8.8	175.2	0	0	0	0	0	114.7	F380 R386	F380-G382 PolarHBondContact O-N 3.01Å; G382-R386 WeakPolarHBondContact O-CD 3.12Å; G382-R386 WeakPolarHBondContact O-CG 3.36Å; G382-R386 PolarHBondContact O-N 2.94Å; G382-R386 PolarHBondContact O-NH1 3.18Å
383	F	95.4	Very high	92.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62	-50.2	170.7	169.8	-115.2	0	0	0	111.3	L346 L377 F380 P381 S385 R386 L387 L421 Y424 V425 W432 L441	L346-F383 HydrophobicContact CD1-CB 3.99Å; L346-F383 HydrophobicContact CD1-CD1 4.12Å; L346-F383 HydrophobicContact CD1-CD2 3.48Å; L346-F383 VanDerWaalsContact CD1-CD2 3.48Å; L346-F383 HydrophobicContact CD1-CE2 3.93Å; L346-F383 HydrophobicContact CD1-CG 3.59Å; L346-F383 HydrophobicContact CD1-CZ 4.42Å; L346-F383 HydrophobicContact CD2-CD1 3.88Å; L346-F383 HydrophobicContact CD2-CE1 4.16Å; L346-F383 HydrophobicContact CD2-CG 4.16Å; L377-F383 HydrophobicContact CD2-CD1 3.91Å; L377-F383 HydrophobicContact CD2-CE1 4.39Å; F380-F383 WeakPolarHBondContact O-CB 3.32Å; F380-F383 PolarHBondContact O-N 3.42Å; P381-F383 PolarHBondContact O-N 3.3Å; P381-F383 VanDerWaalsContact O-N 3.07Å; F383-S385 PolarHBondContact O-N 3.02Å; F383-R386 PolarHBondContact O-N 3.09Å; F383-R386 VanDerWaalsContact O-N 3.15Å; F383-L387 HydrophobicContact CE1-CD2 4.17Å; F383-L387 HydrophobicContact CZ-CD2 3.94Å; F383-L387 PolarHBondContact O-N 3.37Å; F383-L421 HydrophobicContact CB-CD2 4.07Å; F383-Y424 HydrophobicContact CD2-CD1 4.1Å; F383-Y424 HydrophobicContact CD2-CE1 4.25Å; F383-Y424 AromaticContact CE2-CD1 3.92Å; F383-Y424 HydrophobicContact CE2-CD1 3.92Å; F383-Y424 AromaticContact CE2-CE1 3.73Å; F383-Y424 HydrophobicContact CE2-CE1 3.73Å; F383-Y424 HydrophobicContact CZ-CE1 4.41Å; F383-V425 HydrophobicContact CD2-CG2 3.55Å; F383-V425 HydrophobicContact CE2-CG2 3.74Å; F383-W432 AromaticContact CZ-CD1 3.82Å; F383-W432 AromaticContact CZ-CD2 3.87Å; F383-W432 HydrophobicContact CZ-CD2 3.87Å; F383-W432 AromaticContact CZ-CE2 3.71Å; F383-W432 AromaticContact CZ-CG 3.94Å; F383-W432 HydrophobicContact CZ-CG 3.94Å; F383-W432 HydrophobicContact CZ-CZ2 4.27Å; F383-W432 AromaticContact CZ-NE1 3.69Å; F383-L441 HydrophobicContact CE1-CD1 4.42Å; F383-L441 HydrophobicContact CE1-CD2 4.49Å
384	V	93.6	Very high	91.7	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-46.6	-174.3	-179.7	0	0	0	0	110.5	L377 P381 R386 L387 L388 I393 L399 F405 I445	L377-V384 HydrophobicContact CD2-CG2 3.75Å; P381-V384 PolarHBondContact O-N 3.05Å; V384-R386 PolarHBondContact O-N 3.43Å; V384-L387 PolarHBondContact O-N 3.31Å; V384-L388 HydrophobicContact CG1-CD1 4.49Å; V384-L388 WeakPolarHBondContact O-CG 3.27Å; V384-L388 PolarHBondContact O-N 3.26Å; V384-I393 HydrophobicContact CG1-CD1 4Å; V384-L399 HydrophobicContact CG1-CD2 3.77Å; V384-F405 HydrophobicContact CB-CD1 3.75Å; V384-F405 HydrophobicContact CB-CE1 4.23Å; V384-F405 HydrophobicContact CB-CG 4.32Å; V384-F405 HydrophobicContact CG1-CB 4.49Å; V384-F405 HydrophobicContact CG1-CD1 4.32Å; V384-F405 HydrophobicContact CG1-CG 4.42Å; V384-F405 HydrophobicContact CG2-CD1 3.65Å; V384-F405 HydrophobicContact CG2-CE1 3.59Å; V384-F405 HydrophobicContact CG2-CG 4.43Å; V384-F405 HydrophobicContact CG2-CZ 4.32Å; V384-I445 HydrophobicContact CG1-CD1 4.08Å; V384-I445 HydrophobicContact CG2-CD1 4.09Å; V384-I445 HydrophobicContact CG2-CG1 4.35Å
385	S	90.8	Very high	90.5	Very high	14 Å²	14	30.5 Å²	30.5	10%	0.098	19%	0.192	C	C	.	.	H	α-helix	trans	-62	-28.9	178.8	-40.7	0	0	0	0	112.9	F383 F405	F383-S385 PolarHBondContact O-N 3.02Å; S385-F405 PolarHBondContact OG-O 2.68Å; S385-F405 VanDerWaalsContact OG-O 3.07Å
386	R	92.9	Very high	89.6	Confident	27 Å²	27	30.5 Å²	30.5	10%	0.102	19%	0.192	C	C	.	.	H	α-helix	trans	-78.6	-43.3	174.2	-75.1	172.4	176.6	77.8	4.9	111.8	G382 F383 V384 L388 K389 E413 G418 S422 V425	G382-R386 WeakPolarHBondContact O-CD 3.12Å; G382-R386 WeakPolarHBondContact O-CG 3.36Å; G382-R386 PolarHBondContact O-N 2.94Å; G382-R386 PolarHBondContact O-NH1 3.18Å; F383-R386 PolarHBondContact O-N 3.09Å; F383-R386 VanDerWaalsContact O-N 3.15Å; V384-R386 PolarHBondContact O-N 3.43Å; R386-L388 VanDerWaalsContact C-N 3.26Å; R386-L388 PolarHBondContact O-N 2.85Å; R386-K389 VanDerWaalsContact O-CB 3.32Å; R386-K389 WeakPolarHBondContact O-CB 3.49Å; R386-K389 PolarHBondContact O-N 3.22Å; R386-K389 VanDerWaalsContact O-N 3.08Å; R386-E413 IonicContact CZ-OE1 3.32Å; R386-E413 IonicContact NH1-OE1 2.68Å; R386-E413 PolarHBondContact NH1-OE1 3.4Å; R386-E413 IonicContact NH1-OE2 3.88Å; R386-E413 IonicContact NH2-OE1 3.57Å; R386-E413 PolarHBondContact NH2-OE1 3.06Å; R386-G418 VanDerWaalsContact CZ-O 3.29Å; R386-G418 PolarHBondContact NE-O 3.44Å; R386-G418 PolarHBondContact NH2-O 3.39Å; R386-G418 VanDerWaalsContact NH2-O 3.12Å; R386-S422 PolarHBondContact NE-OG 3.22Å; R386-S422 VanDerWaalsContact NE-OG 3.08Å; R386-V425 HydrophobicContact CB-CB 4.37Å; R386-V425 HydrophobicContact CB-CG1 4.31Å; R386-V425 HydrophobicContact CB-CG2 3.91Å
387	L	93.4	Very high	88.5	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-36.4	177.6	-175.1	65.1	0	0	0	112	F383 V384 K389 H390 T391 H429 W432 L441	F383-L387 HydrophobicContact CE1-CD2 4.17Å; F383-L387 HydrophobicContact CZ-CD2 3.94Å; F383-L387 PolarHBondContact O-N 3.37Å; V384-L387 PolarHBondContact O-N 3.31Å; L387-K389 PolarHBondContact O-N 3.13Å; L387-K389 VanDerWaalsContact O-N 3.07Å; L387-H390 PolarHBondContact O-N 3.06Å; L387-T391 PolarHBondContact O-N 2.66Å; L387-H429 HydrophobicContact CD1-CB 3.84Å; L387-W432 HydrophobicContact CD1-CB 3.93Å; L387-W432 HydrophobicContact CD2-CB 4Å; L387-L441 HydrophobicContact CD2-CD2 3.43Å; L387-L441 VanDerWaalsContact CD2-CD2 3.43Å
388	L	91.3	Very high	87.4	Confident	66 Å²	66	40.1 Å²	40.1	35%	0.346	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-20.1	175.5	-76.3	172.6	0	0	0	114.4	V384 R386 H390 T391 I393 L399	V384-L388 HydrophobicContact CG1-CD1 4.49Å; V384-L388 WeakPolarHBondContact O-CG 3.27Å; V384-L388 PolarHBondContact O-N 3.26Å; R386-L388 VanDerWaalsContact C-N 3.26Å; R386-L388 PolarHBondContact O-N 2.85Å; L388-H390 PolarHBondContact O-N 3.01Å; L388-T391 WeakPolarHBondContact CA-O 3.3Å; L388-I393 HydrophobicContact CD2-CB 3.93Å; L388-I393 HydrophobicContact CD2-CD1 3.7Å; L388-I393 HydrophobicContact CD2-CG1 3.88Å; L388-I393 HydrophobicContact CG-CD1 4.24Å; L388-L399 HydrophobicContact CD1-CD2 3.51Å; L388-L399 HydrophobicContact CD1-CG 4.41Å; L388-L399 HydrophobicContact CD2-CD2 4.16Å; L388-L399 HydrophobicContact CG-CD2 4.23Å
389	K	90.3	Very high	86.8	Confident	157 Å²	157	40.7 Å²	40.7	68%	0.683	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-22.8	173.9	-60	179.7	-178.9	179	0	112.6	R386 L387	R386-K389 VanDerWaalsContact O-CB 3.32Å; R386-K389 WeakPolarHBondContact O-CB 3.49Å; R386-K389 PolarHBondContact O-N 3.22Å; R386-K389 VanDerWaalsContact O-N 3.08Å; L387-K389 PolarHBondContact O-N 3.13Å; L387-K389 VanDerWaalsContact O-N 3.07Å
390	H	91.1	Very high	86	Confident	63 Å²	63	46.5 Å²	46.5	29%	0.292	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-16.4	-176.2	-57.6	-97	0	0	0	112.7	L387 L388 H429 E498	L387-H390 PolarHBondContact O-N 3.06Å; L388-H390 PolarHBondContact O-N 3.01Å; H390-H429 HydrophobicContact CB-CB 4.03Å; H390-H429 AromaticContact CE1-CD2 3.93Å; H390-H429 AromaticContact CG-CD2 3.85Å; H390-H429 AromaticContact CG-CG 3.81Å; H390-H429 AromaticContact ND1-CD2 3.43Å; H390-H429 PolarHBondContact ND1-CD2 2.59Å; H390-H429 AromaticContact ND1-CG 3.84Å; H390-H429 AromaticContact ND1-NE2 3.61Å; H390-E498 IonicContact CE1-OE1 2.72Å; H390-E498 PolarHBondContact CE1-OE1 3.14Å; H390-E498 IonicContact CE1-OE2 3.09Å; H390-E498 IonicContact NE2-OE1 2.68Å; H390-E498 IonicContact NE2-OE2 3.51Å
391	T	89.5	Confident	85.2	Confident	20 Å²	20	54.1 Å²	54.1	12%	0.123	31%	0.31	C	S	.	.			trans	-150.7	138.2	-173.7	-67.3	0	0	0	0	112	L387 L388 I393 S433 L438	L387-T391 PolarHBondContact O-N 2.66Å; L388-T391 WeakPolarHBondContact CA-O 3.3Å; T391-I393 PolarHBondContact O-N 2.78Å; T391-S433 WeakPolarHBondContact OG1-CB 3.41Å; T391-S433 PolarHBondContact OG1-OG 3.25Å; T391-L438 HydrophobicContact CG2-CD1 4.02Å; T391-L438 HydrophobicContact CG2-CD2 3.81Å
392	S	86.4	Confident	84.7	Confident	105 Å²	105	54.1 Å²	54.1	73%	0.734	31%	0.31	S	S	*	.			trans	-81.9	115.4	171.3	-55.9	0	0	0	0	109.9	G394	S392-G394 PolarHBondContact O-N 2.92Å
393	I	81	Confident	83.9	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.087	34%	0.341	C	S	.	.			trans	-80.2	97.7	166.9	-69.2	169.6	0	0	0	106.6	V384 L388 T391 I396 L399 L438 E442 I445	V384-I393 HydrophobicContact CG1-CD1 4Å; L388-I393 HydrophobicContact CD2-CB 3.93Å; L388-I393 HydrophobicContact CD2-CD1 3.7Å; L388-I393 HydrophobicContact CD2-CG1 3.88Å; L388-I393 HydrophobicContact CG-CD1 4.24Å; T391-I393 PolarHBondContact O-N 2.78Å; I393-I396 HydrophobicContact CG2-CB 4.05Å; I393-I396 HydrophobicContact CG2-CD1 3.93Å; I393-I396 HydrophobicContact CG2-CG1 3.89Å; I393-L399 HydrophobicContact CD1-CD2 4.4Å; I393-L438 HydrophobicContact CG1-CD1 4.29Å; I393-E442 WeakPolarHBondContact CA-OE1 3.28Å; I393-E442 HydrophobicContact CG2-CG 3.85Å; I393-I445 HydrophobicContact CD1-CD1 3.84Å
394	G	73.8	Confident	83.3	Confident	72 Å²	72	60.7 Å²	60.7	74%	0.742	34%	0.344	S	S	*	.			trans	-78.5	-22.8	-173.4	0	0	0	0	0	113.3	S392 E442	S392-G394 PolarHBondContact O-N 2.92Å; G394-E442 PolarHBondContact N-OE1 3.36Å
395	G	70.8	Confident	82.9	Confident	57 Å²	57	60.8 Å²	60.8	59%	0.588	34%	0.344	S	S	*	.	S	Bend	trans	-81.3	-9.8	-172.3	0	0	0	0	0	116.4	E442	G395-E442 PolarHBondContact N-OE1 3.47Å
396	I	76.4	Confident	82.4	Confident	26 Å²	26	60.2 Å²	60.2	13%	0.133	34%	0.34	C	S	.	.			trans	-128.5	111.4	-165.8	-51.3	-179.4	0	0	0	111.1	I393 L399 E442 I445 L449	I393-I396 HydrophobicContact CG2-CB 4.05Å; I393-I396 HydrophobicContact CG2-CD1 3.93Å; I393-I396 HydrophobicContact CG2-CG1 3.89Å; I396-L399 HydrophobicContact CG2-CD1 4.44Å; I396-E442 HydrophobicContact CD1-CB 4.48Å; I396-E442 WeakPolarHBondContact CD1-O 3.39Å; I396-I445 HydrophobicContact CD1-CB 3.49Å; I396-I445 VanDerWaalsContact CD1-CB 3.49Å; I396-I445 HydrophobicContact CD1-CD1 4.5Å; I396-I445 HydrophobicContact CD1-CG2 3.33Å; I396-L449 HydrophobicContact CG2-CD1 3.49Å; I396-L449 VanDerWaalsContact CG2-CD1 3.49Å
397	T	73.6	Confident	81.6	Confident	118 Å²	118	65 Å²	65	72%	0.724	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	150.9	174	65.2	0	0	0	0	111.1	L399	T397-L399 VanDerWaalsContact C-N 3.31Å; T397-L399 PolarHBondContact O-N 3.22Å
398	N	72.6	Confident	80.7	Confident	90 Å²	90	70.6 Å²	70.6	48%	0.481	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	20.7	172.4	-56.8	-68	0	0	0	116.9	E400 K401 S402	N398-E400 PolarHBondContact O-N 3.39Å; N398-E400 VanDerWaalsContact O-N 3.1Å; N398-K401 HydrophobicContact CB-CB 4.38Å; N398-K401 HydrophobicContact CB-CD 4.15Å; N398-K401 HydrophobicContact CB-CG 4.46Å; N398-K401 WeakPolarHBondContact O-CB 3.32Å; N398-K401 PolarHBondContact O-N 3.15Å; N398-K401 WeakPolarHBondContact OD1-CE 3.47Å; N398-K401 PolarHBondContact OD1-NZ 2.98Å; N398-S402 PolarHBondContact O-N 2.96Å
399	L	82	Confident	80.1	Confident	14 Å²	14	67.9 Å²	67.9	7%	0.073	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-54.9	-32.4	175.4	-166.6	64.7	0	0	0	112.9	V384 L388 I393 I396 T397 K401 S402 F405 I445 L449	V384-L399 HydrophobicContact CG1-CD2 3.77Å; L388-L399 HydrophobicContact CD1-CD2 3.51Å; L388-L399 HydrophobicContact CD1-CG 4.41Å; L388-L399 HydrophobicContact CD2-CD2 4.16Å; L388-L399 HydrophobicContact CG-CD2 4.23Å; I393-L399 HydrophobicContact CD1-CD2 4.4Å; I396-L399 HydrophobicContact CG2-CD1 4.44Å; T397-L399 VanDerWaalsContact C-N 3.31Å; T397-L399 PolarHBondContact O-N 3.22Å; L399-K401 VanDerWaalsContact C-N 3.26Å; L399-K401 PolarHBondContact O-N 2.87Å; L399-S402 VanDerWaalsContact O-CB 3.29Å; L399-S402 WeakPolarHBondContact O-CB 3Å; L399-S402 PolarHBondContact O-N 3.5Å; L399-F405 HydrophobicContact CD1-CB 3.4Å; L399-F405 VanDerWaalsContact CD1-CB 3.4Å; L399-F405 HydrophobicContact CD1-CD2 3.61Å; L399-F405 HydrophobicContact CD1-CG 3.82Å; L399-F405 HydrophobicContact CG-CB 3.88Å; L399-I445 HydrophobicContact CD1-CG2 4.09Å; L399-L449 HydrophobicContact CD1-CD1 4.33Å
400	E	77.6	Confident	79.6	Confident	127 Å²	127	63.6 Å²	63.6	59%	0.593	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-64.2	-25.5	174.5	-60.1	-163.2	129.2	0	0	114.3	N398 K407	N398-E400 PolarHBondContact O-N 3.39Å; N398-E400 VanDerWaalsContact O-N 3.1Å; E400-K407 IonicContact OE1-NZ 3.44Å; E400-K407 PolarHBondContact OE1-NZ 3.05Å
401	K	79.4	Confident	79.1	Confident	161 Å²	161	68 Å²	68	70%	0.7	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-90.3	-8.9	178.6	-61.4	179.3	-175.4	158.1	0	112.4	N398 L399 I403	N398-K401 HydrophobicContact CB-CB 4.38Å; N398-K401 HydrophobicContact CB-CD 4.15Å; N398-K401 HydrophobicContact CB-CG 4.46Å; N398-K401 WeakPolarHBondContact O-CB 3.32Å; N398-K401 PolarHBondContact O-N 3.15Å; N398-K401 WeakPolarHBondContact OD1-CE 3.47Å; N398-K401 PolarHBondContact OD1-NZ 2.98Å; L399-K401 VanDerWaalsContact C-N 3.26Å; L399-K401 PolarHBondContact O-N 2.87Å; K401-I403 PolarHBondContact O-N 3.43Å
402	S	82.6	Confident	78.7	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.007	40%	0.397	C	S	.	.			trans	-65.6	134.4	-179	-174.7	0	0	0	0	110.3	N398 L399 L404 F405 G406 L449 E453	N398-S402 PolarHBondContact O-N 2.96Å; L399-S402 VanDerWaalsContact O-CB 3.29Å; L399-S402 WeakPolarHBondContact O-CB 3Å; L399-S402 PolarHBondContact O-N 3.5Å; S402-L404 PolarHBondContact O-N 3.06Å; S402-L404 PolarHBondContact OG-N 2.62Å; S402-F405 PolarHBondContact OG-N 3.26Å; S402-G406 WeakPolarHBondContact O-CA 3.46Å; S402-G406 PolarHBondContact O-N 2.83Å; S402-L449 WeakPolarHBondContact OG-CD2 3.48Å; S402-E453 VanDerWaalsContact CA-OE1 3.29Å; S402-E453 WeakPolarHBondContact CA-OE1 3.49Å; S402-E453 VanDerWaalsContact CB-OE1 3.25Å; S402-E453 WeakPolarHBondContact CB-OE1 3.31Å; S402-E453 PolarHBondContact OG-OE1 3.12Å
403	I	78.4	Confident	78.8	Confident	125 Å²	125	65.6 Å²	65.6	64%	0.641	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-32.3	174.2	-61.6	171.5	0	0	0	110.6	K401 V409 P454	K401-I403 PolarHBondContact O-N 3.43Å; I403-V409 WeakPolarHBondContact O-CG2 3.33Å; I403-P454 HydrophobicContact CD1-CG 4.16Å
404	L	81.8	Confident	79.4	Confident	12 Å²	12	66.2 Å²	66.2	6%	0.063	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-37	-174	-170.1	66.8	0	0	0	112.9	I378 P381 S402 V409 V448 V452 L469	I378-L404 HydrophobicContact CG1-CD2 4.38Å; P381-L404 HydrophobicContact CB-CD1 3.58Å; P381-L404 HydrophobicContact CB-CG 3.72Å; P381-L404 WeakPolarHBondContact CB-O 3.36Å; P381-L404 HydrophobicContact CG-CD1 3.85Å; S402-L404 PolarHBondContact O-N 3.06Å; S402-L404 PolarHBondContact OG-N 2.62Å; L404-V409 WeakPolarHBondContact O-CG2 3.34Å; L404-V448 HydrophobicContact CD2-CG1 3.7Å; L404-V452 HydrophobicContact CB-CG2 4.2Å; L404-V452 HydrophobicContact CD2-CB 4.47Å; L404-V452 HydrophobicContact CD2-CG1 4.24Å; L404-V452 HydrophobicContact CD2-CG2 3.92Å; L404-L469 HydrophobicContact CD1-CD2 3.9Å; L404-L469 HydrophobicContact CD2-CD2 4.33Å
405	F	85.1	Confident	80.2	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.018	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-1.4	-176.8	-57	-56.4	0	0	0	114.3	L377 P381 V384 S385 L399 S402 I445 V448 L449	L377-F405 HydrophobicContact CB-CZ 4.34Å; P381-F405 HydrophobicContact CB-CD1 4.27Å; P381-F405 HydrophobicContact CB-CE1 4.28Å; V384-F405 HydrophobicContact CB-CD1 3.75Å; V384-F405 HydrophobicContact CB-CE1 4.23Å; V384-F405 HydrophobicContact CB-CG 4.32Å; V384-F405 HydrophobicContact CG1-CB 4.49Å; V384-F405 HydrophobicContact CG1-CD1 4.32Å; V384-F405 HydrophobicContact CG1-CG 4.42Å; V384-F405 HydrophobicContact CG2-CD1 3.65Å; V384-F405 HydrophobicContact CG2-CE1 3.59Å; V384-F405 HydrophobicContact CG2-CG 4.43Å; V384-F405 HydrophobicContact CG2-CZ 4.32Å; S385-F405 PolarHBondContact OG-O 2.68Å; S385-F405 VanDerWaalsContact OG-O 3.07Å; L399-F405 HydrophobicContact CD1-CB 3.4Å; L399-F405 VanDerWaalsContact CD1-CB 3.4Å; L399-F405 HydrophobicContact CD1-CD2 3.61Å; L399-F405 HydrophobicContact CD1-CG 3.82Å; L399-F405 HydrophobicContact CG-CB 3.88Å; S402-F405 PolarHBondContact OG-N 3.26Å; F405-I445 HydrophobicContact CD2-CG2 4.1Å; F405-I445 HydrophobicContact CE2-CG2 3.82Å; F405-I445 HydrophobicContact CZ-CG2 4.46Å; F405-V448 HydrophobicContact CE2-CB 4.34Å; F405-V448 HydrophobicContact CE2-CG1 3.94Å; F405-V448 HydrophobicContact CZ-CB 4.27Å; F405-V448 HydrophobicContact CZ-CG1 3.74Å; F405-L449 HydrophobicContact CD2-CD2 3.74Å; F405-L449 HydrophobicContact CD2-CG 4.22Å; F405-L449 HydrophobicContact CE2-CD2 4.05Å; F405-L449 HydrophobicContact CE2-CG 4.17Å
406	G	80.9	Confident	81.3	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.01	34%	0.342	C	S	.	.	S	Bend	trans	-65.2	170.6	175.4	0	0	0	0	0	113.3	S402 E408 V409	S402-G406 WeakPolarHBondContact O-CA 3.46Å; S402-G406 PolarHBondContact O-N 2.83Å; G406-E408 PolarHBondContact O-N 3.12Å; G406-V409 PolarHBondContact O-N 3.09Å
407	K	75.9	Confident	82.2	Confident	128 Å²	128	65.1 Å²	65.1	56%	0.557	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.6	-177.1	-73.8	167.5	172.8	153	0	112.1	E400 V409 L410	E400-K407 IonicContact OE1-NZ 3.44Å; E400-K407 PolarHBondContact OE1-NZ 3.05Å; K407-V409 VanDerWaalsContact C-N 3.29Å; K407-V409 PolarHBondContact O-N 2.9Å; K407-L410 WeakPolarHBondContact O-CB 3.3Å; K407-L410 PolarHBondContact O-N 2.98Å
408	E	74.3	Confident	83.2	Confident	118 Å²	118	59.7 Å²	59.7	55%	0.551	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-29.9	-179.8	-64.9	70.2	-154.9	0	0	112.5	G406 L410 L411 S412	G406-E408 PolarHBondContact O-N 3.12Å; E408-L410 PolarHBondContact O-N 3.33Å; E408-L411 WeakPolarHBondContact O-CB 3.16Å; E408-L411 PolarHBondContact O-N 3.21Å; E408-S412 PolarHBondContact O-N 2.87Å
409	V	79.4	Confident	84.3	Confident	9 Å²	9	55.9 Å²	55.9	6%	0.055	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-35.7	177.7	169.8	0	0	0	0	111.4	P381 I403 L404 G406 K407 L411 S412 E413	P381-V409 HydrophobicContact CB-CG1 4Å; P381-V409 HydrophobicContact CG-CG1 3.7Å; I403-V409 WeakPolarHBondContact O-CG2 3.33Å; L404-V409 WeakPolarHBondContact O-CG2 3.34Å; G406-V409 PolarHBondContact O-N 3.09Å; K407-V409 VanDerWaalsContact C-N 3.29Å; K407-V409 PolarHBondContact O-N 2.9Å; V409-L411 PolarHBondContact O-N 2.79Å; V409-S412 PolarHBondContact O-N 3.24Å; V409-S412 PolarHBondContact O-OG 2.62Å; V409-E413 PolarHBondContact O-N 3.14Å; V409-E413 VanDerWaalsContact O-N 3.12Å
410	L	79.1	Confident	85	Confident	68 Å²	68	55.5 Å²	55.5	36%	0.356	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-25.2	175.5	-57.2	177.5	0	0	0	112.6	K407 E408	K407-L410 WeakPolarHBondContact O-CB 3.3Å; K407-L410 PolarHBondContact O-N 2.98Å; E408-L410 PolarHBondContact O-N 3.33Å
411	L	79.9	Confident	86	Confident	155 Å²	155	49.4 Å²	49.4	81%	0.812	25%	0.253	S	S	*	.	H	α-helix	trans	-80.4	-25.3	175.8	-59	173.4	0	0	0	112.6	E408 V409	E408-L411 WeakPolarHBondContact O-CB 3.16Å; E408-L411 PolarHBondContact O-N 3.21Å; V409-L411 PolarHBondContact O-N 2.79Å
412	S	82.5	Confident	86.8	Confident	58 Å²	58	42.7 Å²	42.7	41%	0.406	23%	0.226	S	C	.	.	H	α-helix	trans	-89.4	-17.5	-178.9	76.1	0	0	0	0	113.5	E408 V409	E408-S412 PolarHBondContact O-N 2.87Å; V409-S412 PolarHBondContact O-N 3.24Å; V409-S412 PolarHBondContact O-OG 2.62Å
413	E	88.7	Confident	87.5	Confident	17 Å²	17	42.8 Å²	42.8	8%	0.079	23%	0.227	C	C	.	.	S	Bend	trans	-80.9	140.6	-177.3	-173.9	170.4	84.4	0	0	111.2	R386 V409 L417 G418 L421	R386-E413 IonicContact CZ-OE1 3.32Å; R386-E413 IonicContact NH1-OE1 2.68Å; R386-E413 PolarHBondContact NH1-OE1 3.4Å; R386-E413 IonicContact NH1-OE2 3.88Å; R386-E413 IonicContact NH2-OE1 3.57Å; R386-E413 PolarHBondContact NH2-OE1 3.06Å; V409-E413 PolarHBondContact O-N 3.14Å; V409-E413 VanDerWaalsContact O-N 3.12Å; E413-L417 HydrophobicContact CG-CB 4.09Å; E413-L417 HydrophobicContact CG-CD2 4.01Å; E413-L417 HydrophobicContact CG-CG 4.08Å; E413-G418 WeakPolarHBondContact OE1-CA 3.26Å; E413-L421 WeakPolarHBondContact OE2-CD1 3.47Å
414	S	92.4	Very high	88.5	Confident	29 Å²	29	37.2 Å²	37.2	20%	0.203	20%	0.198	C	C	.	.			trans	-69.7	144	172.1	59.2	0	0	0	0	111	S416 L417 G418 Y480	S414-S416 PolarHBondContact O-N 3.22Å; S414-S416 VanDerWaalsContact O-N 3.07Å; S414-L417 PolarHBondContact O-N 3.48Å; S414-L417 VanDerWaalsContact OG-CB 3.25Å; S414-L417 WeakPolarHBondContact OG-CB 3.38Å; S414-L417 PolarHBondContact OG-N 3.46Å; S414-G418 PolarHBondContact O-N 2.89Å; S414-Y480 WeakPolarHBondContact CB-O 3.43Å; S414-Y480 WeakPolarHBondContact OG-CB 3.3Å; S414-Y480 PolarHBondContact OG-O 3.11Å
415	D	91.9	Very high	89.2	Confident	125 Å²	125	36.7 Å²	36.7	67%	0.668	20%	0.195	S	C	*	.	H	α-helix	trans	-53.2	-35.3	177.2	-59.8	-28.9	0	0	0	113.3	G418 C419 I502	D415-G418 PolarHBondContact O-N 3.27Å; D415-C419 WeakPolarHBondContact O-CB 3.5Å; D415-C419 PolarHBondContact O-N 2.93Å; D415-I502 HydrophobicContact CB-CD1 3.6Å
416	S	93	Very high	89.8	Confident	7 Å²	7	37.7 Å²	37.7	5%	0.049	20%	0.204	C	C	.	.	H	α-helix	trans	-69.6	-48	-178.6	79.9	0	0	0	0	112.9	S414 G418 C419 L420 Y480 F483	S414-S416 PolarHBondContact O-N 3.22Å; S414-S416 VanDerWaalsContact O-N 3.07Å; S416-G418 VanDerWaalsContact C-N 3.27Å; S416-G418 PolarHBondContact O-N 3.23Å; S416-C419 PolarHBondContact O-N 3.33Å; S416-L420 PolarHBondContact O-N 3.47Å; S416-L420 VanDerWaalsContact O-N 3.08Å; S416-Y480 VanDerWaalsContact OG-C 3.26Å; S416-Y480 WeakPolarHBondContact OG-CB 3.29Å; S416-Y480 PolarHBondContact OG-O 3.36Å; S416-F483 VanDerWaalsContact CA-CZ 3.47Å; S416-F483 VanDerWaalsContact O-CE1 3.25Å; S416-F483 WeakPolarHBondContact O-CE1 3.33Å; S416-F483 VanDerWaalsContact O-CZ 3.27Å; S416-F483 WeakPolarHBondContact O-CZ 3.44Å
417	L	95.4	Very high	90.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-43	171.2	178.9	56.6	0	0	0	110.9	P342 F380 E413 S414 C419 L420 L421 R476 Y480	P342-L417 HydrophobicContact CG-CD1 3.73Å; F380-L417 HydrophobicContact CD1-CD1 4.05Å; F380-L417 HydrophobicContact CE1-CD1 4.08Å; E413-L417 HydrophobicContact CG-CB 4.09Å; E413-L417 HydrophobicContact CG-CD2 4.01Å; E413-L417 HydrophobicContact CG-CG 4.08Å; S414-L417 PolarHBondContact O-N 3.48Å; S414-L417 VanDerWaalsContact OG-CB 3.25Å; S414-L417 WeakPolarHBondContact OG-CB 3.38Å; S414-L417 PolarHBondContact OG-N 3.46Å; L417-C419 VanDerWaalsContact C-N 3.28Å; L417-C419 PolarHBondContact O-N 3.03Å; L417-L420 PolarHBondContact O-N 3.24Å; L417-L420 VanDerWaalsContact O-N 3.15Å; L417-L421 HydrophobicContact CD1-CD1 4.27Å; L417-L421 HydrophobicContact CD1-CG 4.29Å; L417-L421 HydrophobicContact CG-CD1 4.02Å; L417-L421 HydrophobicContact CG-CG 4.49Å; L417-L421 WeakPolarHBondContact O-CG 3.26Å; L417-L421 PolarHBondContact O-N 2.69Å; L417-R476 HydrophobicContact CD2-CB 4.11Å; L417-R476 VanDerWaalsContact CD2-CD 3.42Å; L417-R476 HydrophobicContact CD2-CG 3.69Å; L417-Y480 HydrophobicContact CB-CD1 4.36Å; L417-Y480 HydrophobicContact CB-CD2 4.01Å; L417-Y480 HydrophobicContact CB-CG 3.79Å; L417-Y480 HydrophobicContact CD1-CD1 4.12Å; L417-Y480 HydrophobicContact CD1-CD2 4.07Å; L417-Y480 HydrophobicContact CD1-CE1 4.08Å; L417-Y480 HydrophobicContact CD1-CE2 4.06Å; L417-Y480 HydrophobicContact CD1-CG 4.14Å; L417-Y480 HydrophobicContact CD2-CD2 3.74Å; L417-Y480 HydrophobicContact CD2-CE2 3.99Å; L417-Y480 HydrophobicContact CD2-CG 4.37Å; L417-Y480 HydrophobicContact CG-CD2 4.16Å; L417-Y480 HydrophobicContact CG-CG 4.32Å
418	G	94.9	Very high	91.6	Very high	5 Å²	5	33.1 Å²	33.1	5%	0.052	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-37.5	-179	0	0	0	0	0	113.4	R386 E413 S414 D415 S416 S422	R386-G418 VanDerWaalsContact CZ-O 3.29Å; R386-G418 PolarHBondContact NE-O 3.44Å; R386-G418 PolarHBondContact NH2-O 3.39Å; R386-G418 VanDerWaalsContact NH2-O 3.12Å; E413-G418 WeakPolarHBondContact OE1-CA 3.26Å; S414-G418 PolarHBondContact O-N 2.89Å; D415-G418 PolarHBondContact O-N 3.27Å; S416-G418 VanDerWaalsContact C-N 3.27Å; S416-G418 PolarHBondContact O-N 3.23Å; G418-S422 PolarHBondContact O-N 3.26Å; G418-S422 PolarHBondContact O-OG 2.85Å; G418-S422 VanDerWaalsContact O-OG 3.08Å
419	C	95.5	Very high	92.6	Very high	9 Å²	9	30 Å²	30	6%	0.061	17%	0.168	C	C	.	.	H	α-helix	trans	-72.7	-34.9	174.5	167.7	0	0	0	0	112.3	D415 S416 L417 L421 S422 L423 F483 P500 I502	D415-C419 WeakPolarHBondContact O-CB 3.5Å; D415-C419 PolarHBondContact O-N 2.93Å; S416-C419 PolarHBondContact O-N 3.33Å; L417-C419 VanDerWaalsContact C-N 3.28Å; L417-C419 PolarHBondContact O-N 3.03Å; C419-L421 PolarHBondContact O-N 3.36Å; C419-S422 PolarHBondContact O-N 3.49Å; C419-L423 WeakPolarHBondContact O-CB 3.24Å; C419-L423 PolarHBondContact O-N 3.33Å; C419-F483 HydrophobicContact CB-CE2 4.31Å; C419-F483 HydrophobicContact CB-CZ 3.73Å; C419-P500 PolarHBondContact SG-O 3.24Å; C419-P500 VanDerWaalsContact SG-O 3.39Å; C419-I502 HydrophobicContact CB-CD1 4.27Å
420	L	96.9	Very high	93.4	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-40.7	170.4	-68.3	176	0	0	0	112.7	L310 P342 S416 L417 L423 Y424 Y480 F483 I487	L310-L420 HydrophobicContact CD1-CD2 4.03Å; L310-L420 HydrophobicContact CD2-CD2 4.29Å; P342-L420 HydrophobicContact CG-CB 4.12Å; S416-L420 PolarHBondContact O-N 3.47Å; S416-L420 VanDerWaalsContact O-N 3.08Å; L417-L420 PolarHBondContact O-N 3.24Å; L417-L420 VanDerWaalsContact O-N 3.15Å; L420-L423 WeakPolarHBondContact O-CB 3.29Å; L420-L423 PolarHBondContact O-N 3.13Å; L420-Y424 PolarHBondContact O-N 3.43Å; L420-Y480 HydrophobicContact CD1-CD1 4.41Å; L420-F483 HydrophobicContact CD2-CE1 4.16Å; L420-F483 HydrophobicContact CG-CE1 3.99Å; L420-I487 HydrophobicContact CD2-CG2 3.97Å
421	L	97.1	Very high	94.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-43.4	176.3	-72.4	166	0	0	0	111.4	P342 F380 F383 E413 L417 C419 L423 Y424 V425	P342-L421 HydrophobicContact CB-CD2 3.6Å; P342-L421 HydrophobicContact CB-CG 4.29Å; P342-L421 HydrophobicContact CG-CD2 3.96Å; P342-L421 HydrophobicContact CG-CG 4.18Å; F380-L421 HydrophobicContact CB-CD2 3.95Å; F380-L421 HydrophobicContact CG-CD2 4.43Å; F383-L421 HydrophobicContact CB-CD2 4.07Å; E413-L421 WeakPolarHBondContact OE2-CD1 3.47Å; L417-L421 HydrophobicContact CD1-CD1 4.27Å; L417-L421 HydrophobicContact CD1-CG 4.29Å; L417-L421 HydrophobicContact CG-CD1 4.02Å; L417-L421 HydrophobicContact CG-CG 4.49Å; L417-L421 WeakPolarHBondContact O-CG 3.26Å; L417-L421 PolarHBondContact O-N 2.69Å; C419-L421 PolarHBondContact O-N 3.36Å; L421-L423 VanDerWaalsContact C-N 3.32Å; L421-L423 PolarHBondContact O-N 2.9Å; L421-Y424 PolarHBondContact O-N 2.87Å; L421-V425 WeakPolarHBondContact O-CB 3.28Å; L421-V425 VanDerWaalsContact O-CG2 3.29Å; L421-V425 WeakPolarHBondContact O-CG2 3.34Å; L421-V425 PolarHBondContact O-N 2.9Å
422	S	97	Very high	95	Very high	19 Å²	19	23.4 Å²	23.4	13%	0.133	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-42.2	173.8	-62.7	0	0	0	0	111.4	R386 G418 C419 Y424 V425 A426 E498	R386-S422 PolarHBondContact NE-OG 3.22Å; R386-S422 VanDerWaalsContact NE-OG 3.08Å; G418-S422 PolarHBondContact O-N 3.26Å; G418-S422 PolarHBondContact O-OG 2.85Å; G418-S422 VanDerWaalsContact O-OG 3.08Å; C419-S422 PolarHBondContact O-N 3.49Å; S422-Y424 VanDerWaalsContact C-N 3.33Å; S422-Y424 PolarHBondContact O-N 2.74Å; S422-V425 PolarHBondContact O-N 2.79Å; S422-A426 VanDerWaalsContact O-CB 3.28Å; S422-A426 WeakPolarHBondContact O-CB 3.49Å; S422-A426 PolarHBondContact O-N 3.02Å; S422-E498 WeakPolarHBondContact CB-O 3.27Å
423	L	97.8	Very high	95.6	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-59.5	-44.9	177.7	-178.7	67.3	0	0	0	111.5	C419 L420 L421 R427 L491 V496 A499	C419-L423 WeakPolarHBondContact O-CB 3.24Å; C419-L423 PolarHBondContact O-N 3.33Å; L420-L423 WeakPolarHBondContact O-CB 3.29Å; L420-L423 PolarHBondContact O-N 3.13Å; L421-L423 VanDerWaalsContact C-N 3.32Å; L421-L423 PolarHBondContact O-N 2.9Å; L423-R427 WeakPolarHBondContact O-CG 3.45Å; L423-R427 PolarHBondContact O-N 2.67Å; L423-L491 HydrophobicContact CD1-CD2 4.43Å; L423-L491 HydrophobicContact CD2-CD2 3.94Å; L423-V496 HydrophobicContact CD1-CB 4.05Å; L423-V496 HydrophobicContact CD1-CG1 4.41Å; L423-V496 HydrophobicContact CD1-CG2 3.8Å; L423-A499 HydrophobicContact CB-CB 3.69Å; L423-A499 HydrophobicContact CD1-CB 4.09Å
424	Y	98.4	Very high	95.9	Very high	8 Å²	8	23.1 Å²	23.1	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-48.4	177.3	178.5	-107.3	0	0	0	112	D313 N343 L346 S347 F383 L420 L421 S422 A426 R427 M428 W432	D313-Y424 WeakPolarHBondContact OD2-CE2 3.4Å; N343-Y424 VanDerWaalsContact CA-CD2 3.44Å; N343-Y424 HydrophobicContact CB-CD2 3.48Å; N343-Y424 VanDerWaalsContact CB-CD2 3.48Å; N343-Y424 HydrophobicContact CB-CE2 3.94Å; N343-Y424 HydrophobicContact CB-CG 4.3Å; L346-Y424 HydrophobicContact CB-CD1 4.48Å; L346-Y424 HydrophobicContact CB-CE1 3.6Å; L346-Y424 HydrophobicContact CD1-CD1 3.62Å; L346-Y424 HydrophobicContact CD1-CE1 3.46Å; L346-Y424 VanDerWaalsContact CD1-CE1 3.46Å; L346-Y424 HydrophobicContact CG-CE1 4.18Å; S347-Y424 PolarHBondContact N-OH 3.15Å; S347-Y424 WeakPolarHBondContact OG-CE2 3.47Å; S347-Y424 PolarHBondContact OG-OH 3.04Å; F383-Y424 HydrophobicContact CD2-CD1 4.1Å; F383-Y424 HydrophobicContact CD2-CE1 4.25Å; F383-Y424 AromaticContact CE2-CD1 3.92Å; F383-Y424 HydrophobicContact CE2-CD1 3.92Å; F383-Y424 AromaticContact CE2-CE1 3.73Å; F383-Y424 HydrophobicContact CE2-CE1 3.73Å; F383-Y424 HydrophobicContact CZ-CE1 4.41Å; L420-Y424 PolarHBondContact O-N 3.43Å; L421-Y424 PolarHBondContact O-N 2.87Å; S422-Y424 VanDerWaalsContact C-N 3.33Å; S422-Y424 PolarHBondContact O-N 2.74Å; Y424-A426 PolarHBondContact O-N 2.64Å; Y424-R427 PolarHBondContact O-N 3.48Å; Y424-M428 HydrophobicContact CD2-CB 4.44Å; Y424-M428 HydrophobicContact CD2-CG 3.87Å; Y424-M428 HydrophobicContact CE1-CB 4.22Å; Y424-M428 HydrophobicContact CE2-CB 4.03Å; Y424-M428 HydrophobicContact CE2-CG 3.46Å; Y424-M428 VanDerWaalsContact CE2-CG 3.46Å; Y424-M428 WeakPolarHBondContact O-CB 3.46Å; Y424-M428 PolarHBondContact O-N 3.08Å; Y424-W432 AromaticContact CE1-NE1 3.6Å; Y424-W432 AromaticContact CZ-NE1 3.74Å; Y424-W432 PolarHBondContact OH-NE1 3.47Å
425	V	97.9	Very high	95.9	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-44.5	-179.5	171.1	0	0	0	0	111.1	F383 R386 L421 S422 R427 M428 H429	F383-V425 HydrophobicContact CD2-CG2 3.55Å; F383-V425 HydrophobicContact CE2-CG2 3.74Å; R386-V425 HydrophobicContact CB-CB 4.37Å; R386-V425 HydrophobicContact CB-CG1 4.31Å; R386-V425 HydrophobicContact CB-CG2 3.91Å; L421-V425 WeakPolarHBondContact O-CB 3.28Å; L421-V425 VanDerWaalsContact O-CG2 3.29Å; L421-V425 WeakPolarHBondContact O-CG2 3.34Å; L421-V425 PolarHBondContact O-N 2.9Å; S422-V425 PolarHBondContact O-N 2.79Å; V425-R427 PolarHBondContact O-N 2.8Å; V425-R427 VanDerWaalsContact O-N 3.14Å; V425-M428 PolarHBondContact O-N 2.69Å; V425-H429 HydrophobicContact CG1-CB 4.19Å; V425-H429 VanDerWaalsContact O-CB 3.26Å; V425-H429 WeakPolarHBondContact O-CB 3.3Å; V425-H429 PolarHBondContact O-N 2.85Å
426	A	96.9	Very high	95.8	Very high	25 Å²	25	26.9 Å²	26.9	21%	0.207	16%	0.161	C	C	.	.	H	α-helix	trans	-53.2	-37.6	176.6	0	0	0	0	0	112.3	S422 Y424 V496 E498	S422-A426 VanDerWaalsContact O-CB 3.28Å; S422-A426 WeakPolarHBondContact O-CB 3.49Å; S422-A426 PolarHBondContact O-N 3.02Å; Y424-A426 PolarHBondContact O-N 2.64Å; A426-V496 HydrophobicContact CB-CG1 3.66Å; A426-E498 WeakPolarHBondContact CA-OE2 3.47Å; A426-E498 HydrophobicContact CB-CB 4.33Å; A426-E498 WeakPolarHBondContact CB-OE2 3.45Å
427	R	96.4	Very high	96	Very high	32 Å²	32	26.6 Å²	26.6	12%	0.121	16%	0.159	C	C	.	.	H	α-helix	trans	-83.3	-36.7	-179.4	-70.2	175	174.2	159.8	1	113.4	L310 Y318 L423 Y424 V425 H490 S494	L310-R427 PolarHBondContact O-NH1 3.17Å; Y318-R427 PolarHBondContact OH-O 3.28Å; L423-R427 WeakPolarHBondContact O-CG 3.45Å; L423-R427 PolarHBondContact O-N 2.67Å; Y424-R427 PolarHBondContact O-N 3.48Å; V425-R427 PolarHBondContact O-N 2.8Å; V425-R427 VanDerWaalsContact O-N 3.14Å; R427-H490 PolarHBondContact NH1-NE2 3.2Å; R427-H490 PolarHBondContact NH2-NE2 2.73Å; R427-S494 PolarHBondContact NH2-OG 2.97Å
428	M	97.6	Very high	96	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-112.7	-8.5	-164	-64.9	-62.3	-75.8	0	0	114.5	C314 I317 Y318 L350 Y424 V425 P430 L431 W432	C314-M428 VanDerWaalsContact CA-SD 3.59Å; C314-M428 HydrophobicContact CB-SD 3.69Å; C314-M428 VanDerWaalsContact SG-SD 3.69Å; I317-M428 HydrophobicContact CB-CE 4.21Å; I317-M428 HydrophobicContact CD1-CE 3.76Å; I317-M428 HydrophobicContact CG2-CE 4.13Å; Y318-M428 HydrophobicContact CD2-SD 4.43Å; Y318-M428 HydrophobicContact CE2-SD 3.88Å; L350-M428 HydrophobicContact CD2-CE 4.27Å; Y424-M428 HydrophobicContact CD2-CB 4.44Å; Y424-M428 HydrophobicContact CD2-CG 3.87Å; Y424-M428 HydrophobicContact CE1-CB 4.22Å; Y424-M428 HydrophobicContact CE2-CB 4.03Å; Y424-M428 HydrophobicContact CE2-CG 3.46Å; Y424-M428 VanDerWaalsContact CE2-CG 3.46Å; Y424-M428 WeakPolarHBondContact O-CB 3.46Å; Y424-M428 PolarHBondContact O-N 3.08Å; V425-M428 PolarHBondContact O-N 2.69Å; M428-P430 VanDerWaalsContact C-N 3.29Å; M428-L431 HydrophobicContact CE-CD2 3.77Å; M428-L431 PolarHBondContact O-N 2.76Å; M428-L431 VanDerWaalsContact O-N 3.1Å; M428-W432 VanDerWaalsContact O-CD1 3.25Å; M428-W432 PolarHBondContact O-N 2.86Å
429	H	96.9	Very high	95.9	Very high	51 Å²	51	31.1 Å²	31.1	24%	0.236	19%	0.185	C	C	.	.	H	α-helix	trans	-51.2	-42.1	179.8	82.6	71.7	0	0	0	112.7	L387 H390 V425 L431 W432 S433	L387-H429 HydrophobicContact CD1-CB 3.84Å; H390-H429 HydrophobicContact CB-CB 4.03Å; H390-H429 AromaticContact CE1-CD2 3.93Å; H390-H429 AromaticContact CG-CD2 3.85Å; H390-H429 AromaticContact CG-CG 3.81Å; H390-H429 AromaticContact ND1-CD2 3.43Å; H390-H429 PolarHBondContact ND1-CD2 2.59Å; H390-H429 AromaticContact ND1-CG 3.84Å; H390-H429 AromaticContact ND1-NE2 3.61Å; V425-H429 HydrophobicContact CG1-CB 4.19Å; V425-H429 VanDerWaalsContact O-CB 3.26Å; V425-H429 WeakPolarHBondContact O-CB 3.3Å; V425-H429 PolarHBondContact O-N 2.85Å; H429-L431 PolarHBondContact O-N 3.41Å; H429-L431 VanDerWaalsContact O-N 3.1Å; H429-W432 PolarHBondContact O-N 3.31Å; H429-W432 VanDerWaalsContact O-N 3.07Å; H429-S433 WeakPolarHBondContact O-CB 3.44Å; H429-S433 PolarHBondContact O-N 2.85Å; H429-S433 PolarHBondContact O-OG 3.11Å
430	P	95.6	Very high	95.9	Very high	64 Å²	64	31.7 Å²	31.7	42%	0.416	19%	0.186	S	C	.	.	H	α-helix	trans	-60.6	-31	-175.8	-22.3	33.4	0	0	0	112.9	M428 S434	M428-P430 VanDerWaalsContact C-N 3.29Å; P430-S434 PolarHBondContact O-N 3.49Å
431	L	95.7	Very high	95.9	Very high	29 Å²	29	31.4 Å²	31.4	15%	0.152	19%	0.185	C	C	.	.	H	α-helix	trans	-77.5	-41.2	178.3	-176.3	65.3	0	0	0	112	I317 L350 L354 M428 H429 S433 S434 V437	I317-L431 HydrophobicContact CB-CD2 4.43Å; I317-L431 HydrophobicContact CG2-CD2 3.12Å; L350-L431 HydrophobicContact CD2-CD2 3.51Å; L350-L431 HydrophobicContact CD2-CG 4.15Å; L350-L431 HydrophobicContact CG-CD2 4.3Å; L354-L431 HydrophobicContact CD1-CD1 4.46Å; L354-L431 HydrophobicContact CD1-CD2 4.19Å; M428-L431 HydrophobicContact CE-CD2 3.77Å; M428-L431 PolarHBondContact O-N 2.76Å; M428-L431 VanDerWaalsContact O-N 3.1Å; H429-L431 PolarHBondContact O-N 3.41Å; H429-L431 VanDerWaalsContact O-N 3.1Å; L431-S433 VanDerWaalsContact C-N 3.25Å; L431-S433 PolarHBondContact O-N 3.47Å; L431-S434 WeakPolarHBondContact O-CB 3.46Å; L431-S434 PolarHBondContact O-N 3.3Å; L431-S434 VanDerWaalsContact O-N 3.1Å; L431-V437 WeakPolarHBondContact O-CB 3.36Å
432	W	97	Very high	95.8	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-31.6	174.7	-71.5	108.9	0	0	0	112.3	L346 L350 L373 F383 L387 Y424 M428 H429 S434 V437 L438 W440 L441	L346-W432 HydrophobicContact CB-CZ2 4.12Å; L350-W432 HydrophobicContact CB-CH2 3.93Å; L350-W432 HydrophobicContact CB-CZ2 4.02Å; L350-W432 HydrophobicContact CD1-CH2 4.27Å; L350-W432 HydrophobicContact CD1-CZ3 4.25Å; L350-W432 HydrophobicContact CD2-CD2 4.31Å; L350-W432 HydrophobicContact CD2-CH2 4.17Å; L350-W432 HydrophobicContact CD2-CZ2 3.7Å; L350-W432 HydrophobicContact CG-CH2 4.36Å; L350-W432 HydrophobicContact CG-CZ2 4.33Å; L373-W432 HydrophobicContact CD1-CH2 3.9Å; L373-W432 HydrophobicContact CD1-CZ3 4.38Å; F383-W432 AromaticContact CZ-CD1 3.82Å; F383-W432 AromaticContact CZ-CD2 3.87Å; F383-W432 HydrophobicContact CZ-CD2 3.87Å; F383-W432 AromaticContact CZ-CE2 3.71Å; F383-W432 AromaticContact CZ-CG 3.94Å; F383-W432 HydrophobicContact CZ-CG 3.94Å; F383-W432 HydrophobicContact CZ-CZ2 4.27Å; F383-W432 AromaticContact CZ-NE1 3.69Å; L387-W432 HydrophobicContact CD1-CB 3.93Å; L387-W432 HydrophobicContact CD2-CB 4Å; Y424-W432 AromaticContact CE1-NE1 3.6Å; Y424-W432 AromaticContact CZ-NE1 3.74Å; Y424-W432 PolarHBondContact OH-NE1 3.47Å; M428-W432 VanDerWaalsContact O-CD1 3.25Å; M428-W432 PolarHBondContact O-N 2.86Å; H429-W432 PolarHBondContact O-N 3.31Å; H429-W432 VanDerWaalsContact O-N 3.07Å; W432-S434 PolarHBondContact O-N 2.89Å; W432-V437 HydrophobicContact CD2-CG1 4.38Å; W432-V437 HydrophobicContact CE3-CG1 3.59Å; W432-V437 HydrophobicContact CZ3-CG1 4.05Å; W432-L438 WeakPolarHBondContact O-CA 3.43Å; W432-L438 WeakPolarHBondContact O-CB 3.3Å; W432-L438 PolarHBondContact O-N 3.33Å; W432-W440 HydrophobicContact CH2-CZ3 4.11Å; W432-W440 HydrophobicContact CZ3-CE3 4.27Å; W432-W440 AromaticContact CZ3-CZ3 3.7Å; W432-W440 HydrophobicContact CZ3-CZ3 3.7Å; W432-L441 HydrophobicContact CE3-CB 4.28Å; W432-L441 HydrophobicContact CE3-CD1 4.26Å; W432-L441 HydrophobicContact CE3-CD2 3.86Å; W432-L441 HydrophobicContact CE3-CG 4.35Å; W432-L441 HydrophobicContact CZ3-CB 4.38Å; W432-L441 HydrophobicContact CZ3-CD1 4.02Å; W432-L441 HydrophobicContact CZ3-CD2 4.45Å
433	S	94.9	Very high	95.7	Very high	36 Å²	36	36.5 Å²	36.5	25%	0.252	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-7.6	173.2	-45.4	0	0	0	0	114.1	T391 H429 L431	T391-S433 WeakPolarHBondContact OG1-CB 3.41Å; T391-S433 PolarHBondContact OG1-OG 3.25Å; H429-S433 WeakPolarHBondContact O-CB 3.44Å; H429-S433 PolarHBondContact O-N 2.85Å; H429-S433 PolarHBondContact O-OG 3.11Å; L431-S433 VanDerWaalsContact C-N 3.25Å; L431-S433 PolarHBondContact O-N 3.47Å
434	S	94.2	Very high	95.5	Very high	33 Å²	33	36.3 Å²	36.3	23%	0.231	20%	0.204	C	C	.	.	S	Bend	trans	-62.5	140.6	-178.2	-177.9	0	0	0	0	110.8	P430 L431 W432 N436 V437 L438	P430-S434 PolarHBondContact O-N 3.49Å; L431-S434 WeakPolarHBondContact O-CB 3.46Å; L431-S434 PolarHBondContact O-N 3.3Å; L431-S434 VanDerWaalsContact O-N 3.1Å; W432-S434 PolarHBondContact O-N 2.89Å; S434-N436 PolarHBondContact O-N 2.95Å; S434-V437 PolarHBondContact O-N 3.47Å; S434-L438 PolarHBondContact O-N 3.27Å
435	P	92.1	Very high	95.4	Very high	106 Å²	106	35.9 Å²	35.9	69%	0.688	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.7	179.7	23.6	-35.4	0	0	0	113.7	P439	P435-P439 WeakPolarHBondContact O-CD 3.4Å; P435-P439 WeakPolarHBondContact O-CG 3.07Å
436	N	91.3	Very high	95.1	Very high	127 Å²	127	37.9 Å²	37.9	68%	0.679	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-18.8	176.4	-64.9	-23	0	0	0	113	K353 S434	K353-N436 PolarHBondContact NZ-O 3.29Å; S434-N436 PolarHBondContact O-N 2.95Å
437	V	95.9	Very high	94.9	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-42.4	-172.9	-179.9	0	0	0	0	111.5	L350 L354 L431 W432 S434 W440 L441	L350-V437 HydrophobicContact CD1-CG1 3.68Å; L350-V437 HydrophobicContact CD1-CG2 4.13Å; L354-V437 HydrophobicContact CD2-CG2 4.27Å; L431-V437 WeakPolarHBondContact O-CB 3.36Å; W432-V437 HydrophobicContact CD2-CG1 4.38Å; W432-V437 HydrophobicContact CE3-CG1 3.59Å; W432-V437 HydrophobicContact CZ3-CG1 4.05Å; S434-V437 PolarHBondContact O-N 3.47Å; V437-W440 HydrophobicContact CG1-CE3 4.15Å; V437-W440 HydrophobicContact CG1-CZ3 4.43Å; V437-W440 WeakPolarHBondContact O-CB 3.41Å; V437-W440 PolarHBondContact O-N 2.76Å; V437-L441 PolarHBondContact O-N 2.78Å
438	L	95.4	Very high	94.7	Very high	28 Å²	28	37.3 Å²	37.3	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-57.7	-49.7	-175.5	-177.2	62.2	0	0	0	112.9	T391 I393 W432 S434 W440 L441 E442	T391-L438 HydrophobicContact CG2-CD1 4.02Å; T391-L438 HydrophobicContact CG2-CD2 3.81Å; I393-L438 HydrophobicContact CG1-CD1 4.29Å; W432-L438 WeakPolarHBondContact O-CA 3.43Å; W432-L438 WeakPolarHBondContact O-CB 3.3Å; W432-L438 PolarHBondContact O-N 3.33Å; S434-L438 PolarHBondContact O-N 3.27Å; L438-W440 PolarHBondContact O-N 3.45Å; L438-L441 WeakPolarHBondContact O-CB 3Å; L438-L441 PolarHBondContact O-N 3.47Å; L438-E442 HydrophobicContact CD1-CG 4.27Å; L438-E442 HydrophobicContact CG-CG 4.38Å; L438-E442 WeakPolarHBondContact O-CG 3.29Å; L438-E442 PolarHBondContact O-N 2.89Å
439	P	94.2	Very high	94.3	Very high	72 Å²	72	38.1 Å²	38.1	47%	0.468	22%	0.221	S	C	.	.	H	α-helix	trans	-61.6	-32.2	179.8	-23.4	35	0	0	0	113.3	P435 E442 K443	P435-P439 WeakPolarHBondContact O-CD 3.4Å; P435-P439 WeakPolarHBondContact O-CG 3.07Å; P439-E442 PolarHBondContact O-N 2.87Å; P439-K443 PolarHBondContact O-N 2.91Å
440	W	95.6	Very high	93.9	Very high	21 Å²	21	40.5 Å²	40.5	8%	0.08	24%	0.239	C	C	.	.	H	α-helix	trans	-71.2	-40.2	175.2	167.5	71.9	0	0	0	112.3	P349 L350 K353 V369 D370 L373 W432 V437 L438 E442 K443 N444	P349-W440 HydrophobicContact CB-CH2 4.48Å; L350-W440 HydrophobicContact CD1-CZ3 3.95Å; K353-W440 HydrophobicContact CB-CH2 4.06Å; K353-W440 HydrophobicContact CB-CZ2 4.1Å; K353-W440 HydrophobicContact CB-CZ3 4.5Å; K353-W440 HydrophobicContact CD-CB 4.21Å; K353-W440 HydrophobicContact CD-CD2 3.09Å; K353-W440 HydrophobicContact CD-CE3 3.4Å; K353-W440 HydrophobicContact CD-CG 3.48Å; K353-W440 VanDerWaalsContact CD-CG 3.48Å; K353-W440 HydrophobicContact CD-CH2 3.87Å; K353-W440 HydrophobicContact CD-CZ2 3.69Å; K353-W440 HydrophobicContact CD-CZ3 3.74Å; K353-W440 VanDerWaalsContact CE-CB 3.49Å; K353-W440 VanDerWaalsContact CE-CD2 3.47Å; V369-W440 HydrophobicContact CG1-CZ2 4.08Å; D370-W440 PolarHBondContact OD1-NE1 3.18Å; L373-W440 HydrophobicContact CB-CH2 4.34Å; L373-W440 HydrophobicContact CB-CZ2 4.18Å; L373-W440 HydrophobicContact CD2-CD2 4.17Å; L373-W440 HydrophobicContact CD2-CE3 4.03Å; L373-W440 HydrophobicContact CD2-CH2 3.51Å; L373-W440 HydrophobicContact CD2-CZ2 3.56Å; L373-W440 HydrophobicContact CD2-CZ3 3.73Å; L373-W440 HydrophobicContact CG-CH2 4.35Å; L373-W440 HydrophobicContact CG-CZ2 4.45Å; W432-W440 HydrophobicContact CH2-CZ3 4.11Å; W432-W440 HydrophobicContact CZ3-CE3 4.27Å; W432-W440 AromaticContact CZ3-CZ3 3.7Å; W432-W440 HydrophobicContact CZ3-CZ3 3.7Å; V437-W440 HydrophobicContact CG1-CE3 4.15Å; V437-W440 HydrophobicContact CG1-CZ3 4.43Å; V437-W440 WeakPolarHBondContact O-CB 3.41Å; V437-W440 PolarHBondContact O-N 2.76Å; L438-W440 PolarHBondContact O-N 3.45Å; W440-E442 VanDerWaalsContact C-N 3.33Å; W440-K443 PolarHBondContact O-N 3.46Å; W440-N444 PolarHBondContact NE1-ND2 3.44Å; W440-N444 PolarHBondContact O-N 3.11Å; W440-N444 VanDerWaalsContact O-N 3.14Å; W440-N444 PolarHBondContact O-ND2 3.03Å
441	L	96.2	Very high	93.4	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-44.4	171.9	175.7	63.9	0	0	0	110.3	L373 L377 F383 L387 W432 V437 L438 K443 N444 I445	L373-L441 HydrophobicContact CD2-CD1 4.2Å; L377-L441 HydrophobicContact CD1-CD1 4.38Å; L377-L441 HydrophobicContact CD2-CD1 4.3Å; F383-L441 HydrophobicContact CE1-CD1 4.42Å; F383-L441 HydrophobicContact CE1-CD2 4.49Å; L387-L441 HydrophobicContact CD2-CD2 3.43Å; L387-L441 VanDerWaalsContact CD2-CD2 3.43Å; W432-L441 HydrophobicContact CE3-CB 4.28Å; W432-L441 HydrophobicContact CE3-CD1 4.26Å; W432-L441 HydrophobicContact CE3-CD2 3.86Å; W432-L441 HydrophobicContact CE3-CG 4.35Å; W432-L441 HydrophobicContact CZ3-CB 4.38Å; W432-L441 HydrophobicContact CZ3-CD1 4.02Å; W432-L441 HydrophobicContact CZ3-CD2 4.45Å; V437-L441 PolarHBondContact O-N 2.78Å; L438-L441 WeakPolarHBondContact O-CB 3Å; L438-L441 PolarHBondContact O-N 3.47Å; L441-K443 PolarHBondContact O-N 3.44Å; L441-N444 PolarHBondContact O-N 3.33Å; L441-I445 HydrophobicContact CD1-CD1 3.97Å; L441-I445 HydrophobicContact CD1-CG1 4.11Å; L441-I445 HydrophobicContact CD2-CD1 4.35Å; L441-I445 HydrophobicContact CG-CD1 3.76Å; L441-I445 HydrophobicContact CG-CG1 4.32Å; L441-I445 VanDerWaalsContact O-CG1 3.31Å; L441-I445 WeakPolarHBondContact O-CG1 3.01Å; L441-I445 PolarHBondContact O-N 3.46Å
442	E	94.8	Very high	92.7	Very high	36 Å²	36	40.4 Å²	40.4	17%	0.168	24%	0.236	C	C	.	.	H	α-helix	trans	-60	-45.6	177.4	-67.9	-175.8	144.3	0	0	112.2	I393 G394 G395 I396 L438 P439 W440 N444 I445 A446	I393-E442 WeakPolarHBondContact CA-OE1 3.28Å; I393-E442 HydrophobicContact CG2-CG 3.85Å; G394-E442 PolarHBondContact N-OE1 3.36Å; G395-E442 PolarHBondContact N-OE1 3.47Å; I396-E442 HydrophobicContact CD1-CB 4.48Å; I396-E442 WeakPolarHBondContact CD1-O 3.39Å; L438-E442 HydrophobicContact CD1-CG 4.27Å; L438-E442 HydrophobicContact CG-CG 4.38Å; L438-E442 WeakPolarHBondContact O-CG 3.29Å; L438-E442 PolarHBondContact O-N 2.89Å; P439-E442 PolarHBondContact O-N 2.87Å; W440-E442 VanDerWaalsContact C-N 3.33Å; E442-N444 VanDerWaalsContact C-N 3.31Å; E442-N444 PolarHBondContact O-N 3.16Å; E442-I445 PolarHBondContact O-N 2.82Å; E442-A446 WeakPolarHBondContact O-CB 3.49Å; E442-A446 PolarHBondContact O-N 2.9Å
443	K	94.1	Very high	91.9	Very high	90 Å²	90	44 Å²	44	39%	0.391	25%	0.252	S	S	.	.	H	α-helix	trans	-52.5	-49.9	172.7	-178.1	-162.2	177.6	-162.1	0	110.9	E360 D370 P439 W440 L441 A446 T447	E360-K443 IonicContact OE1-NZ 2.78Å; E360-K443 PolarHBondContact OE1-NZ 3.18Å; D370-K443 IonicContact OD2-NZ 2.74Å; D370-K443 PolarHBondContact OD2-NZ 3.04Å; P439-K443 PolarHBondContact O-N 2.91Å; W440-K443 PolarHBondContact O-N 3.46Å; L441-K443 PolarHBondContact O-N 3.44Å; K443-A446 PolarHBondContact O-N 3.22Å; K443-T447 PolarHBondContact O-N 2.91Å; K443-T447 PolarHBondContact O-OG1 2.88Å
444	N	95.5	Very high	90.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-70.7	-36.6	-177	-80.5	-75.1	0	0	0	113	D370 L373 Q374 L377 W440 L441 E442 A446 T447 V448	D370-N444 WeakPolarHBondContact CA-OD1 3.26Å; D370-N444 WeakPolarHBondContact CB-OD1 3.49Å; D370-N444 PolarHBondContact O-OD1 2.96Å; D370-N444 PolarHBondContact OD1-ND2 3.26Å; L373-N444 HydrophobicContact CD2-CB 3.75Å; L373-N444 HydrophobicContact CG-CB 4.27Å; Q374-N444 HydrophobicContact CG-CB 4.22Å; Q374-N444 WeakPolarHBondContact CG-OD1 3.27Å; Q374-N444 PolarHBondContact NE2-OD1 3.32Å; L377-N444 HydrophobicContact CD1-CB 4.31Å; W440-N444 PolarHBondContact NE1-ND2 3.44Å; W440-N444 PolarHBondContact O-N 3.11Å; W440-N444 VanDerWaalsContact O-N 3.14Å; W440-N444 PolarHBondContact O-ND2 3.03Å; L441-N444 PolarHBondContact O-N 3.33Å; E442-N444 VanDerWaalsContact C-N 3.31Å; E442-N444 PolarHBondContact O-N 3.16Å; N444-A446 VanDerWaalsContact C-N 3.33Å; N444-T447 PolarHBondContact O-N 3.46Å; N444-V448 WeakPolarHBondContact O-CG2 3.4Å; N444-V448 PolarHBondContact O-N 3.47Å
445	I	94.4	Very high	89.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-43.2	172.7	-65.8	167.5	0	0	0	110	L377 V384 I393 I396 L399 F405 L441 E442 T447 V448 L449	L377-I445 HydrophobicContact CD1-CG1 3.95Å; V384-I445 HydrophobicContact CG1-CD1 4.08Å; V384-I445 HydrophobicContact CG2-CD1 4.09Å; V384-I445 HydrophobicContact CG2-CG1 4.35Å; I393-I445 HydrophobicContact CD1-CD1 3.84Å; I396-I445 HydrophobicContact CD1-CB 3.49Å; I396-I445 VanDerWaalsContact CD1-CB 3.49Å; I396-I445 HydrophobicContact CD1-CD1 4.5Å; I396-I445 HydrophobicContact CD1-CG2 3.33Å; L399-I445 HydrophobicContact CD1-CG2 4.09Å; F405-I445 HydrophobicContact CD2-CG2 4.1Å; F405-I445 HydrophobicContact CE2-CG2 3.82Å; F405-I445 HydrophobicContact CZ-CG2 4.46Å; L441-I445 HydrophobicContact CD1-CD1 3.97Å; L441-I445 HydrophobicContact CD1-CG1 4.11Å; L441-I445 HydrophobicContact CD2-CD1 4.35Å; L441-I445 HydrophobicContact CG-CD1 3.76Å; L441-I445 HydrophobicContact CG-CG1 4.32Å; L441-I445 VanDerWaalsContact O-CG1 3.31Å; L441-I445 WeakPolarHBondContact O-CG1 3.01Å; L441-I445 PolarHBondContact O-N 3.46Å; E442-I445 PolarHBondContact O-N 2.82Å; I445-T447 VanDerWaalsContact C-N 3.34Å; I445-T447 PolarHBondContact O-N 3.1Å; I445-V448 PolarHBondContact O-N 3.25Å; I445-L449 HydrophobicContact CG2-CD1 4.22Å; I445-L449 HydrophobicContact CG2-CG 4.44Å; I445-L449 WeakPolarHBondContact O-CG 3.41Å; I445-L449 PolarHBondContact O-N 2.95Å
446	A	92.6	Very high	87.5	Confident	42 Å²	42	55.1 Å²	55.1	35%	0.347	29%	0.291	S	S	.	.	H	α-helix	trans	-60.8	-42.2	176.1	0	0	0	0	0	112	E442 K443 N444 L449 T450	E442-A446 WeakPolarHBondContact O-CB 3.49Å; E442-A446 PolarHBondContact O-N 2.9Å; K443-A446 PolarHBondContact O-N 3.22Å; N444-A446 VanDerWaalsContact C-N 3.33Å; A446-L449 PolarHBondContact O-N 3.49Å; A446-T450 WeakPolarHBondContact O-CG2 3.45Å; A446-T450 PolarHBondContact O-N 3.08Å; A446-T450 VanDerWaalsContact O-N 3.11Å
447	T	92.2	Very high	85.6	Confident	45 Å²	45	54.9 Å²	54.9	28%	0.276	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-42.4	173.1	-57.2	0	0	0	0	112.2	K443 N444 I445 L449 T450 L451	K443-T447 PolarHBondContact O-N 2.91Å; K443-T447 PolarHBondContact O-OG1 2.88Å; N444-T447 PolarHBondContact O-N 3.46Å; I445-T447 VanDerWaalsContact C-N 3.34Å; I445-T447 PolarHBondContact O-N 3.1Å; T447-L449 VanDerWaalsContact C-N 3.32Å; T447-L449 PolarHBondContact O-N 2.67Å; T447-T450 PolarHBondContact O-N 3.3Å; T447-T450 PolarHBondContact O-OG1 3Å; T447-L451 HydrophobicContact CG2-CD1 4.15Å; T447-L451 VanDerWaalsContact O-CG 3.27Å; T447-L451 WeakPolarHBondContact O-CG 3.12Å; T447-L451 PolarHBondContact O-N 3.37Å; T447-L451 VanDerWaalsContact O-N 3.14Å
448	V	92.2	Very high	83.3	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62	-42.5	176	172.6	0	0	0	0	110.9	Q374 L377 I378 L404 F405 N444 I445 T450 L451 V452	Q374-V448 HydrophobicContact CB-CG2 3.71Å; Q374-V448 HydrophobicContact CG-CG2 3.86Å; L377-V448 HydrophobicContact CB-CG2 4.15Å; L377-V448 HydrophobicContact CD1-CG2 4.19Å; I378-V448 HydrophobicContact CD1-CG1 4.38Å; I378-V448 HydrophobicContact CG1-CG1 3.7Å; I378-V448 HydrophobicContact CG1-CG2 4.31Å; L404-V448 HydrophobicContact CD2-CG1 3.7Å; F405-V448 HydrophobicContact CE2-CB 4.34Å; F405-V448 HydrophobicContact CE2-CG1 3.94Å; F405-V448 HydrophobicContact CZ-CB 4.27Å; F405-V448 HydrophobicContact CZ-CG1 3.74Å; N444-V448 WeakPolarHBondContact O-CG2 3.4Å; N444-V448 PolarHBondContact O-N 3.47Å; I445-V448 PolarHBondContact O-N 3.25Å; V448-T450 VanDerWaalsContact C-N 3.33Å; V448-T450 PolarHBondContact O-N 3.22Å; V448-L451 WeakPolarHBondContact O-CB 3.4Å; V448-L451 PolarHBondContact O-N 2.85Å; V448-L451 VanDerWaalsContact O-N 3.13Å; V448-V452 HydrophobicContact CG1-CG1 4.01Å; V448-V452 HydrophobicContact CG1-CG2 4.21Å; V448-V452 WeakPolarHBondContact O-CG1 3.46Å; V448-V452 WeakPolarHBondContact O-CG2 3.3Å; V448-V452 PolarHBondContact O-N 3.28Å
449	L	89.9	Confident	81	Confident	18 Å²	18	69.1 Å²	69.1	9%	0.094	36%	0.363	C	S	.	.	H	α-helix	trans	-58.1	-43.2	177.1	-72.5	171.8	0	0	0	112	I396 L399 S402 F405 I445 A446 T447 L451 V452 E453	I396-L449 HydrophobicContact CG2-CD1 3.49Å; I396-L449 VanDerWaalsContact CG2-CD1 3.49Å; L399-L449 HydrophobicContact CD1-CD1 4.33Å; S402-L449 WeakPolarHBondContact OG-CD2 3.48Å; F405-L449 HydrophobicContact CD2-CD2 3.74Å; F405-L449 HydrophobicContact CD2-CG 4.22Å; F405-L449 HydrophobicContact CE2-CD2 4.05Å; F405-L449 HydrophobicContact CE2-CG 4.17Å; I445-L449 HydrophobicContact CG2-CD1 4.22Å; I445-L449 HydrophobicContact CG2-CG 4.44Å; I445-L449 WeakPolarHBondContact O-CG 3.41Å; I445-L449 PolarHBondContact O-N 2.95Å; A446-L449 PolarHBondContact O-N 3.49Å; T447-L449 VanDerWaalsContact C-N 3.32Å; T447-L449 PolarHBondContact O-N 2.67Å; L449-L451 VanDerWaalsContact C-N 3.28Å; L449-L451 PolarHBondContact O-N 3.45Å; L449-V452 PolarHBondContact O-N 3.21Å; L449-E453 HydrophobicContact CD2-CG 4.1Å; L449-E453 VanDerWaalsContact CD2-OE1 3.31Å; L449-E453 WeakPolarHBondContact CD2-OE1 3.4Å; L449-E453 VanDerWaalsContact O-CB 3.26Å; L449-E453 WeakPolarHBondContact O-CB 3.31Å; L449-E453 WeakPolarHBondContact O-CG 3.49Å; L449-E453 PolarHBondContact O-N 3.47Å
450	T	88.7	Confident	78.8	Confident	102 Å²	102	70.9 Å²	70.9	63%	0.626	38%	0.377	S	S	*	.	H	α-helix	trans	-68.6	-26.3	177.8	60.4	0	0	0	0	113.5	A446 T447 V448	A446-T450 WeakPolarHBondContact O-CG2 3.45Å; A446-T450 PolarHBondContact O-N 3.08Å; A446-T450 VanDerWaalsContact O-N 3.11Å; T447-T450 PolarHBondContact O-N 3.3Å; T447-T450 PolarHBondContact O-OG1 3Å; V448-T450 VanDerWaalsContact C-N 3.33Å; V448-T450 PolarHBondContact O-N 3.22Å
451	L	85.6	Confident	76.8	Confident	75 Å²	75	78.9 Å²	78.9	39%	0.393	42%	0.415	S	S	.	.	H	α-helix	trans	-78.6	-38.2	176.6	-68.6	170.7	0	0	0	112.8	T447 V448 L449	T447-L451 HydrophobicContact CG2-CD1 4.15Å; T447-L451 VanDerWaalsContact O-CG 3.27Å; T447-L451 WeakPolarHBondContact O-CG 3.12Å; T447-L451 PolarHBondContact O-N 3.37Å; T447-L451 VanDerWaalsContact O-N 3.14Å; V448-L451 WeakPolarHBondContact O-CB 3.4Å; V448-L451 PolarHBondContact O-N 2.85Å; V448-L451 VanDerWaalsContact O-N 3.13Å; L449-L451 VanDerWaalsContact C-N 3.28Å; L449-L451 PolarHBondContact O-N 3.45Å
452	V	81.2	Confident	74.7	Confident	16 Å²	16	83.2 Å²	83.2	10%	0.097	45%	0.446	C	S	.	.	H	α-helix	trans	-104.8	-26.1	-166.9	-56.4	0	0	0	0	114.3	I378 L404 V448 L449 L469	I378-V452 HydrophobicContact CD1-CG1 4.31Å; I378-V452 HydrophobicContact CG1-CG1 4.25Å; L404-V452 HydrophobicContact CB-CG2 4.2Å; L404-V452 HydrophobicContact CD2-CB 4.47Å; L404-V452 HydrophobicContact CD2-CG1 4.24Å; L404-V452 HydrophobicContact CD2-CG2 3.92Å; V448-V452 HydrophobicContact CG1-CG1 4.01Å; V448-V452 HydrophobicContact CG1-CG2 4.21Å; V448-V452 WeakPolarHBondContact O-CG1 3.46Å; V448-V452 WeakPolarHBondContact O-CG2 3.3Å; V448-V452 PolarHBondContact O-N 3.28Å; L449-V452 PolarHBondContact O-N 3.21Å; V452-L469 HydrophobicContact CB-CD1 3.88Å; V452-L469 HydrophobicContact CB-CD2 4.01Å; V452-L469 HydrophobicContact CB-CG 4.37Å; V452-L469 HydrophobicContact CG1-CD1 4.19Å; V452-L469 HydrophobicContact CG1-CD2 3.84Å; V452-L469 HydrophobicContact CG1-CG 4.21Å
453	E	78.8	Confident	72.9	Confident	76 Å²	76	86.6 Å²	86.6	36%	0.355	47%	0.465	S	S	.	.	S	Bend	trans	-76.7	140	-179.1	-68.5	-165.6	159.1	0	0	111.4	S402 L449 K455	S402-E453 VanDerWaalsContact CA-OE1 3.29Å; S402-E453 WeakPolarHBondContact CA-OE1 3.49Å; S402-E453 VanDerWaalsContact CB-OE1 3.25Å; S402-E453 WeakPolarHBondContact CB-OE1 3.31Å; S402-E453 PolarHBondContact OG-OE1 3.12Å; L449-E453 HydrophobicContact CD2-CG 4.1Å; L449-E453 VanDerWaalsContact CD2-OE1 3.31Å; L449-E453 WeakPolarHBondContact CD2-OE1 3.4Å; L449-E453 VanDerWaalsContact O-CB 3.26Å; L449-E453 WeakPolarHBondContact O-CB 3.31Å; L449-E453 WeakPolarHBondContact O-CG 3.49Å; L449-E453 PolarHBondContact O-N 3.47Å; E453-K455 PolarHBondContact O-N 3.03Å; E453-K455 VanDerWaalsContact O-N 3.16Å
454	P	69.2	Low	71.7	Confident	67 Å²	67	87.7 Å²	87.7	44%	0.435	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-62.5	120.7	176.3	25.1	-32.2	0	0	0	109.7	I403 Q456	I403-P454 HydrophobicContact CD1-CG 4.16Å; P454-Q456 PolarHBondContact O-N 3.31Å
455	K	66.3	Low	70.8	Confident	163 Å²	163	93.5 Å²	93.5	71%	0.709	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-60.8	125.2	172.6	-66.9	-179.7	-178.3	175.2	0	108.4	E453 V457	E453-K455 PolarHBondContact O-N 3.03Å; E453-K455 VanDerWaalsContact O-N 3.16Å; K455-V457 PolarHBondContact O-N 3.01Å
456	Q	54.5	Low	70.2	Confident	178 Å²	178	94.6 Å²	94.6	83%	0.832	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-56.7	129.4	175	-70.1	-69.6	-37.8	0	0	108.9	P454 H458	P454-Q456 PolarHBondContact O-N 3.31Å; Q456-H458 PolarHBondContact O-N 3.39Å
457	V	50.9	Low	70	Confident	122 Å²	122	97.3 Å²	97.3	74%	0.739	53%	0.529	S	S	*	.			trans	-62.3	93.3	-172.9	179.9	0	0	0	0	110.5	K455	K455-V457 PolarHBondContact O-N 3.01Å
458	H	47.2	Very low	69.9	Low	177 Å²	177	97.9 Å²	97.9	82%	0.819	53%	0.526	S	S	*	.			trans	-114.7	101.4	141.6	-78.6	-71.5	0	0	0	107	Q456	Q456-H458 PolarHBondContact O-N 3.39Å
459	L	46	Very low	69.6	Low	151 Å²	151	99.7 Å²	99.7	79%	0.791	54%	0.535	S	S	*	.	S	Bend	trans	15.2	131.4	159.5	-63	130.1	0	0	0	118.2
460	S	49.9	Very low	69.5	Low	110 Å²	110	102.1 Å²	102.1	77%	0.769	55%	0.554	S	S	*	*	S	Bend	trans	74.9	85	167.7	76.3	0	0	0	0	117
461	E	53.1	Low	69.6	Low	188 Å²	188	101.7 Å²	101.7	88%	0.879	55%	0.545	S	S	*	.	S	Bend		158.8	103.6	124.3	-86.2	170.7	-170.7	0	0	108.7
462	S	52.1	Low	69.9	Low	91 Å²	91	99.1 Å²	99.1	64%	0.636	53%	0.53	S	S	*	.			trans	39.3	93.9	162.1	-168.9	0	0	0	0	116.6	T464	S462-T464 PolarHBondContact O-N 3.04Å; S462-T464 PolarHBondContact O-OG1 2.97Å; S462-T464 WeakPolarHBondContact OG-CG2 3.34Å
463	N	57.3	Low	70.3	Confident	108 Å²	108	100.1 Å²	100.1	58%	0.578	54%	0.538	S	S	*	.			trans	-71	58.8	167.6	-159	20.1	0	0	0	110.5	I465	N463-I465 PolarHBondContact O-N 2.9Å
464	T	68.2	Low	70.9	Confident	112 Å²	112	103.3 Å²	103.3	69%	0.687	55%	0.55	S	S	*	*			trans	-71.6	98.4	176.2	40.1	0	0	0	0	108.6	S462 D466	S462-T464 PolarHBondContact O-N 3.04Å; S462-T464 PolarHBondContact O-OG1 2.97Å; S462-T464 WeakPolarHBondContact OG-CG2 3.34Å; T464-D466 PolarHBondContact O-N 3.32Å
465	I	76.1	Confident	72	Confident	123 Å²	123	103.1 Å²	103.1	63%	0.631	54%	0.541	S	S	*	.			trans	-59.7	132.6	168.5	-60.9	171.2	0	0	0	107.9	N463 L469	N463-I465 PolarHBondContact O-N 2.9Å; I465-L469 HydrophobicContact CG2-CD1 3.8Å
466	D	82.7	Confident	73.2	Confident	23 Å²	23	96.3 Å²	96.3	12%	0.123	51%	0.511	C	S	.	.			trans	-55.5	122.3	176.2	-171.9	-40.3	0	0	0	110.1	T464 R468 L469	T464-D466 PolarHBondContact O-N 3.32Å; D466-R468 PolarHBondContact O-N 3.35Å; D466-R468 VanDerWaalsContact O-N 3.14Å; D466-R468 WeakPolarHBondContact OD1-CB 3.49Å; D466-R468 VanDerWaalsContact OD1-CG 3.3Å; D466-R468 WeakPolarHBondContact OD1-CG 3.48Å; D466-R468 PolarHBondContact OD1-N 3.25Å; D466-R468 IonicContact OD1-NE 3.06Å; D466-R468 PolarHBondContact OD1-NE 2.97Å; D466-R468 VanDerWaalsContact OD1-NE 3.16Å; D466-R468 IonicContact OD2-CZ 2.73Å; D466-R468 IonicContact OD2-NE 2.73Å; D466-R468 PolarHBondContact OD2-NE 3.34Å; D466-R468 IonicContact OD2-NH2 3.32Å; D466-R468 PolarHBondContact OD2-NH2 3.49Å; D466-L469 HydrophobicContact CB-CD1 4.48Å; D466-L469 PolarHBondContact O-N 2.52Å
467	P	87.4	Confident	74.9	Confident	99 Å²	99	94.4 Å²	94.4	64%	0.643	50%	0.5	S	S	*	.	H	α-helix	trans	-60.4	-26.1	-176.4	24.5	-34.8	0	0	0	113.1	L469 S470 E471	P467-L469 PolarHBondContact O-N 2.98Å; P467-S470 PolarHBondContact O-N 2.72Å; P467-E471 PolarHBondContact O-N 3.21Å; P467-E471 VanDerWaalsContact O-N 3.15Å
468	R	89.8	Confident	76.9	Confident	56 Å²	56	91.4 Å²	91.4	21%	0.211	49%	0.485	C	S	.	.	H	α-helix	trans	-60.1	-30.3	179.6	-66.3	-180	-71.8	-178.4	-4.3	112.4	D375 I378 D466 S470 E471 Y472	D375-R468 WeakPolarHBondContact OD1-CD 3.46Å; D375-R468 IonicContact OD1-NH1 3.16Å; D375-R468 PolarHBondContact OD1-NH1 2.81Å; D375-R468 VanDerWaalsContact OD1-NH1 3.16Å; I378-R468 HydrophobicContact CG2-CB 4.09Å; D466-R468 PolarHBondContact O-N 3.35Å; D466-R468 VanDerWaalsContact O-N 3.14Å; D466-R468 WeakPolarHBondContact OD1-CB 3.49Å; D466-R468 VanDerWaalsContact OD1-CG 3.3Å; D466-R468 WeakPolarHBondContact OD1-CG 3.48Å; D466-R468 PolarHBondContact OD1-N 3.25Å; D466-R468 IonicContact OD1-NE 3.06Å; D466-R468 PolarHBondContact OD1-NE 2.97Å; D466-R468 VanDerWaalsContact OD1-NE 3.16Å; D466-R468 IonicContact OD2-CZ 2.73Å; D466-R468 IonicContact OD2-NE 2.73Å; D466-R468 PolarHBondContact OD2-NE 3.34Å; D466-R468 IonicContact OD2-NH2 3.32Å; D466-R468 PolarHBondContact OD2-NH2 3.49Å; R468-S470 PolarHBondContact O-N 2.75Å; R468-E471 PolarHBondContact O-N 3.24Å; R468-Y472 HydrophobicContact CB-CD2 4.13Å; R468-Y472 HydrophobicContact CB-CE2 4.01Å; R468-Y472 HydrophobicContact CG-CE2 4.31Å; R468-Y472 WeakPolarHBondContact O-CB 3.4Å; R468-Y472 VanDerWaalsContact O-CG 3.28Å; R468-Y472 PolarHBondContact O-N 3.05Å
469	L	86.3	Confident	79	Confident	38 Å²	38	84.3 Å²	84.3	20%	0.199	45%	0.452	C	S	.	.	H	α-helix	trans	-61.1	-46.2	179.1	-68	171.3	0	0	0	112.1	I378 L404 V452 I465 D466 P467 S473	I378-L469 HydrophobicContact CG2-CD2 4.05Å; L404-L469 HydrophobicContact CD1-CD2 3.9Å; L404-L469 HydrophobicContact CD2-CD2 4.33Å; V452-L469 HydrophobicContact CB-CD1 3.88Å; V452-L469 HydrophobicContact CB-CD2 4.01Å; V452-L469 HydrophobicContact CB-CG 4.37Å; V452-L469 HydrophobicContact CG1-CD1 4.19Å; V452-L469 HydrophobicContact CG1-CD2 3.84Å; V452-L469 HydrophobicContact CG1-CG 4.21Å; I465-L469 HydrophobicContact CG2-CD1 3.8Å; D466-L469 HydrophobicContact CB-CD1 4.48Å; D466-L469 PolarHBondContact O-N 2.52Å; P467-L469 PolarHBondContact O-N 2.98Å; L469-S473 WeakPolarHBondContact O-CB 3.46Å; L469-S473 PolarHBondContact O-N 3.32Å
470	S	87.7	Confident	81.3	Confident	69 Å²	69	77.1 Å²	77.1	48%	0.483	42%	0.415	S	S	.	.	H	α-helix	trans	-72	-43.3	178.7	-174.5	0	0	0	0	111	P467 R468 K474	P467-S470 PolarHBondContact O-N 2.72Å; R468-S470 PolarHBondContact O-N 2.75Å; S470-K474 WeakPolarHBondContact O-CG 3.19Å; S470-K474 PolarHBondContact O-N 3.49Å; S470-K474 VanDerWaalsContact O-N 3.13Å
471	E	91.4	Very high	83.2	Confident	94 Å²	94	75.6 Å²	75.6	44%	0.439	40%	0.402	S	S	.	.	H	α-helix	trans	-63.6	-51.9	179.8	-170.2	-172.2	158.3	0	0	111.9	P467 R468 S473 K474 R475	P467-E471 PolarHBondContact O-N 3.21Å; P467-E471 VanDerWaalsContact O-N 3.15Å; R468-E471 PolarHBondContact O-N 3.24Å; E471-S473 VanDerWaalsContact C-N 3.33Å; E471-S473 PolarHBondContact O-N 3.22Å; E471-K474 WeakPolarHBondContact O-CB 3.46Å; E471-K474 PolarHBondContact O-N 3.2Å; E471-R475 WeakPolarHBondContact O-CB 3.45Å; E471-R475 PolarHBondContact O-N 3.04Å; E471-R475 IonicContact OE1-CZ 3.66Å; E471-R475 IonicContact OE1-NH2 3.61Å; E471-R475 PolarHBondContact OE1-NH2 3.13Å
472	Y	92.4	Very high	84.9	Confident	21 Å²	21	68.1 Å²	68.1	8%	0.082	37%	0.373	C	S	.	.	H	α-helix	trans	-69.4	-32.7	-176.8	-66.5	-5.7	0	0	0	111.7	D375 I378 M379 R468 R475 R476	D375-Y472 VanDerWaalsContact CG-OH 3.26Å; D375-Y472 PolarHBondContact OD1-OH 2.98Å; D375-Y472 PolarHBondContact OD2-OH 3.46Å; I378-Y472 HydrophobicContact CB-CD2 4.24Å; I378-Y472 HydrophobicContact CB-CE2 4.39Å; I378-Y472 HydrophobicContact CG2-CD2 3.79Å; I378-Y472 HydrophobicContact CG2-CE2 4.24Å; M379-Y472 VanDerWaalsContact CA-CD2 3.47Å; M379-Y472 HydrophobicContact CB-CD2 3.74Å; M379-Y472 HydrophobicContact CB-CE2 3.93Å; M379-Y472 HydrophobicContact CB-CG 4.4Å; M379-Y472 HydrophobicContact CG-CD2 4.42Å; M379-Y472 HydrophobicContact SD-CD1 3.9Å; M379-Y472 HydrophobicContact SD-CD2 3.95Å; M379-Y472 HydrophobicContact SD-CE1 4.48Å; M379-Y472 HydrophobicContact SD-CG 3.59Å; M379-Y472 VanDerWaalsContact SD-CG 3.59Å; R468-Y472 HydrophobicContact CB-CD2 4.13Å; R468-Y472 HydrophobicContact CB-CE2 4.01Å; R468-Y472 HydrophobicContact CG-CE2 4.31Å; R468-Y472 WeakPolarHBondContact O-CB 3.4Å; R468-Y472 VanDerWaalsContact O-CG 3.28Å; R468-Y472 PolarHBondContact O-N 3.05Å; Y472-R475 PolarHBondContact O-N 3.45Å; Y472-R476 WeakPolarHBondContact O-CB 3.11Å; Y472-R476 WeakPolarHBondContact O-CG 3.25Å; Y472-R476 PolarHBondContact O-N 2.83Å
473	S	90	Very high	86.7	Confident	36 Å²	36	64.2 Å²	64.2	25%	0.252	34%	0.344	S	S	.	.	H	α-helix	trans	-60.5	-45.4	170.4	-177.2	0	0	0	0	112.2	L469 E471 K477	L469-S473 WeakPolarHBondContact O-CB 3.46Å; L469-S473 PolarHBondContact O-N 3.32Å; E471-S473 VanDerWaalsContact C-N 3.33Å; E471-S473 PolarHBondContact O-N 3.22Å; S473-K477 WeakPolarHBondContact O-CG 3.34Å; S473-K477 PolarHBondContact O-N 3.41Å
474	K	91.1	Very high	88.4	Confident	143 Å²	143	59 Å²	59	62%	0.622	32%	0.317	S	S	*	.	H	α-helix	trans	-64	-43.4	173.9	-70.1	171.7	-174.9	175.9	0	111.4	S470 E471 K477 S478	S470-K474 WeakPolarHBondContact O-CG 3.19Å; S470-K474 PolarHBondContact O-N 3.49Å; S470-K474 VanDerWaalsContact O-N 3.13Å; E471-K474 WeakPolarHBondContact O-CB 3.46Å; E471-K474 PolarHBondContact O-N 3.2Å; K474-K477 PolarHBondContact O-N 3.09Å; K474-S478 PolarHBondContact O-N 2.91Å
475	R	91.9	Very high	89.5	Confident	63 Å²	63	56 Å²	56	24%	0.238	30%	0.299	C	S	.	.	H	α-helix	trans	-60.9	-47	-179.9	-170.4	176.3	-74.4	177	-3.5	111.5	M379 E471 Y472 K477 S478 L479	M379-R475 HydrophobicContact CE-CB 4.43Å; M379-R475 HydrophobicContact CE-CG 3.94Å; E471-R475 WeakPolarHBondContact O-CB 3.45Å; E471-R475 PolarHBondContact O-N 3.04Å; E471-R475 IonicContact OE1-CZ 3.66Å; E471-R475 IonicContact OE1-NH2 3.61Å; E471-R475 PolarHBondContact OE1-NH2 3.13Å; Y472-R475 PolarHBondContact O-N 3.45Å; R475-K477 VanDerWaalsContact C-N 3.35Å; R475-K477 PolarHBondContact O-N 3.33Å; R475-S478 PolarHBondContact O-N 2.72Å; R475-L479 HydrophobicContact CG-CD1 3.38Å; R475-L479 HydrophobicContact CG-CG 3.96Å; R475-L479 WeakPolarHBondContact O-CB 3.31Å; R475-L479 WeakPolarHBondContact O-CG 3.45Å; R475-L479 PolarHBondContact O-N 2.98Å
476	R	92.2	Very high	90.4	Very high	20 Å²	20	51.2 Å²	51.2	8%	0.075	27%	0.273	C	S	.	.	H	α-helix	trans	-56.7	-46.2	175.2	-73.5	-168.8	-64.5	-89.2	4.8	112.3	I378 M379 L417 Y472 S478 Y480	I378-R476 PolarHBondContact O-NH1 3.39Å; M379-R476 HydrophobicContact CE-CG 4.38Å; M379-R476 WeakPolarHBondContact O-CD 3.37Å; M379-R476 PolarHBondContact O-NH1 2.85Å; L417-R476 HydrophobicContact CD2-CB 4.11Å; L417-R476 VanDerWaalsContact CD2-CD 3.42Å; L417-R476 HydrophobicContact CD2-CG 3.69Å; Y472-R476 WeakPolarHBondContact O-CB 3.11Å; Y472-R476 WeakPolarHBondContact O-CG 3.25Å; Y472-R476 PolarHBondContact O-N 2.83Å; R476-S478 VanDerWaalsContact C-N 3.31Å; R476-S478 PolarHBondContact O-N 2.82Å; R476-Y480 HydrophobicContact CB-CD2 4.28Å; R476-Y480 HydrophobicContact CB-CE2 4.41Å; R476-Y480 HydrophobicContact CG-CD2 4.5Å; R476-Y480 HydrophobicContact CG-CE2 4.22Å; R476-Y480 VanDerWaalsContact O-CD2 3.25Å; R476-Y480 WeakPolarHBondContact O-CD2 3.24Å; R476-Y480 PolarHBondContact O-N 3.16Å
477	K	89.7	Confident	91	Very high	138 Å²	138	50.3 Å²	50.3	60%	0.6	27%	0.268	S	S	*	.	H	α-helix	trans	-64.2	-34.7	178.8	-69.4	176.9	-176.3	179.2	0	113.1	S473 K474 R475	S473-K477 WeakPolarHBondContact O-CG 3.34Å; S473-K477 PolarHBondContact O-N 3.41Å; K474-K477 PolarHBondContact O-N 3.09Å; R475-K477 VanDerWaalsContact C-N 3.35Å; R475-K477 PolarHBondContact O-N 3.33Å
478	S	92.1	Very high	91.4	Very high	60 Å²	60	45.7 Å²	45.7	42%	0.42	24%	0.239	S	C	.	.	H	α-helix	trans	-79.6	-40.5	-180	-172.2	0	0	0	0	113.3	Q85 K474 R475 R476	Q85-S478 PolarHBondContact OE1-OG 3.07Å; Q85-S478 VanDerWaalsContact OE1-OG 3.08Å; K474-S478 PolarHBondContact O-N 2.91Å; R475-S478 PolarHBondContact O-N 2.72Å; R476-S478 VanDerWaalsContact C-N 3.31Å; R476-S478 PolarHBondContact O-N 2.82Å
479	L	92.1	Very high	91.7	Very high	27 Å²	27	43.8 Å²	43.8	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-86.7	-28.4	-168.7	-67.9	-177.5	0	0	0	114.4	Q85 L86 L340 R475 P481	Q85-L479 HydrophobicContact CB-CD2 4.19Å; L86-L479 WeakPolarHBondContact CD1-O 3.3Å; L340-L479 HydrophobicContact CD1-CD1 3.83Å; L340-L479 HydrophobicContact CD2-CD1 3.78Å; L340-L479 HydrophobicContact CG-CD1 4.26Å; R475-L479 HydrophobicContact CG-CD1 3.38Å; R475-L479 HydrophobicContact CG-CG 3.96Å; R475-L479 WeakPolarHBondContact O-CB 3.31Å; R475-L479 WeakPolarHBondContact O-CG 3.45Å; R475-L479 PolarHBondContact O-N 2.98Å; L479-P481 VanDerWaalsContact O-CD 3.25Å; L479-P481 WeakPolarHBondContact O-CD 3.35Å
480	Y	93.1	Very high	92.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.			trans	-116.5	47.9	-174.5	-43.9	-80.8	0	0	0	113.8	L86 L340 M379 S414 S416 L417 L420 R476 A482	L86-Y480 HydrophobicContact CD1-CD1 4.24Å; L340-Y480 PolarHBondContact O-OH 3.01Å; M379-Y480 HydrophobicContact CE-CE2 4.29Å; S414-Y480 WeakPolarHBondContact CB-O 3.43Å; S414-Y480 WeakPolarHBondContact OG-CB 3.3Å; S414-Y480 PolarHBondContact OG-O 3.11Å; S416-Y480 VanDerWaalsContact OG-C 3.26Å; S416-Y480 WeakPolarHBondContact OG-CB 3.29Å; S416-Y480 PolarHBondContact OG-O 3.36Å; L417-Y480 HydrophobicContact CB-CD1 4.36Å; L417-Y480 HydrophobicContact CB-CD2 4.01Å; L417-Y480 HydrophobicContact CB-CG 3.79Å; L417-Y480 HydrophobicContact CD1-CD1 4.12Å; L417-Y480 HydrophobicContact CD1-CD2 4.07Å; L417-Y480 HydrophobicContact CD1-CE1 4.08Å; L417-Y480 HydrophobicContact CD1-CE2 4.06Å; L417-Y480 HydrophobicContact CD1-CG 4.14Å; L417-Y480 HydrophobicContact CD2-CD2 3.74Å; L417-Y480 HydrophobicContact CD2-CE2 3.99Å; L417-Y480 HydrophobicContact CD2-CG 4.37Å; L417-Y480 HydrophobicContact CG-CD2 4.16Å; L417-Y480 HydrophobicContact CG-CG 4.32Å; L420-Y480 HydrophobicContact CD1-CD1 4.41Å; R476-Y480 HydrophobicContact CB-CD2 4.28Å; R476-Y480 HydrophobicContact CB-CE2 4.41Å; R476-Y480 HydrophobicContact CG-CD2 4.5Å; R476-Y480 HydrophobicContact CG-CE2 4.22Å; R476-Y480 VanDerWaalsContact O-CD2 3.25Å; R476-Y480 WeakPolarHBondContact O-CD2 3.24Å; R476-Y480 PolarHBondContact O-N 3.16Å; Y480-A482 VanDerWaalsContact C-N 3.34Å; Y480-A482 PolarHBondContact O-N 3.28Å
481	P	89.8	Confident	92.6	Very high	78 Å²	78	38.7 Å²	38.7	51%	0.506	20%	0.199	S	C	.	.	S	Bend	trans	-68.4	-35.3	179.3	29	-34.3	0	0	0	112.3	L479	L479-P481 VanDerWaalsContact O-CD 3.25Å; L479-P481 WeakPolarHBondContact O-CD 3.35Å
482	A	89.5	Confident	92.7	Very high	32 Å²	32	35.4 Å²	35.4	26%	0.264	18%	0.184	S	C	.	.	S	Bend	trans	-164.8	165.8	-178.8	0	0	0	0	0	110.3	Y84 Y480	Y84-A482 HydrophobicContact CE1-CB 3.87Å; Y480-A482 VanDerWaalsContact C-N 3.34Å; Y480-A482 PolarHBondContact O-N 3.28Å
483	F	90.2	Very high	92.9	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.035	18%	0.18	C	C	.	.			trans	-76.1	131.5	178.4	-65.9	-56	0	0	0	113.2	Y84 S416 C419 L420 I487 L488 L491 I502	Y84-F483 VanDerWaalsContact CE1-O 3.28Å; Y84-F483 WeakPolarHBondContact CE1-O 3.32Å; S416-F483 VanDerWaalsContact CA-CZ 3.47Å; S416-F483 VanDerWaalsContact O-CE1 3.25Å; S416-F483 WeakPolarHBondContact O-CE1 3.33Å; S416-F483 VanDerWaalsContact O-CZ 3.27Å; S416-F483 WeakPolarHBondContact O-CZ 3.44Å; C419-F483 HydrophobicContact CB-CE2 4.31Å; C419-F483 HydrophobicContact CB-CZ 3.73Å; L420-F483 HydrophobicContact CD2-CE1 4.16Å; L420-F483 HydrophobicContact CG-CE1 3.99Å; F483-I487 HydrophobicContact CB-CB 4.48Å; F483-I487 HydrophobicContact CD1-CB 4.21Å; F483-I487 HydrophobicContact CD1-CG2 3.51Å; F483-I487 HydrophobicContact CE1-CG2 3.91Å; F483-I487 HydrophobicContact CG-CG2 4.23Å; F483-L488 HydrophobicContact CB-CD1 4.38Å; F483-L488 HydrophobicContact CB-CD2 3.65Å; F483-L488 HydrophobicContact CB-CG 3.62Å; F483-L488 HydrophobicContact CD2-CD2 3.65Å; F483-L488 HydrophobicContact CG-CD2 3.99Å; F483-L488 HydrophobicContact CG-CG 4.44Å; F483-L491 HydrophobicContact CD1-CD1 4.31Å; F483-L491 HydrophobicContact CD2-CD1 3.94Å; F483-L491 HydrophobicContact CE1-CD1 3.98Å; F483-L491 HydrophobicContact CE2-CD1 3.56Å; F483-L491 HydrophobicContact CG-CD1 4.28Å; F483-L491 HydrophobicContact CZ-CD1 3.56Å; F483-I502 HydrophobicContact CD2-CB 4.28Å; F483-I502 HydrophobicContact CE2-CB 3.98Å; F483-I502 HydrophobicContact CE2-CD1 4.25Å; F483-I502 HydrophobicContact CE2-CG1 4.1Å
484	P	91.9	Very high	93.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.			trans	-58.3	152.7	158.3	-24.3	35	0	0	0	111.9	Y84 L86 D87 K486 I487 L488	Y84-P484 HydrophobicContact CD1-CG 4.42Å; Y84-P484 HydrophobicContact CG-CG 4.41Å; L86-P484 HydrophobicContact CB-CG 3.48Å; L86-P484 VanDerWaalsContact CB-CG 3.48Å; L86-P484 HydrophobicContact CD1-CG 4.13Å; L86-P484 HydrophobicContact CG-CG 4.47Å; D87-P484 WeakPolarHBondContact OD1-CB 3.3Å; P484-K486 VanDerWaalsContact C-N 3.26Å; P484-K486 HydrophobicContact CB-CG 4.26Å; P484-K486 PolarHBondContact O-N 2.98Å; P484-K486 VanDerWaalsContact O-N 3.16Å; P484-I487 HydrophobicContact CG-CD1 4.28Å; P484-I487 HydrophobicContact CG-CG1 4.47Å; P484-I487 PolarHBondContact O-N 3.11Å; P484-L488 PolarHBondContact O-N 3.46Å; P484-L488 VanDerWaalsContact O-N 3.15Å
485	P	92.3	Very high	93.1	Very high	47 Å²	47	31 Å²	31	31%	0.305	16%	0.164	S	C	.	.	H	α-helix	trans	-53.4	-38.5	178.7	-28.1	35.4	0	0	0	114.2	I487 L488 R489 I518	P485-I487 VanDerWaalsContact C-N 3.34Å; P485-I487 PolarHBondContact O-N 3.24Å; P485-L488 PolarHBondContact O-N 3.45Å; P485-R489 WeakPolarHBondContact O-CG 3.3Å; P485-R489 PolarHBondContact O-N 3.36Å; P485-I518 HydrophobicContact CB-CG2 4.34Å
486	K	95	Very high	93.2	Very high	24 Å²	24	29.4 Å²	29.4	10%	0.104	16%	0.161	C	C	.	.	H	α-helix	trans	-65.4	-33.3	179.5	60.4	178.2	178.9	-172.8	0	113.9	D303 P305 T307 P484 H490	D303-K486 PolarHBondContact O-NZ 3.34Å; P305-K486 WeakPolarHBondContact O-CA 3.38Å; P305-K486 VanDerWaalsContact O-CB 3.25Å; P305-K486 WeakPolarHBondContact O-CB 3.49Å; T307-K486 WeakPolarHBondContact OG1-CB 3.27Å; T307-K486 WeakPolarHBondContact OG1-CG 3.26Å; T307-K486 PolarHBondContact OG1-O 3.33Å; P484-K486 VanDerWaalsContact C-N 3.26Å; P484-K486 HydrophobicContact CB-CG 4.26Å; P484-K486 PolarHBondContact O-N 2.98Å; P484-K486 VanDerWaalsContact O-N 3.16Å; K486-H490 PolarHBondContact O-N 2.89Å
487	I	96.1	Very high	93.3	Very high	3 Å²	3	34 Å²	34	2%	0.015	20%	0.197	C	C	.	.	H	α-helix	trans	-74.5	-38.9	175.1	-60.1	-170.3	0	0	0	109.9	T307 L310 L420 F483 P484 P485 R489 H490 L491	T307-I487 HydrophobicContact CG2-CG1 4.33Å; T307-I487 PolarHBondContact OG1-N 3.32Å; L310-I487 HydrophobicContact CD1-CG1 4.29Å; L310-I487 HydrophobicContact CD1-CG2 4.06Å; L420-I487 HydrophobicContact CD2-CG2 3.97Å; F483-I487 HydrophobicContact CB-CB 4.48Å; F483-I487 HydrophobicContact CD1-CB 4.21Å; F483-I487 HydrophobicContact CD1-CG2 3.51Å; F483-I487 HydrophobicContact CE1-CG2 3.91Å; F483-I487 HydrophobicContact CG-CG2 4.23Å; P484-I487 HydrophobicContact CG-CD1 4.28Å; P484-I487 HydrophobicContact CG-CG1 4.47Å; P484-I487 PolarHBondContact O-N 3.11Å; P485-I487 VanDerWaalsContact C-N 3.34Å; P485-I487 PolarHBondContact O-N 3.24Å; I487-R489 VanDerWaalsContact C-N 3.3Å; I487-R489 PolarHBondContact O-N 3.34Å; I487-H490 WeakPolarHBondContact O-CB 3.32Å; I487-H490 PolarHBondContact O-N 3.42Å; I487-H490 VanDerWaalsContact O-N 3.14Å; I487-L491 HydrophobicContact CG2-CD1 4.15Å; I487-L491 HydrophobicContact CG2-CG 4.38Å; I487-L491 WeakPolarHBondContact O-CG 3.36Å; I487-L491 PolarHBondContact O-N 2.91Å
488	L	94.6	Very high	93.5	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-59.2	-41.2	173.9	-70	173.5	0	0	0	111.9	F483 P484 P485 H490 L491 I492 L503 P504 L507 I518	F483-L488 HydrophobicContact CB-CD1 4.38Å; F483-L488 HydrophobicContact CB-CD2 3.65Å; F483-L488 HydrophobicContact CB-CG 3.62Å; F483-L488 HydrophobicContact CD2-CD2 3.65Å; F483-L488 HydrophobicContact CG-CD2 3.99Å; F483-L488 HydrophobicContact CG-CG 4.44Å; P484-L488 PolarHBondContact O-N 3.46Å; P484-L488 VanDerWaalsContact O-N 3.15Å; P485-L488 PolarHBondContact O-N 3.45Å; L488-H490 VanDerWaalsContact C-N 3.35Å; L488-H490 PolarHBondContact O-N 3.28Å; L488-L491 PolarHBondContact O-N 3.09Å; L488-I492 WeakPolarHBondContact O-CB 3.27Å; L488-I492 WeakPolarHBondContact O-CD1 3.27Å; L488-I492 VanDerWaalsContact O-CG1 3.26Å; L488-I492 WeakPolarHBondContact O-CG1 3.32Å; L488-I492 PolarHBondContact O-N 3.34Å; L488-L503 HydrophobicContact CD2-CD2 4.46Å; L488-P504 HydrophobicContact CD1-CG 4.24Å; L488-L507 HydrophobicContact CD1-CD1 4.24Å; L488-I518 HydrophobicContact CB-CD1 3.44Å; L488-I518 VanDerWaalsContact CB-CD1 3.44Å; L488-I518 HydrophobicContact CD1-CD1 4.02Å; L488-I518 HydrophobicContact CG-CD1 4.35Å
489	R	95.4	Very high	93.6	Very high	15 Å²	15	29 Å²	29	6%	0.057	17%	0.169	C	C	.	.	H	α-helix	trans	-58.9	-45.8	173.5	-65.8	-176.6	-161.5	103.7	8	112	P305 L306 P485 I487 L491 I492 L493 P517 I518	P305-R489 PolarHBondContact O-NH1 3.48Å; P305-R489 VanDerWaalsContact O-NH1 3.07Å; L306-R489 HydrophobicContact CD2-CB 3.86Å; L306-R489 HydrophobicContact CD2-CG 4.42Å; P485-R489 WeakPolarHBondContact O-CG 3.3Å; P485-R489 PolarHBondContact O-N 3.36Å; I487-R489 VanDerWaalsContact C-N 3.3Å; I487-R489 PolarHBondContact O-N 3.34Å; R489-L491 VanDerWaalsContact C-N 3.33Å; R489-L491 PolarHBondContact O-N 3.27Å; R489-I492 PolarHBondContact O-N 3.44Å; R489-L493 WeakPolarHBondContact O-CB 3.49Å; R489-L493 WeakPolarHBondContact O-CG 3.43Å; R489-L493 PolarHBondContact O-N 3.09Å; R489-P517 HydrophobicContact CB-CG 4.43Å; R489-P517 VanDerWaalsContact CD-O 3.25Å; R489-P517 WeakPolarHBondContact CD-O 3.39Å; R489-P517 HydrophobicContact CG-CB 4.44Å; R489-P517 HydrophobicContact CG-CG 4.38Å; R489-P517 VanDerWaalsContact CG-O 3.26Å; R489-P517 WeakPolarHBondContact CG-O 3.37Å; R489-P517 PolarHBondContact NE-O 3.31Å; R489-I518 HydrophobicContact CG-CB 4.16Å; R489-I518 PolarHBondContact NE-O 3.01Å; R489-I518 PolarHBondContact NH2-O 3.38Å
490	H	97.7	Very high	93.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.5	-48.4	176.4	-170.7	104.2	0	0	0	111.3	F274 L306 T307 M311 R427 K486 I487 L488 L493 S494	F274-H490 HydrophobicContact CE2-CB 4.48Å; F274-H490 AromaticContact CE2-CE1 3.99Å; F274-H490 AromaticContact CE2-ND1 3.49Å; F274-H490 WeakPolarHBondContact CE2-ND1 3.14Å; F274-H490 HydrophobicContact CZ-CB 4.38Å; F274-H490 AromaticContact CZ-CE1 3.86Å; F274-H490 AromaticContact CZ-CG 3.82Å; F274-H490 AromaticContact CZ-ND1 3.6Å; L306-H490 WeakPolarHBondContact O-CB 3.5Å; L306-H490 PolarHBondContact O-ND1 2.79Å; L306-H490 VanDerWaalsContact O-ND1 3.13Å; T307-H490 PolarHBondContact O-CE1 2.93Å; T307-H490 PolarHBondContact O-ND1 3.49Å; M311-H490 VanDerWaalsContact CE-CE1 3.5Å; M311-H490 WeakPolarHBondContact CE-CE1 3.17Å; R427-H490 PolarHBondContact NH1-NE2 3.2Å; R427-H490 PolarHBondContact NH2-NE2 2.73Å; K486-H490 PolarHBondContact O-N 2.89Å; I487-H490 WeakPolarHBondContact O-CB 3.32Å; I487-H490 PolarHBondContact O-N 3.42Å; I487-H490 VanDerWaalsContact O-N 3.14Å; L488-H490 VanDerWaalsContact C-N 3.35Å; L488-H490 PolarHBondContact O-N 3.28Å; H490-L493 PolarHBondContact O-N 3.12Å; H490-S494 PolarHBondContact CD2-OG 3.21Å; H490-S494 PolarHBondContact NE2-OG 3.4Å; H490-S494 WeakPolarHBondContact O-CB 3.44Å; H490-S494 PolarHBondContact O-N 3.01Å; H490-S494 PolarHBondContact O-OG 3.09Å
491	L	95.9	Very high	93.3	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-65.6	-42.4	-178.5	-67.5	171	0	0	0	112.1	L423 F483 I487 L488 R489 S494 E495 P501	L423-L491 HydrophobicContact CD1-CD2 4.43Å; L423-L491 HydrophobicContact CD2-CD2 3.94Å; F483-L491 HydrophobicContact CD1-CD1 4.31Å; F483-L491 HydrophobicContact CD2-CD1 3.94Å; F483-L491 HydrophobicContact CE1-CD1 3.98Å; F483-L491 HydrophobicContact CE2-CD1 3.56Å; F483-L491 HydrophobicContact CG-CD1 4.28Å; F483-L491 HydrophobicContact CZ-CD1 3.56Å; I487-L491 HydrophobicContact CG2-CD1 4.15Å; I487-L491 HydrophobicContact CG2-CG 4.38Å; I487-L491 WeakPolarHBondContact O-CG 3.36Å; I487-L491 PolarHBondContact O-N 2.91Å; L488-L491 PolarHBondContact O-N 3.09Å; R489-L491 VanDerWaalsContact C-N 3.33Å; R489-L491 PolarHBondContact O-N 3.27Å; L491-S494 PolarHBondContact O-N 2.88Å; L491-E495 PolarHBondContact O-N 2.81Å; L491-P501 HydrophobicContact CB-CB 3.91Å
492	I	93.9	Very high	93.2	Very high	25 Å²	25	33.5 Å²	33.5	13%	0.128	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-46.2	176.2	-70.6	160.5	0	0	0	110.8	L488 R489 E495 P501 L503 I512 P517 I518	L488-I492 WeakPolarHBondContact O-CB 3.27Å; L488-I492 WeakPolarHBondContact O-CD1 3.27Å; L488-I492 VanDerWaalsContact O-CG1 3.26Å; L488-I492 WeakPolarHBondContact O-CG1 3.32Å; L488-I492 PolarHBondContact O-N 3.34Å; R489-I492 PolarHBondContact O-N 3.44Å; I492-E495 VanDerWaalsContact O-CG 3.26Å; I492-E495 WeakPolarHBondContact O-CG 3.31Å; I492-P501 HydrophobicContact CG1-CB 3.93Å; I492-P501 HydrophobicContact CG1-CG 4.06Å; I492-L503 HydrophobicContact CD1-CD2 4.3Å; I492-I512 HydrophobicContact CD1-CD1 4.39Å; I492-I512 HydrophobicContact CD1-CG2 4.02Å; I492-I512 HydrophobicContact CG2-CG2 4.39Å; I492-P517 HydrophobicContact CD1-CB 4.5Å; I492-P517 HydrophobicContact CG2-CB 4.06Å; I492-I518 HydrophobicContact CD1-CD1 3.47Å; I492-I518 VanDerWaalsContact CD1-CD1 3.47Å; I492-I518 HydrophobicContact CD1-CG1 3.82Å
493	L	95.8	Very high	93	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-75.6	-25.7	-178.6	-68.6	172.1	0	0	0	113.4	V271 F274 R275 L278 L306 R489 H490 P517	V271-L493 HydrophobicContact CG1-CD2 4.03Å; F274-L493 HydrophobicContact CB-CD1 4.29Å; F274-L493 HydrophobicContact CD1-CB 3.5Å; F274-L493 HydrophobicContact CD1-CD1 3.86Å; F274-L493 HydrophobicContact CD1-CG 4.28Å; F274-L493 HydrophobicContact CD2-CD1 4.24Å; F274-L493 HydrophobicContact CE1-CB 3.25Å; F274-L493 HydrophobicContact CE1-CD1 4.19Å; F274-L493 HydrophobicContact CE1-CG 4.36Å; F274-L493 HydrophobicContact CG-CB 4.36Å; F274-L493 HydrophobicContact CG-CD1 3.89Å; F274-L493 HydrophobicContact CZ-CB 3.93Å; R275-L493 HydrophobicContact CG-CD2 4.39Å; L278-L493 WeakPolarHBondContact CD1-O 3.27Å; L306-L493 HydrophobicContact CD1-CD1 3.92Å; L306-L493 HydrophobicContact CD2-CD1 3.97Å; L306-L493 HydrophobicContact CG-CD1 4.48Å; R489-L493 WeakPolarHBondContact O-CB 3.49Å; R489-L493 WeakPolarHBondContact O-CG 3.43Å; R489-L493 PolarHBondContact O-N 3.09Å; H490-L493 PolarHBondContact O-N 3.12Å; L493-P517 HydrophobicContact CD1-CG 4.02Å; L493-P517 HydrophobicContact CD2-CG 3.96Å; L493-P517 HydrophobicContact CG-CG 3.91Å
494	S	94.8	Very high	92.8	Very high	13 Å²	13	36 Å²	36	9%	0.091	21%	0.205	C	C	.	.	H	α-helix	trans	-78.1	-26.9	-178.2	-62.5	0	0	0	0	113.4	R427 H490 L491 V496	R427-S494 PolarHBondContact NH2-OG 2.97Å; H490-S494 PolarHBondContact CD2-OG 3.21Å; H490-S494 PolarHBondContact NE2-OG 3.4Å; H490-S494 WeakPolarHBondContact O-CB 3.44Å; H490-S494 PolarHBondContact O-N 3.01Å; H490-S494 PolarHBondContact O-OG 3.09Å; L491-S494 PolarHBondContact O-N 2.88Å; S494-V496 PolarHBondContact O-N 3.1Å
495	E	91.7	Very high	92.3	Very high	92 Å²	92	47.2 Å²	47.2	43%	0.43	25%	0.248	S	C	.	.			trans	52.2	28.1	175.2	-60	170.6	-159.5	0	0	113.9	H224 R275 L491 I492 S497	H224-E495 IonicContact NE2-OE2 3.47Å; R275-E495 IonicContact CZ-OE1 2.74Å; R275-E495 IonicContact NH1-OE1 2.86Å; R275-E495 PolarHBondContact NH1-OE1 3.05Å; R275-E495 IonicContact NH2-OE1 3.77Å; R275-E495 PolarHBondContact NH2-OE1 3.38Å; R275-E495 VanDerWaalsContact NH2-OE1 3.09Å; L491-E495 PolarHBondContact O-N 2.81Å; I492-E495 VanDerWaalsContact O-CG 3.26Å; I492-E495 WeakPolarHBondContact O-CG 3.31Å; E495-S497 PolarHBondContact O-N 2.97Å
496	V	93.9	Very high	91.6	Very high	31 Å²	31	49.6 Å²	49.6	19%	0.188	26%	0.258	C	S	.	.			trans	-74.3	114.7	179.8	176	0	0	0	0	109.5	L423 A426 S494 E498 A499	L423-V496 HydrophobicContact CD1-CB 4.05Å; L423-V496 HydrophobicContact CD1-CG1 4.41Å; L423-V496 HydrophobicContact CD1-CG2 3.8Å; A426-V496 HydrophobicContact CB-CG1 3.66Å; S494-V496 PolarHBondContact O-N 3.1Å; V496-E498 HydrophobicContact CG1-CB 4.31Å; V496-E498 PolarHBondContact O-N 3.15Å; V496-A499 HydrophobicContact CB-CB 4.37Å; V496-A499 HydrophobicContact CG1-CB 4.16Å; V496-A499 CarbonylContact O-C 3.32Å; V496-A499 VanDerWaalsContact O-C 3.24Å; V496-A499 PolarHBondContact O-N 2.92Å
497	S	93.1	Very high	90.7	Very high	117 Å²	117	50.2 Å²	50.2	82%	0.818	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-37.3	-177.8	-176	0	0	0	0	113.8	E495 A499	E495-S497 PolarHBondContact O-N 2.97Å; S497-A499 VanDerWaalsContact C-N 3.29Å; S497-A499 PolarHBondContact O-N 3.23Å
498	E	93.6	Very high	89.7	Confident	92 Å²	92	54.8 Å²	54.8	43%	0.43	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-14.7	-179.6	-66.4	169.3	-167.1	0	0	113.8	H390 S422 A426 V496	H390-E498 IonicContact CE1-OE1 2.72Å; H390-E498 PolarHBondContact CE1-OE1 3.14Å; H390-E498 IonicContact CE1-OE2 3.09Å; H390-E498 IonicContact NE2-OE1 2.68Å; H390-E498 IonicContact NE2-OE2 3.51Å; S422-E498 WeakPolarHBondContact CB-O 3.27Å; A426-E498 WeakPolarHBondContact CA-OE2 3.47Å; A426-E498 HydrophobicContact CB-CB 4.33Å; A426-E498 WeakPolarHBondContact CB-OE2 3.45Å; V496-E498 HydrophobicContact CG1-CB 4.31Å; V496-E498 PolarHBondContact O-N 3.15Å
499	A	94.4	Very high	88.5	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.008	32%	0.324	C	S	.	.	S	Bend	trans	-134.4	64	-176.2	0	0	0	0	0	111.2	L423 V496 S497	L423-A499 HydrophobicContact CB-CB 3.69Å; L423-A499 HydrophobicContact CD1-CB 4.09Å; V496-A499 HydrophobicContact CB-CB 4.37Å; V496-A499 HydrophobicContact CG1-CB 4.16Å; V496-A499 CarbonylContact O-C 3.32Å; V496-A499 VanDerWaalsContact O-C 3.24Å; V496-A499 PolarHBondContact O-N 2.92Å; S497-A499 VanDerWaalsContact C-N 3.29Å; S497-A499 PolarHBondContact O-N 3.23Å
500	P	91.3	Very high	87.6	Confident	75 Å²	75	62 Å²	62	49%	0.487	34%	0.344	S	S	.	.			trans	-67.9	149.7	-178.4	29.1	-35.1	0	0	0	111.6	C419 I502	C419-P500 PolarHBondContact SG-O 3.24Å; C419-P500 VanDerWaalsContact SG-O 3.39Å; P500-I502 PolarHBondContact O-N 2.66Å
501	P	88.2	Confident	86.6	Confident	48 Å²	48	66.4 Å²	66.4	31%	0.312	37%	0.372	S	S	.	.			trans	-66.7	122.1	176.5	26.9	-33.6	0	0	0	111.2	L491 I492 L503	L491-P501 HydrophobicContact CB-CB 3.91Å; I492-P501 HydrophobicContact CG1-CB 3.93Å; I492-P501 HydrophobicContact CG1-CG 4.06Å; P501-L503 HydrophobicContact CB-CD2 4.45Å; P501-L503 PolarHBondContact O-N 3.14Å
502	I	88.4	Confident	86	Confident	75 Å²	75	69.2 Å²	69.2	39%	0.385	39%	0.386	S	S	.	.			trans	-89.8	94	176.8	-53	179.5	0	0	0	108.7	D415 C419 F483 P500 P504	D415-I502 HydrophobicContact CB-CD1 3.6Å; C419-I502 HydrophobicContact CB-CD1 4.27Å; F483-I502 HydrophobicContact CD2-CB 4.28Å; F483-I502 HydrophobicContact CE2-CB 3.98Å; F483-I502 HydrophobicContact CE2-CD1 4.25Å; F483-I502 HydrophobicContact CE2-CG1 4.1Å; P500-I502 PolarHBondContact O-N 2.66Å; I502-P504 WeakPolarHBondContact O-CD 3.47Å
503	L	85.7	Confident	85.7	Confident	58 Å²	58	72 Å²	72	30%	0.304	40%	0.396	S	S	.	.			trans	-77.3	130	-174.1	-62.8	177.9	0	0	0	112.3	L488 I492 P501 T508 I512	L488-L503 HydrophobicContact CD2-CD2 4.46Å; I492-L503 HydrophobicContact CD1-CD2 4.3Å; P501-L503 HydrophobicContact CB-CD2 4.45Å; P501-L503 PolarHBondContact O-N 3.14Å; L503-T508 HydrophobicContact CB-CG2 4.29Å; L503-I512 HydrophobicContact CD1-CD1 3.61Å; L503-I512 HydrophobicContact CD2-CD1 3.95Å; L503-I512 HydrophobicContact CG-CD1 4.46Å
504	P	84.3	Confident	85.1	Confident	35 Å²	35	72.2 Å²	72.2	23%	0.227	40%	0.398	C	S	.	.			trans	-55.8	146.1	166.6	-28.8	36.8	0	0	0	112.8	L488 I502 N506 L507 T508	L488-P504 HydrophobicContact CD1-CG 4.24Å; I502-P504 WeakPolarHBondContact O-CD 3.47Å; P504-N506 WeakPolarHBondContact CB-OD1 3.42Å; P504-N506 PolarHBondContact O-N 2.76Å; P504-L507 HydrophobicContact CG-CD1 4.33Å; P504-L507 PolarHBondContact O-N 2.81Å; P504-T508 PolarHBondContact O-N 3.01Å
505	R	81.4	Confident	84.9	Confident	235 Å²	235	71.9 Å²	71.9	89%	0.887	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-22.2	-178.9	-65.2	-176.3	-177.9	177.7	0.5	115	T508	R505-T508 PolarHBondContact O-OG1 2.93Å
506	N	78	Confident	84.9	Confident	98 Å²	98	68.6 Å²	68.6	52%	0.524	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.7	177	63.6	-66.3	0	0	0	113.7	P504	P504-N506 WeakPolarHBondContact CB-OD1 3.42Å; P504-N506 PolarHBondContact O-N 2.76Å
507	L	77.3	Confident	84.8	Confident	37 Å²	37	67.1 Å²	67.1	19%	0.194	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-13.3	177.9	-74.5	169.3	0	0	0	112.5	L488 P504 S509 S510 I518	L488-L507 HydrophobicContact CD1-CD1 4.24Å; P504-L507 HydrophobicContact CG-CD1 4.33Å; P504-L507 PolarHBondContact O-N 2.81Å; L507-S509 PolarHBondContact O-N 3.13Å; L507-S510 PolarHBondContact O-N 3.45Å; L507-I518 HydrophobicContact CD1-CD1 4.18Å; L507-I518 HydrophobicContact CD1-CG2 4.45Å
508	T	73.6	Confident	84.7	Confident	98 Å²	98	62.3 Å²	62.3	60%	0.601	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-17.5	-178.2	54	0	0	0	0	114	L503 P504 R505	L503-T508 HydrophobicContact CB-CG2 4.29Å; P504-T508 PolarHBondContact O-N 3.01Å; R505-T508 PolarHBondContact O-OG1 2.93Å
509	S	70.8	Confident	84.6	Confident	104 Å²	104	61.1 Å²	61.1	73%	0.727	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-13.3	-179.2	55.5	0	0	0	0	114.3	L507	L507-S509 PolarHBondContact O-N 3.13Å
510	S	75	Confident	84.5	Confident	67 Å²	67	62.2 Å²	62.2	47%	0.469	34%	0.344	S	S	.	.	S	Bend	trans	-103.9	139.8	-175.9	-63.2	0	0	0	0	109.9	L507 I512	L507-S510 PolarHBondContact O-N 3.45Å; S510-I512 PolarHBondContact O-N 3.17Å
511	P	76.9	Confident	84.4	Confident	92 Å²	92	70.3 Å²	70.3	60%	0.597	36%	0.364	S	S	*	.			trans	-61.4	131	173.4	26.9	-33.2	0	0	0	109.3	Y513	P511-Y513 HydrophobicContact CB-CE1 4.4Å; P511-Y513 HydrophobicContact CB-CE2 4.23Å; P511-Y513 HydrophobicContact CG-CE2 4.11Å
512	I	85	Confident	84.4	Confident	59 Å²	59	71.3 Å²	71.3	30%	0.303	37%	0.373	S	S	.	.			trans	-104.1	111.3	173.2	-61.1	177.9	0	0	0	106.3	I492 L503 S510	I492-I512 HydrophobicContact CD1-CD1 4.39Å; I492-I512 HydrophobicContact CD1-CG2 4.02Å; I492-I512 HydrophobicContact CG2-CG2 4.39Å; L503-I512 HydrophobicContact CD1-CD1 3.61Å; L503-I512 HydrophobicContact CD2-CD1 3.95Å; L503-I512 HydrophobicContact CG-CD1 4.46Å; S510-I512 PolarHBondContact O-N 3.17Å
513	Y	86.4	Confident	84.6	Confident	83 Å²	83	69.4 Å²	69.4	33%	0.325	37%	0.366	S	S	.	.			trans	-87.5	140.9	175.5	-57.9	-71.9	0	0	0	110.4	L193 P511 F515 D516 P517	L193-Y513 HydrophobicContact CB-CE1 4.5Å; L193-Y513 HydrophobicContact CD1-CD1 4.25Å; L193-Y513 HydrophobicContact CD1-CE1 4.03Å; P511-Y513 HydrophobicContact CB-CE1 4.4Å; P511-Y513 HydrophobicContact CB-CE2 4.23Å; P511-Y513 HydrophobicContact CG-CE2 4.11Å; Y513-F515 AromaticContact CD1-CE1 3.72Å; Y513-F515 HydrophobicContact CD1-CE1 3.72Å; Y513-F515 HydrophobicContact CD1-CZ 4.19Å; Y513-F515 HydrophobicContact CD2-CE1 4.39Å; Y513-F515 HydrophobicContact CD2-CZ 4.1Å; Y513-F515 HydrophobicContact CG-CD1 4.43Å; Y513-F515 AromaticContact CG-CE1 3.57Å; Y513-F515 HydrophobicContact CG-CE1 3.57Å; Y513-F515 AromaticContact CG-CZ 3.72Å; Y513-F515 HydrophobicContact CG-CZ 3.72Å; Y513-D516 CarbonylContact O-C 3.16Å; Y513-D516 PolarHBondContact O-N 3.1Å; Y513-P517 WeakPolarHBondContact O-CA 3.19Å; Y513-P517 VanDerWaalsContact O-N 3.14Å
514	A	83.4	Confident	84.9	Confident	7 Å²	7	69.9 Å²	69.9	6%	0.058	37%	0.368	C	S	.	.	S	Bend	trans	-87.9	-13.1	-176.7	0	0	0	0	0	114	E220 V271 D516	E220-A514 HydrophobicContact CG-CB 4.37Å; E220-A514 WeakPolarHBondContact OE1-CB 3.47Å; E220-A514 WeakPolarHBondContact OE2-CB 3.43Å; V271-A514 WeakPolarHBondContact CG1-O 3.17Å; A514-D516 VanDerWaalsContact C-N 3.26Å
515	F	90.5	Very high	85.2	Confident	6 Å²	6	70.4 Å²	70.4	3%	0.026	37%	0.369	C	S	.	.	S	Bend	trans	-72.6	-20.5	164.1	67	-95.8	0	0	0	112.2	F189 L193 D213 L216 Q217 Y513	F189-F515 AromaticContact CE1-CE1 3.96Å; F189-F515 HydrophobicContact CE1-CE1 3.96Å; F189-F515 HydrophobicContact CE1-CE2 4.13Å; F189-F515 AromaticContact CE1-CZ 3.75Å; F189-F515 HydrophobicContact CE1-CZ 3.75Å; F189-F515 HydrophobicContact CZ-CD1 4.14Å; F189-F515 AromaticContact CZ-CE1 3.82Å; F189-F515 HydrophobicContact CZ-CE1 3.82Å; F189-F515 HydrophobicContact CZ-CZ 4.1Å; L193-F515 HydrophobicContact CD1-CE1 3.55Å; L193-F515 HydrophobicContact CD1-CZ 3.61Å; L193-F515 HydrophobicContact CD2-CE1 4.45Å; D213-F515 HydrophobicContact CB-CD2 4.11Å; D213-F515 HydrophobicContact CB-CE2 4.48Å; D213-F515 HydrophobicContact CB-CG 4.46Å; L216-F515 HydrophobicContact CB-CB 3.76Å; L216-F515 HydrophobicContact CD1-CB 4.25Å; Q217-F515 HydrophobicContact CB-CD1 4.18Å; Q217-F515 VanDerWaalsContact OE1-CD1 3.22Å; Y513-F515 AromaticContact CD1-CE1 3.72Å; Y513-F515 HydrophobicContact CD1-CE1 3.72Å; Y513-F515 HydrophobicContact CD1-CZ 4.19Å; Y513-F515 HydrophobicContact CD2-CE1 4.39Å; Y513-F515 HydrophobicContact CD2-CZ 4.1Å; Y513-F515 HydrophobicContact CG-CD1 4.43Å; Y513-F515 AromaticContact CG-CE1 3.57Å; Y513-F515 HydrophobicContact CG-CE1 3.57Å; Y513-F515 AromaticContact CG-CZ 3.72Å; Y513-F515 HydrophobicContact CG-CZ 3.72Å
516	D	92.5	Very high	85.6	Confident	22 Å²	22	61 Å²	61	12%	0.118	34%	0.336	C	S	.	.	S	Bend	trans	-150.3	69	-178.4	-169.3	18.8	0	0	0	112.9	R267 Y513 A514 I518	R267-D516 VanDerWaalsContact CD-OD1 3.3Å; R267-D516 WeakPolarHBondContact CD-OD1 3.46Å; R267-D516 IonicContact CZ-OD1 2.66Å; R267-D516 IonicContact CZ-OD2 2.9Å; R267-D516 VanDerWaalsContact CZ-OD2 3.23Å; R267-D516 VanDerWaalsContact NE-CG 3.32Å; R267-D516 IonicContact NE-OD1 3.63Å; R267-D516 PolarHBondContact NE-OD1 3.38Å; R267-D516 IonicContact NE-OD2 2.62Å; R267-D516 PolarHBondContact NE-OD2 2.84Å; R267-D516 IonicContact NH2-OD1 3.88Å; R267-D516 IonicContact NH2-OD2 3.8Å; R267-D516 PolarHBondContact NH2-OD2 3.43Å; Y513-D516 CarbonylContact O-C 3.16Å; Y513-D516 PolarHBondContact O-N 3.1Å; A514-D516 VanDerWaalsContact C-N 3.26Å; D516-I518 PolarHBondContact O-N 2.99Å
517	P	91.8	Very high	86.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.315	C	S	.	.			trans	-73.1	127.7	-172.8	29	-35.2	0	0	0	111.9	R489 I492 L493 Y513	R489-P517 HydrophobicContact CB-CG 4.43Å; R489-P517 VanDerWaalsContact CD-O 3.25Å; R489-P517 WeakPolarHBondContact CD-O 3.39Å; R489-P517 HydrophobicContact CG-CB 4.44Å; R489-P517 HydrophobicContact CG-CG 4.38Å; R489-P517 VanDerWaalsContact CG-O 3.26Å; R489-P517 WeakPolarHBondContact CG-O 3.37Å; R489-P517 PolarHBondContact NE-O 3.31Å; I492-P517 HydrophobicContact CD1-CB 4.5Å; I492-P517 HydrophobicContact CG2-CB 4.06Å; L493-P517 HydrophobicContact CD1-CG 4.02Å; L493-P517 HydrophobicContact CD2-CG 3.96Å; L493-P517 HydrophobicContact CG-CG 3.91Å; Y513-P517 WeakPolarHBondContact O-CA 3.19Å; Y513-P517 VanDerWaalsContact O-N 3.14Å
518	I	90.8	Very high	86.4	Confident	17 Å²	17	58.1 Å²	58.1	9%	0.087	32%	0.319	C	S	.	.	S	Bend	trans	45.7	70.3	173.7	-51.4	176.6	0	0	0	111.5	P485 L488 R489 I492 L507 D516	P485-I518 HydrophobicContact CB-CG2 4.34Å; L488-I518 HydrophobicContact CB-CD1 3.44Å; L488-I518 VanDerWaalsContact CB-CD1 3.44Å; L488-I518 HydrophobicContact CD1-CD1 4.02Å; L488-I518 HydrophobicContact CG-CD1 4.35Å; R489-I518 HydrophobicContact CG-CB 4.16Å; R489-I518 PolarHBondContact NE-O 3.01Å; R489-I518 PolarHBondContact NH2-O 3.38Å; I492-I518 HydrophobicContact CD1-CD1 3.47Å; I492-I518 VanDerWaalsContact CD1-CD1 3.47Å; I492-I518 HydrophobicContact CD1-CG1 3.82Å; L507-I518 HydrophobicContact CD1-CD1 4.18Å; L507-I518 HydrophobicContact CD1-CG2 4.45Å; D516-I518 PolarHBondContact O-N 2.99Å
519	P	91.6	Very high	86.2	Confident	66 Å²	66	57.5 Å²	57.5	43%	0.429	32%	0.317	S	S	.	.			trans	-56	145.3	179.4	23.5	-34.7	0	0	0	111.6
520	P	92.6	Very high	86.2	Confident	24 Å²	24	59.4 Å²	59.4	16%	0.156	32%	0.315	C	S	.	.			trans	-57.9	148.5	178.1	-23.1	33.4	0	0	0	112	F261 S522 S523	F261-P520 HydrophobicContact CD1-CG 3.74Å; F261-P520 HydrophobicContact CE1-CG 3.85Å; P520-S522 PolarHBondContact O-N 2.88Å; P520-S523 WeakPolarHBondContact O-CB 3.49Å; P520-S523 PolarHBondContact O-N 3.17Å
521	R	87.7	Confident	85.8	Confident	245 Å²	245	59.2 Å²	59.2	93%	0.925	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.3	175.3	-67.2	-176.9	-179.5	163.6	2.3	113.1	S523	R521-S523 VanDerWaalsContact C-N 3.26Å
522	S	89.4	Confident	85.4	Confident	69 Å²	69	57.2 Å²	57.2	48%	0.483	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	30	173.2	65.6	0	0	0	0	111.9	P520 I524	P520-S522 PolarHBondContact O-N 2.88Å; S522-I524 PolarHBondContact O-N 3.09Å
523	S	91.6	Very high	84.8	Confident	36 Å²	36	60.9 Å²	60.9	25%	0.252	30%	0.299	S	S	.	.			trans	-63.2	131.8	-179.9	176.6	0	0	0	0	110.3	K262 R267 P520 R521	K262-S523 CarbonylContact O-C 3.57Å; K262-S523 WeakPolarHBondContact O-CA 3.37Å; R267-S523 PolarHBondContact NH1-OG 2.67Å; P520-S523 WeakPolarHBondContact O-CB 3.49Å; P520-S523 PolarHBondContact O-N 3.17Å; R521-S523 VanDerWaalsContact C-N 3.26Å
524	I	92.6	Very high	84.1	Confident	68 Å²	68	63.7 Å²	63.7	35%	0.349	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-93.6	96.4	169.2	-56.8	168.8	0	0	0	105.9	K262 R263 Q264 S522	K262-I524 PolarHBondContact O-N 3.33Å; R263-I524 HydrophobicContact CG-CB 4.34Å; R263-I524 HydrophobicContact CG-CD1 4.09Å; Q264-I524 PolarHBondContact N-O 3.41Å; S522-I524 PolarHBondContact O-N 3.09Å
525	N	90.3	Very high	83.4	Confident	46 Å²	46	67.2 Å²	67.2	25%	0.246	32%	0.321	C	S	.	.			trans	-103.1	113.3	-178.6	-174.2	5.4	0	0	0	110.3	Y527 D528	N525-Y527 PolarHBondContact O-N 3.03Å; N525-Y527 WeakPolarHBondContact OD1-CB 3.44Å; N525-Y527 PolarHBondContact OD1-N 3.17Å; N525-D528 PolarHBondContact O-N 3.44Å
526	I	90.9	Very high	82.4	Confident	37 Å²	37	70.3 Å²	70.3	19%	0.19	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.1	177.8	64	168.2	0	0	0	113.5	H178 Q183 V265	H178-I526 HydrophobicContact CB-CD1 4.36Å; Q183-I526 HydrophobicContact CG-CD1 4.46Å; V265-I526 HydrophobicContact CG1-CD1 3.5Å; V265-I526 HydrophobicContact CG1-CG1 4Å
527	Y	88.9	Confident	81.4	Confident	21 Å²	21	77.9 Å²	77.9	8%	0.082	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	9	-179.1	-59	-71.7	0	0	0	113.8	H178 Q183 Q186 R187 Y190 Q264 N525 P529	H178-Y527 AromaticContact ND1-CE2 3.99Å; H178-Y527 AromaticContact ND1-CZ 3.76Å; H178-Y527 PolarHBondContact ND1-OH 2.89Å; Q183-Y527 HydrophobicContact CB-CE1 3.78Å; Q183-Y527 HydrophobicContact CG-CE1 3.76Å; Q186-Y527 HydrophobicContact CB-CD1 4.49Å; Q186-Y527 HydrophobicContact CB-CE1 3.73Å; Q186-Y527 HydrophobicContact CB-CE2 4.41Å; Q186-Y527 HydrophobicContact CG-CD1 4.24Å; Q186-Y527 HydrophobicContact CG-CD2 4.17Å; Q186-Y527 HydrophobicContact CG-CE1 3.77Å; Q186-Y527 HydrophobicContact CG-CE2 3.72Å; Q186-Y527 HydrophobicContact CG-CG 4.41Å; Q186-Y527 VanDerWaalsContact CG-CZ 3.48Å; R187-Y527 HydrophobicContact CG-CD1 4.5Å; Y190-Y527 HydrophobicContact CE2-CD1 4.48Å; Y190-Y527 HydrophobicContact CE2-CD2 4.19Å; Y190-Y527 AromaticContact CE2-CG 3.93Å; Y190-Y527 HydrophobicContact CE2-CG 3.93Å; Q264-Y527 VanDerWaalsContact OE1-CE2 3.29Å; N525-Y527 PolarHBondContact O-N 3.03Å; N525-Y527 WeakPolarHBondContact OD1-CB 3.44Å; N525-Y527 PolarHBondContact OD1-N 3.17Å; Y527-P529 VanDerWaalsContact O-CD 3.29Å; Y527-P529 WeakPolarHBondContact O-CD 3.49Å
528	D	81.5	Confident	80.4	Confident	53 Å²	53	83 Å²	83	28%	0.283	39%	0.387	S	S	.	.			trans	-62.9	120.3	175.9	-173.4	-18.7	0	0	0	110.1	N525 E530 E531 E532	N525-D528 PolarHBondContact O-N 3.44Å; D528-E530 PolarHBondContact O-N 3.35Å; D528-E530 PolarHBondContact OD1-N 3.16Å; D528-E531 HydrophobicContact CB-CB 4.08Å; D528-E531 HydrophobicContact CB-CG 4.02Å; D528-E531 PolarHBondContact O-N 2.61Å; D528-E532 WeakPolarHBondContact O-CB 3.46Å; D528-E532 PolarHBondContact O-N 3.13Å
529	P	70.5	Confident	79.4	Confident	85 Å²	85	87.3 Å²	87.3	55%	0.552	42%	0.415	S	S	*	.	H	α-helix	trans	-55.5	-33.2	177.4	-25	34.4	0	0	0	113.6	Y527 R533	Y527-P529 VanDerWaalsContact O-CD 3.29Å; Y527-P529 WeakPolarHBondContact O-CD 3.49Å; P529-R533 VanDerWaalsContact O-CG 3.24Å; P529-R533 WeakPolarHBondContact O-CG 3.39Å; P529-R533 PolarHBondContact O-N 3.05Å; P529-R533 VanDerWaalsContact O-N 3.09Å
530	E	69.7	Low	77.6	Confident	145 Å²	145	88 Å²	88	68%	0.678	41%	0.413	S	S	*	.	H	α-helix	trans	-74.6	-44.6	-179.3	-65.1	-170.5	173.8	0	0	112.1	D528 E532 R533 R534	D528-E530 PolarHBondContact O-N 3.35Å; D528-E530 PolarHBondContact OD1-N 3.16Å; E530-E532 VanDerWaalsContact C-N 3.29Å; E530-E532 PolarHBondContact O-N 3.22Å; E530-R533 PolarHBondContact O-N 2.91Å; E530-R534 PolarHBondContact O-N 3.24Å
531	E	68.3	Low	75.9	Confident	63 Å²	63	90.3 Å²	90.3	29%	0.294	44%	0.435	S	S	.	.	H	α-helix	trans	-63.1	-38.8	174.8	-68.9	-166.4	173.7	0	0	111.4	D528 R534 R535	D528-E531 HydrophobicContact CB-CB 4.08Å; D528-E531 HydrophobicContact CB-CG 4.02Å; D528-E531 PolarHBondContact O-N 2.61Å; E531-R534 CarbonylContact O-C 3.57Å; E531-R534 WeakPolarHBondContact O-CA 3.43Å; E531-R534 VanDerWaalsContact O-CB 3.29Å; E531-R534 WeakPolarHBondContact O-CB 3.48Å; E531-R534 PolarHBondContact O-N 3.48Å; E531-R534 VanDerWaalsContact O-N 3.13Å; E531-R535 WeakPolarHBondContact O-CG 3.36Å; E531-R535 PolarHBondContact O-N 3.41Å; E531-R535 IonicContact OE2-NH2 2.77Å; E531-R535 PolarHBondContact OE2-NH2 3.46Å
532	E	67.5	Low	74.3	Confident	50 Å²	50	82.1 Å²	82.1	23%	0.234	43%	0.427	C	S	.	.	H	α-helix	trans	-65.9	-44.9	178.3	-174.9	58.4	-162.7	0	0	111.5	D528 E530 R534 R535 I536	D528-E532 WeakPolarHBondContact O-CB 3.46Å; D528-E532 PolarHBondContact O-N 3.13Å; E530-E532 VanDerWaalsContact C-N 3.29Å; E530-E532 PolarHBondContact O-N 3.22Å; E532-R534 PolarHBondContact O-N 3.38Å; E532-R535 PolarHBondContact O-N 3.05Å; E532-R535 VanDerWaalsContact O-N 3.07Å; E532-I536 HydrophobicContact CG-CD1 3.98Å; E532-I536 HydrophobicContact CG-CG1 4.4Å; E532-I536 WeakPolarHBondContact O-CG1 3.22Å; E532-I536 PolarHBondContact O-N 3.04Å
533	R	71.3	Confident	72.4	Confident	135 Å²	135	82.1 Å²	82.1	51%	0.509	43%	0.427	S	S	.	.	H	α-helix	trans	-56	-37.1	171.6	-74.1	171.6	-165.9	170	6	111.4	P529 E530 R537	P529-R533 VanDerWaalsContact O-CG 3.24Å; P529-R533 WeakPolarHBondContact O-CG 3.39Å; P529-R533 PolarHBondContact O-N 3.05Å; P529-R533 VanDerWaalsContact O-N 3.09Å; E530-R533 PolarHBondContact O-N 2.91Å; R533-R537 VanDerWaalsContact O-CB 3.25Å; R533-R537 WeakPolarHBondContact O-CB 3.34Å; R533-R537 PolarHBondContact O-N 3.22Å
534	R	72.3	Confident	70.3	Confident	142 Å²	142	82.8 Å²	82.8	54%	0.536	44%	0.439	S	S	.	.	H	α-helix	trans	-66.4	-46.2	175.3	-155.1	-173.8	81.2	-154.6	-3.3	111.5	E530 E531 E532 R537 E538	E530-R534 PolarHBondContact O-N 3.24Å; E531-R534 CarbonylContact O-C 3.57Å; E531-R534 WeakPolarHBondContact O-CA 3.43Å; E531-R534 VanDerWaalsContact O-CB 3.29Å; E531-R534 WeakPolarHBondContact O-CB 3.48Å; E531-R534 PolarHBondContact O-N 3.48Å; E531-R534 VanDerWaalsContact O-N 3.13Å; E532-R534 PolarHBondContact O-N 3.38Å; R534-R537 CarbonylContact O-C 3.59Å; R534-R537 PolarHBondContact O-N 3.37Å; R534-E538 WeakPolarHBondContact CG-OE1 3.03Å; R534-E538 IonicContact CZ-OE1 2.72Å; R534-E538 IonicContact NE-OE1 3.28Å; R534-E538 PolarHBondContact NE-OE1 2.86Å; R534-E538 IonicContact NH2-OE1 3.18Å; R534-E538 WeakPolarHBondContact O-CB 3.43Å; R534-E538 VanDerWaalsContact O-CG 3.3Å; R534-E538 WeakPolarHBondContact O-CG 3.47Å; R534-E538 PolarHBondContact O-N 2.78Å
535	R	69.8	Low	68.8	Low	82 Å²	82	87.9 Å²	87.9	31%	0.309	46%	0.459	S	S	.	.	H	α-helix	trans	-62.6	-43.8	177	-70.1	176.3	-167.1	178.3	7.7	112.5	E531 E532 R537 E538 T539	E531-R535 WeakPolarHBondContact O-CG 3.36Å; E531-R535 PolarHBondContact O-N 3.41Å; E531-R535 IonicContact OE2-NH2 2.77Å; E531-R535 PolarHBondContact OE2-NH2 3.46Å; E532-R535 PolarHBondContact O-N 3.05Å; E532-R535 VanDerWaalsContact O-N 3.07Å; R535-R537 VanDerWaalsContact C-N 3.32Å; R535-E538 PolarHBondContact O-N 3.45Å; R535-T539 WeakPolarHBondContact O-CB 3.39Å; R535-T539 PolarHBondContact O-N 3.28Å; R535-T539 PolarHBondContact O-OG1 2.86Å
536	I	69.7	Low	67.2	Low	70 Å²	70	91.8 Å²	91.8	36%	0.359	48%	0.479	S	S	.	.	H	α-helix	trans	-61.1	-45.6	174.8	-66.5	169.8	0	0	0	109.3	E532 E538 T539 M540	E532-I536 HydrophobicContact CG-CD1 3.98Å; E532-I536 HydrophobicContact CG-CG1 4.4Å; E532-I536 WeakPolarHBondContact O-CG1 3.22Å; E532-I536 PolarHBondContact O-N 3.04Å; I536-E538 PolarHBondContact O-N 3.4Å; I536-T539 PolarHBondContact O-N 3.06Å; I536-M540 HydrophobicContact CG2-CE 3.9Å; I536-M540 HydrophobicContact CG2-CG 4.35Å; I536-M540 HydrophobicContact CG2-SD 4.26Å; I536-M540 VanDerWaalsContact O-CB 3.3Å; I536-M540 WeakPolarHBondContact O-CB 3.12Å; I536-M540 VanDerWaalsContact O-CG 3.31Å; I536-M540 WeakPolarHBondContact O-CG 2.89Å; I536-M540 PolarHBondContact O-N 3.44Å
537	R	69.9	Low	65.5	Low	182 Å²	182	93.5 Å²	93.5	69%	0.687	49%	0.488	S	S	*	.	H	α-helix	trans	-63	-41.3	176.6	-173.3	-176.9	-66.6	167.6	-0.8	112.5	R533 R534 R535 M540 A541	R533-R537 VanDerWaalsContact O-CB 3.25Å; R533-R537 WeakPolarHBondContact O-CB 3.34Å; R533-R537 PolarHBondContact O-N 3.22Å; R534-R537 CarbonylContact O-C 3.59Å; R534-R537 PolarHBondContact O-N 3.37Å; R535-R537 VanDerWaalsContact C-N 3.32Å; R537-M540 PolarHBondContact O-N 3.26Å; R537-A541 WeakPolarHBondContact O-CB 3.35Å; R537-A541 PolarHBondContact O-N 3.26Å
538	E	71.4	Confident	63.8	Low	106 Å²	106	94.4 Å²	94.4	50%	0.495	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-44.4	177	-74.8	166.7	-165.1	0	0	111.2	R534 R535 I536 A541 G542	R534-E538 WeakPolarHBondContact CG-OE1 3.03Å; R534-E538 IonicContact CZ-OE1 2.72Å; R534-E538 IonicContact NE-OE1 3.28Å; R534-E538 PolarHBondContact NE-OE1 2.86Å; R534-E538 IonicContact NH2-OE1 3.18Å; R534-E538 WeakPolarHBondContact O-CB 3.43Å; R534-E538 VanDerWaalsContact O-CG 3.3Å; R534-E538 WeakPolarHBondContact O-CG 3.47Å; R534-E538 PolarHBondContact O-N 2.78Å; R535-E538 PolarHBondContact O-N 3.45Å; I536-E538 PolarHBondContact O-N 3.4Å; E538-A541 PolarHBondContact O-N 3.31Å; E538-G542 PolarHBondContact O-N 3.5Å
539	T	69.7	Low	62.9	Low	109 Å²	109	96 Å²	96	67%	0.669	51%	0.512	S	S	*	.	H	α-helix	trans	-64.9	-40.4	177	-50.3	0	0	0	0	111.2	R535 I536	R535-T539 WeakPolarHBondContact O-CB 3.39Å; R535-T539 PolarHBondContact O-N 3.28Å; R535-T539 PolarHBondContact O-OG1 2.86Å; I536-T539 PolarHBondContact O-N 3.06Å
540	M	53.3	Low	62.2	Low	80 Å²	80	97.3 Å²	97.3	39%	0.394	51%	0.514	S	S	.	.	H	α-helix	trans	-73.8	-33.5	175.3	-73.3	-164.2	-177.1	0	0	112.9	I536 R537 G542 S543	I536-M540 HydrophobicContact CG2-CE 3.9Å; I536-M540 HydrophobicContact CG2-CG 4.35Å; I536-M540 HydrophobicContact CG2-SD 4.26Å; I536-M540 VanDerWaalsContact O-CB 3.3Å; I536-M540 WeakPolarHBondContact O-CB 3.12Å; I536-M540 VanDerWaalsContact O-CG 3.31Å; I536-M540 WeakPolarHBondContact O-CG 2.89Å; I536-M540 PolarHBondContact O-N 3.44Å; R537-M540 PolarHBondContact O-N 3.26Å; M540-G542 VanDerWaalsContact C-N 3.27Å; M540-G542 PolarHBondContact O-N 3.33Å; M540-S543 CarbonylContact O-C 3.26Å; M540-S543 VanDerWaalsContact O-C 3.26Å; M540-S543 WeakPolarHBondContact O-CA 3.47Å; M540-S543 PolarHBondContact O-N 2.84Å
541	A	58	Low	61.3	Low	73 Å²	73	92.8 Å²	92.8	60%	0.603	50%	0.498	S	S	*	.	H	α-helix	trans	-67.6	-29.3	175.2	0	0	0	0	0	112	R537 E538 S543	R537-A541 WeakPolarHBondContact O-CB 3.35Å; R537-A541 PolarHBondContact O-N 3.26Å; E538-A541 PolarHBondContact O-N 3.31Å; A541-S543 PolarHBondContact O-N 2.88Å
542	G	54.8	Low	61	Low	73 Å²	73	93.9 Å²	93.9	75%	0.753	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-15	166.6	0	0	0	0	0	114	E538 M540	E538-G542 PolarHBondContact O-N 3.5Å; M540-G542 VanDerWaalsContact C-N 3.27Å; M540-G542 PolarHBondContact O-N 3.33Å
543	S	48.7	Very low	60.2	Low	69 Å²	69	98.8 Å²	98.8	48%	0.483	53%	0.533	S	S	.	.	S	Bend	trans	-117.7	64.8	-178.5	-167.1	0	0	0	0	111.4	M540 A541 N547	M540-S543 CarbonylContact O-C 3.26Å; M540-S543 VanDerWaalsContact O-C 3.26Å; M540-S543 WeakPolarHBondContact O-CA 3.47Å; M540-S543 PolarHBondContact O-N 2.84Å; A541-S543 PolarHBondContact O-N 2.88Å; S543-N547 WeakPolarHBondContact O-CB 3.45Å; S543-N547 PolarHBondContact O-ND2 3.49Å
544	G	48.2	Very low	59.2	Low	49 Å²	49	97.3 Å²	97.3	51%	0.505	54%	0.535	S	S	.	.			trans	73.6	142.8	161	0	0	0	0	0	117.8	L546 N547	G544-L546 VanDerWaalsContact C-N 3.25Å; G544-L546 PolarHBondContact O-N 3.26Å; G544-L546 VanDerWaalsContact O-N 3.1Å; G544-N547 PolarHBondContact O-N 3.41Å
545	F	60.6	Low	57.8	Low	176 Å²	176	94.3 Å²	94.3	77%	0.772	53%	0.534	S	S	*	.	H	α-helix	trans	-51.2	-33.7	-178.3	177.4	-102.7	0	0	0	115.2	G548 L549	F545-G548 PolarHBondContact O-N 3.27Å; F545-L549 PolarHBondContact O-N 3.32Å
546	L	56.1	Low	57	Low	128 Å²	128	94.9 Å²	94.9	67%	0.67	55%	0.551	S	S	*	*	H	α-helix	trans	-71.1	-31.2	-177.6	-68.5	174.9	0	0	0	113.5	G544 L549 L550	G544-L546 VanDerWaalsContact C-N 3.25Å; G544-L546 PolarHBondContact O-N 3.26Å; G544-L546 VanDerWaalsContact O-N 3.1Å; L546-L549 PolarHBondContact O-N 3.4Å; L546-L550 PolarHBondContact O-N 3.48Å
547	N	54.6	Low	55.9	Low	73 Å²	73	95.3 Å²	95.3	39%	0.39	56%	0.56	S	S	.	*	H	α-helix	trans	-74.8	-30.1	177.4	-74.4	-21.3	0	0	0	112.2	S543 G544 L549 S551	S543-N547 WeakPolarHBondContact O-CB 3.45Å; S543-N547 PolarHBondContact O-ND2 3.49Å; G544-N547 PolarHBondContact O-N 3.41Å; N547-L549 VanDerWaalsContact C-N 3.34Å; N547-S551 WeakPolarHBondContact O-CB 3.46Å; N547-S551 PolarHBondContact O-N 2.85Å; N547-S551 PolarHBondContact O-OG 3.29Å
548	G	55.1	Low	54.6	Low	39 Å²	39	88.5 Å²	88.5	40%	0.402	54%	0.54	S	S	.	.	H	α-helix	trans	-66.2	-34.5	172.9	0	0	0	0	0	113.2	F545 S551	F545-G548 PolarHBondContact O-N 3.27Å; G548-S551 PolarHBondContact O-OG 2.97Å; G548-S551 VanDerWaalsContact O-OG 3.13Å
549	L	61.4	Low	53.4	Low	87 Å²	87	87.5 Å²	87.5	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-72.9	-46.7	177.9	-164.5	115.5	0	0	0	111.4	F545 L546 N547 S551 S552 F553	F545-L549 PolarHBondContact O-N 3.32Å; L546-L549 PolarHBondContact O-N 3.4Å; N547-L549 VanDerWaalsContact C-N 3.34Å; L549-S551 PolarHBondContact O-N 3.43Å; L549-S552 PolarHBondContact O-N 3.35Å; L549-S552 PolarHBondContact O-OG 3.06Å; L549-F553 HydrophobicContact CD2-CE2 3.89Å; L549-F553 HydrophobicContact CG-CE2 4.03Å; L549-F553 WeakPolarHBondContact O-CD2 3.34Å
550	L	55.3	Low	51.8	Low	112 Å²	112	87.2 Å²	87.2	59%	0.586	53%	0.532	S	S	*	.	H	α-helix	trans	-65.6	-35.9	-178.9	-68.3	175	0	0	0	113.1	L546 S552 F553	L546-L550 PolarHBondContact O-N 3.48Å; L550-S552 VanDerWaalsContact C-N 3.27Å; L550-S552 PolarHBondContact O-N 2.83Å; L550-F553 PolarHBondContact O-N 3.09Å
551	S	51.8	Low	51.1	Low	51 Å²	51	86.1 Å²	86.1	36%	0.357	54%	0.536	S	S	.	.	H	α-helix	trans	-68.8	-21.8	176.9	52.3	0	0	0	0	114	N547 G548 L549 F553	N547-S551 WeakPolarHBondContact O-CB 3.46Å; N547-S551 PolarHBondContact O-N 2.85Å; N547-S551 PolarHBondContact O-OG 3.29Å; G548-S551 PolarHBondContact O-OG 2.97Å; G548-S551 VanDerWaalsContact O-OG 3.13Å; L549-S551 PolarHBondContact O-N 3.43Å; S551-F553 VanDerWaalsContact C-N 3.32Å
552	S	60.7	Low	49.9	Very low	86 Å²	86	90.3 Å²	90.3	60%	0.601	54%	0.543	S	S	*	.	H	α-helix	trans	-75.2	-20.9	174.7	75.1	0	0	0	0	113.7	L549 L550	L549-S552 PolarHBondContact O-N 3.35Å; L549-S552 PolarHBondContact O-OG 3.06Å; L550-S552 VanDerWaalsContact C-N 3.27Å; L550-S552 PolarHBondContact O-N 2.83Å
553	F	51.2	Low	49.1	Very low	152 Å²	152	92 Å²	92	67%	0.667	53%	0.534	S	S	*	.	H	α-helix	trans	-92.7	-10.1	-179.8	-72.5	-70	0	0	0	113.8	L549 L550 S551 P555	L549-F553 HydrophobicContact CD2-CE2 3.89Å; L549-F553 HydrophobicContact CG-CE2 4.03Å; L549-F553 WeakPolarHBondContact O-CD2 3.34Å; L550-F553 PolarHBondContact O-N 3.09Å; S551-F553 VanDerWaalsContact C-N 3.32Å; F553-P555 VanDerWaalsContact O-CD 3.3Å; F553-P555 WeakPolarHBondContact O-CD 3.32Å
554	L	50.8	Low	48.4	Very low	105 Å²	105	92 Å²	92	55%	0.55	54%	0.538	S	S	.	.	S	Bend	trans	-76.9	117.6	177.2	-69.4	174.5	0	0	0	109.9
555	P	43.1	Very low	47.5	Very low	79 Å²	79	96.2 Å²	96.2	51%	0.513	55%	0.549	S	S	.	.			trans	-60.7	143.1	177.3	-19.9	32	0	0	0	110.7	F553 S557 S558	F553-P555 VanDerWaalsContact O-CD 3.3Å; F553-P555 WeakPolarHBondContact O-CD 3.32Å; P555-S557 PolarHBondContact O-N 3.35Å; P555-S558 PolarHBondContact O-N 3.46Å; P555-S558 PolarHBondContact O-OG 3.19Å
556	S	52.8	Low	46.2	Very low	94 Å²	94	96.3 Å²	96.3	66%	0.657	55%	0.551	S	S	*	*	H	α-helix	trans	-52.9	-21.5	-176.5	50.1	0	0	0	0	115.3
557	S	46.3	Very low	44.7	Very low	78 Å²	78	92.4 Å²	92.4	55%	0.545	54%	0.541	S	S	.	.	H	α-helix	trans	-77.6	-26.5	175.6	42.1	0	0	0	0	114.2	P555 N560 A561	P555-S557 PolarHBondContact O-N 3.35Å; S557-N560 PolarHBondContact O-N 3.23Å; S557-A561 PolarHBondContact O-N 3.45Å
558	S	42.8	Very low	43.5	Very low	39 Å²	39	95.2 Å²	95.2	27%	0.273	56%	0.564	S	S	.	*	H	α-helix	trans	-72.3	-33.3	-175.8	54.1	0	0	0	0	113.3	P555 N560 A561 E562	P555-S558 PolarHBondContact O-N 3.46Å; P555-S558 PolarHBondContact O-OG 3.19Å; S558-N560 VanDerWaalsContact C-N 3.27Å; S558-N560 PolarHBondContact O-N 3.01Å; S558-A561 PolarHBondContact O-N 3.22Å; S558-E562 PolarHBondContact O-N 2.92Å
559	I	45.7	Very low	42	Very low	86 Å²	86	99.6 Å²	99.6	44%	0.441	59%	0.588	S	S	.	*	H	α-helix	trans	-65.2	-33.9	172.4	-63.3	170.7	0	0	0	111.1
560	N	37.1	Very low	40.2	Very low	102 Å²	102	99.2 Å²	99.2	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-75.8	-32.1	174.9	-69.9	-6.9	0	0	0	111.9	S557 S558 L563 A564	S557-N560 PolarHBondContact O-N 3.23Å; S558-N560 VanDerWaalsContact C-N 3.27Å; S558-N560 PolarHBondContact O-N 3.01Å; N560-L563 PolarHBondContact O-N 2.79Å; N560-A564 VanDerWaalsContact O-CB 3.31Å; N560-A564 WeakPolarHBondContact O-CB 3.46Å; N560-A564 PolarHBondContact O-N 3.02Å
561	A	37.8	Very low	38.9	Very low	58 Å²	58	98.5 Å²	98.5	48%	0.479	62%	0.615	S	S	.	*	H	α-helix	trans	-68.6	-37.2	-179.7	0	0	0	0	0	112.7	S557 S558 L563 A564	S557-A561 PolarHBondContact O-N 3.45Å; S558-A561 PolarHBondContact O-N 3.22Å; A561-L563 VanDerWaalsContact C-N 3.31Å; A561-L563 PolarHBondContact O-N 3.18Å; A561-A564 PolarHBondContact O-N 3.28Å
562	E	33.2	Very low	37.7	Very low	161 Å²	161	101.7 Å²	101.7	75%	0.752	64%	0.635	S	S	*	*	H	α-helix	trans	-72.7	-26.1	178	-159.8	157.2	-171.9	0	0	112.3	S558	S558-E562 PolarHBondContact O-N 2.92Å
563	L	38.3	Very low	35.9	Very low	107 Å²	107	104.7 Å²	104.7	56%	0.56	65%	0.649	S	S	*	*	H	α-helix	trans	-81.3	-24.9	171.5	-69.5	168.7	0	0	0	113.1	N560 A561 L565	N560-L563 PolarHBondContact O-N 2.79Å; A561-L563 VanDerWaalsContact C-N 3.31Å; A561-L563 PolarHBondContact O-N 3.18Å; L563-L565 VanDerWaalsContact C-N 3.31Å; L563-L565 PolarHBondContact O-N 2.7Å
564	A	33.1	Very low	34.8	Very low	70 Å²	70	103.9 Å²	103.9	58%	0.579	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-6.3	-179.7	0	0	0	0	0	114.2	N560 A561 H566	N560-A564 VanDerWaalsContact O-CB 3.31Å; N560-A564 WeakPolarHBondContact O-CB 3.46Å; N560-A564 PolarHBondContact O-N 3.02Å; A561-A564 PolarHBondContact O-N 3.28Å; A564-H566 PolarHBondContact O-N 3.44Å
565	L	29.8	Very low	33.6	Very low	138 Å²	138	106.4 Å²	106.4	72%	0.723	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-6.7	178	-89.5	156.7	0	0	0	114.1	L563	L563-L565 VanDerWaalsContact C-N 3.31Å; L563-L565 PolarHBondContact O-N 2.7Å
566	H	32.5	Very low	32.7	Very low	178 Å²	178	110.9 Å²	110.9	82%	0.824	69%	0.685	S	S	*	*	S	Bend	trans	-115	65.5	170.6	-69.2	-70.8	0	0	0	111	A564	A564-H566 PolarHBondContact O-N 3.44Å
567	G	25.1	Very low	31.4	Very low	45 Å²	45	114.3 Å²	114.3	46%	0.464	70%	0.696	S	S	.	*	S	Bend	trans	-144.9	136	166.6	0	0	0	0	0	109.7	S569	G567-S569 PolarHBondContact O-N 2.7Å; G567-S569 VanDerWaalsContact O-N 3.09Å
568	P	30.6	Very low	30.5	Very low	133 Å²	133	114.4 Å²	114.4	86%	0.864	70%	0.701	S	S	*	*			trans	-66.6	113.6	-178.9	24.6	-30	0	0	0	110.3	G570	P568-G570 PolarHBondContact O-N 3.23Å
569	S	23.1	Very low	29.8	Very low	131 Å²	131	119.1 Å²	119.1	92%	0.916	73%	0.734	S	S	*	*			trans	-58.7	118.6	170.9	-71.4	0	0	0	0	111	G567	G567-S569 PolarHBondContact O-N 2.7Å; G567-S569 VanDerWaalsContact O-N 3.09Å
570	G	23.3	Very low	29	Very low	78 Å²	78	117.3 Å²	117.3	80%	0.804	74%	0.736	S	S	*	*			trans	136.9	85.5	162.4	0	0	0	0	0	114.2	P568	P568-G570 PolarHBondContact O-N 3.23Å
571	A	27	Very low	28.8	Very low	97 Å²	97	117.8 Å²	117.8	80%	0.802	75%	0.748	S	S	*	*			trans	-136.2	126.8	158.8	0	0	0	0	0	109.4
572	P	26.7	Very low	28.7	Very low	118 Å²	118	121.3 Å²	121.3	77%	0.766	76%	0.757	S	S	*	*			trans	-80.6	153	-174.4	32	-33.3	0	0	0	112.4	V574	P572-V574 PolarHBondContact O-N 3.44Å
573	T	23	Very low	28.5	Very low	149 Å²	149	116 Å²	116	91%	0.914	75%	0.746	S	S	*	*			trans	-53.9	114.1	178.4	49.8	0	0	0	0	112.1
574	V	28.1	Very low	27.9	Very low	135 Å²	135	113.6 Å²	113.6	82%	0.818	75%	0.747	S	S	*	*			trans	-98.9	128.1	170.3	178.6	0	0	0	0	109.3	P572	P572-V574 PolarHBondContact O-N 3.44Å
575	N	26.1	Very low	28	Very low	158 Å²	158	115.8 Å²	115.8	85%	0.845	75%	0.748	S	S	*	*			trans	-66.7	129.9	-171.7	-146	1.3	0	0	0	111.8	N577	N575-N577 PolarHBondContact O-N 3.42Å
576	E	24.4	Very low	28.3	Very low	173 Å²	173	112.8 Å²	112.8	81%	0.808	74%	0.735	S	S	*	*	S	Bend	trans	-67.2	110.5	172.7	-66.3	179.1	151.9	0	0	109.1
577	N	25	Very low	28.5	Very low	167 Å²	167	114.2 Å²	114.2	89%	0.893	73%	0.733	S	S	*	*			trans	170.1	85.9	147.9	-85.1	-27.8	0	0	0	110.6	N575	N575-N577 PolarHBondContact O-N 3.42Å
578	A	29	Very low	29.3	Very low	79 Å²	79	116.3 Å²	116.3	65%	0.653	75%	0.746	S	S	*	*			trans	-157.3	89.3	159.3	0	0	0	0	0	110.3	G580	A578-G580 VanDerWaalsContact C-N 3.27Å; A578-G580 PolarHBondContact O-N 3.23Å
579	S	26.4	Very low	30	Very low	139 Å²	139	112.6 Å²	112.6	97%	0.972	73%	0.726	S	S	*	*			trans	-71.9	85.7	163.8	66.3	0	0	0	0	108.7
580	G	29.2	Very low	31.2	Very low	47 Å²	47	106.9 Å²	106.9	49%	0.485	69%	0.687	S	S	.	*			trans	-139.1	131.9	174.8	0	0	0	0	0	109.3	A578 I582	A578-G580 VanDerWaalsContact C-N 3.27Å; A578-G580 PolarHBondContact O-N 3.23Å; G580-I582 PolarHBondContact O-N 3.35Å
581	S	33.8	Very low	32.7	Very low	112 Å²	112	105.6 Å²	105.6	78%	0.783	67%	0.674	S	S	*	*			trans	-44	134	-179.8	-178.8	0	0	0	0	112.4	G583 G584	S581-G583 PolarHBondContact O-N 2.9Å; S581-G584 PolarHBondContact O-N 3.27Å; S581-G584 VanDerWaalsContact O-N 3.09Å
582	I	36	Very low	34.8	Very low	133 Å²	133	105.4 Å²	105.4	68%	0.682	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.7	-27.9	-172.5	-66.1	172	0	0	0	113.1	G580 G584 V586	G580-I582 PolarHBondContact O-N 3.35Å; I582-G584 VanDerWaalsContact C-N 3.29Å; I582-G584 PolarHBondContact O-N 3.18Å; I582-V586 HydrophobicContact CG2-CG2 4.05Å; I582-V586 WeakPolarHBondContact O-CG2 3.43Å
583	G	29.2	Very low	36.8	Very low	50 Å²	50	99.8 Å²	99.8	52%	0.515	63%	0.627	S	S	.	*	H	α-helix	trans	-63.4	-24.3	-179.9	0	0	0	0	0	116	S581	S581-G583 PolarHBondContact O-N 2.9Å
584	G	25.7	Very low	39.1	Very low	56 Å²	56	93.3 Å²	93.3	58%	0.577	59%	0.587	S	S	*	*	H	α-helix	trans	-82.1	-45.2	-175.4	0	0	0	0	0	114.4	S581 I582 R587	S581-G584 PolarHBondContact O-N 3.27Å; S581-G584 VanDerWaalsContact O-N 3.09Å; I582-G584 VanDerWaalsContact C-N 3.29Å; I582-G584 PolarHBondContact O-N 3.18Å; G584-R587 PolarHBondContact O-N 3.41Å
585	I	35.1	Very low	41.3	Very low	116 Å²	116	89.5 Å²	89.5	60%	0.595	57%	0.57	S	S	*	*	H	α-helix	trans	-73.4	-31.1	-177.8	-66.7	166.7	0	0	0	110.8	R587	I585-R587 VanDerWaalsContact C-N 3.31Å; I585-R587 PolarHBondContact O-N 2.98Å
586	V	35.5	Very low	43.5	Very low	75 Å²	75	84.4 Å²	84.4	46%	0.455	54%	0.544	S	S	.	.	H	α-helix	trans	-62.7	-35.3	176.8	172.4	0	0	0	0	111.5	I582 A588 A590	I582-V586 HydrophobicContact CG2-CG2 4.05Å; I582-V586 WeakPolarHBondContact O-CG2 3.43Å; V586-A588 PolarHBondContact O-N 2.85Å; V586-A590 HydrophobicContact CG1-CB 4.4Å; V586-A590 WeakPolarHBondContact O-CA 3.37Å; V586-A590 WeakPolarHBondContact O-CB 3.5Å; V586-A590 PolarHBondContact O-N 2.65Å
587	R	35.8	Very low	46	Very low	207 Å²	207	76.2 Å²	76.2	78%	0.781	51%	0.506	S	S	*	.	H	α-helix	trans	-69	-37.6	-168.6	-163	177.5	-68.4	169.1	-3.1	115.1	G584 I585	G584-R587 PolarHBondContact O-N 3.41Å; I585-R587 VanDerWaalsContact C-N 3.31Å; I585-R587 PolarHBondContact O-N 2.98Å
588	A	41.9	Very low	48.6	Very low	90 Å²	90	74.2 Å²	74.2	74%	0.744	49%	0.486	S	S	*	.	H	α-helix	trans	-80.4	-38.4	-179.8	0	0	0	0	0	112.6	V586 A590	V586-A588 PolarHBondContact O-N 2.85Å; A588-A590 VanDerWaalsContact C-N 3.25Å; A588-A590 PolarHBondContact O-N 3.3Å
589	A	46.2	Very low	51	Low	54 Å²	54	75.9 Å²	75.9	45%	0.446	48%	0.481	S	S	.	.	H	α-helix	trans	-72.6	-18.7	170.7	0	0	0	0	0	112.7	T592 F593	A589-T592 PolarHBondContact O-OG1 3.41Å; A589-F593 WeakPolarHBondContact O-CB 3.12Å; A589-F593 PolarHBondContact O-N 3.25Å
590	A	48.9	Very low	53.3	Low	11 Å²	11	70 Å²	70	9%	0.091	44%	0.439	C	S	.	.	H	α-helix	trans	-71.6	-37.4	179.9	0	0	0	0	0	113.4	Q225 V586 A588 T592 F593 S594	Q225-A590 HydrophobicContact CG-CB 4.29Å; Q225-A590 VanDerWaalsContact NE2-CB 3.26Å; V586-A590 HydrophobicContact CG1-CB 4.4Å; V586-A590 WeakPolarHBondContact O-CA 3.37Å; V586-A590 WeakPolarHBondContact O-CB 3.5Å; V586-A590 PolarHBondContact O-N 2.65Å; A588-A590 VanDerWaalsContact C-N 3.25Å; A588-A590 PolarHBondContact O-N 3.3Å; A590-T592 PolarHBondContact O-N 3.34Å; A590-F593 PolarHBondContact O-N 3.2Å; A590-S594 WeakPolarHBondContact O-CB 3.41Å; A590-S594 PolarHBondContact O-N 3.1Å
591	G	53.6	Low	55.7	Low	51 Å²	51	68.9 Å²	68.9	53%	0.526	42%	0.422	S	S	.	.	H	α-helix	trans	-62.6	-43.7	-179.2	0	0	0	0	0	112.1	A595	G591-A595 PolarHBondContact O-N 3.49Å
592	T	70.5	Confident	57.9	Low	93 Å²	93	69.6 Å²	69.6	57%	0.571	41%	0.412	S	S	*	.	H	α-helix	trans	-66.3	-43.3	173.4	45.5	0	0	0	0	111.3	A589 A590 A595 T596	A589-T592 PolarHBondContact O-OG1 3.41Å; A590-T592 PolarHBondContact O-N 3.34Å; T592-A595 PolarHBondContact O-N 2.86Å; T592-T596 PolarHBondContact O-N 2.9Å; T592-T596 PolarHBondContact O-OG1 2.95Å
593	F	68.8	Low	59.8	Low	1 Å²	1	67.6 Å²	67.6	0%	0.004	40%	0.401	C	S	.	.	H	α-helix	trans	-62.1	-45.5	178.8	174.5	-111	0	0	0	113.8	P198 N199 L218 I221 M222 A589 A590 A595 T596 L597	P198-F593 HydrophobicContact CB-CD1 4.06Å; P198-F593 HydrophobicContact CB-CD2 3.7Å; P198-F593 HydrophobicContact CB-CE1 3.89Å; P198-F593 HydrophobicContact CB-CE2 3.57Å; P198-F593 HydrophobicContact CB-CG 3.94Å; P198-F593 HydrophobicContact CB-CZ 3.65Å; P198-F593 HydrophobicContact CG-CB 4.26Å; P198-F593 HydrophobicContact CG-CD1 4.18Å; P198-F593 HydrophobicContact CG-CD2 3.76Å; P198-F593 HydrophobicContact CG-CE2 4.18Å; P198-F593 HydrophobicContact CG-CG 3.77Å; P198-F593 WeakPolarHBondContact O-CE2 3.47Å; N199-F593 WeakPolarHBondContact OD1-CD2 3.34Å; L218-F593 HydrophobicContact CD2-CE1 4.35Å; L218-F593 HydrophobicContact CD2-CE2 4.36Å; L218-F593 HydrophobicContact CD2-CZ 3.5Å; L218-F593 VanDerWaalsContact CD2-CZ 3.5Å; I221-F593 HydrophobicContact CB-CE1 4.46Å; I221-F593 HydrophobicContact CG2-CD1 4.12Å; I221-F593 HydrophobicContact CG2-CE1 3.62Å; M222-F593 HydrophobicContact CE-CD1 3.72Å; M222-F593 HydrophobicContact CE-CE1 3.3Å; M222-F593 HydrophobicContact CE-CZ 4.28Å; A589-F593 WeakPolarHBondContact O-CB 3.12Å; A589-F593 PolarHBondContact O-N 3.25Å; A590-F593 PolarHBondContact O-N 3.2Å; F593-A595 VanDerWaalsContact C-N 3.29Å; F593-A595 PolarHBondContact O-N 3.41Å; F593-T596 PolarHBondContact O-N 3.23Å; F593-L597 HydrophobicContact CZ-CB 4.47Å; F593-L597 HydrophobicContact CZ-CD2 4.37Å; F593-L597 PolarHBondContact O-N 3.16Å
594	S	71.1	Confident	62.1	Low	13 Å²	13	66 Å²	66	9%	0.091	38%	0.381	C	S	.	.	H	α-helix	trans	-58.7	-43.3	177.4	-176.5	0	0	0	0	111.2	A590 L597 R598	A590-S594 WeakPolarHBondContact O-CB 3.41Å; A590-S594 PolarHBondContact O-N 3.1Å; S594-L597 PolarHBondContact O-N 3.18Å; S594-R598 WeakPolarHBondContact O-CG 3.46Å; S594-R598 PolarHBondContact O-N 3.06Å
595	A	74.5	Confident	64.4	Low	55 Å²	55	64.2 Å²	64.2	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-63.1	-44.9	175.1	0	0	0	0	0	111.9	G591 T592 F593 L597 R598 Q599	G591-A595 PolarHBondContact O-N 3.49Å; T592-A595 PolarHBondContact O-N 2.86Å; F593-A595 VanDerWaalsContact C-N 3.29Å; F593-A595 PolarHBondContact O-N 3.41Å; A595-L597 PolarHBondContact O-N 3.18Å; A595-R598 PolarHBondContact O-N 2.72Å; A595-Q599 PolarHBondContact O-N 3.01Å
596	T	73.7	Confident	66	Low	50 Å²	50	62.2 Å²	62.2	31%	0.307	35%	0.348	S	S	.	.	H	α-helix	trans	-60.2	-43.8	175.7	-57.9	0	0	0	0	111.9	T592 F593 Q599 V600	T592-T596 PolarHBondContact O-N 2.9Å; T592-T596 PolarHBondContact O-OG1 2.95Å; F593-T596 PolarHBondContact O-N 3.23Å; T596-Q599 PolarHBondContact O-N 3.5Å; T596-V600 WeakPolarHBondContact O-CG2 3.31Å; T596-V600 PolarHBondContact O-N 2.99Å
597	L	75.4	Confident	67.5	Low	1 Å²	1	66 Å²	66	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-39.8	178.4	-176.5	62.6	0	0	0	111.8	L205 L218 M222 L234 F593 S594 A595 Q599 V600 L601	L205-L597 HydrophobicContact CD2-CD1 4.15Å; L218-L597 HydrophobicContact CB-CD2 4.45Å; L218-L597 HydrophobicContact CD1-CD1 4.18Å; L218-L597 HydrophobicContact CD2-CD1 4.48Å; L218-L597 HydrophobicContact CD2-CD2 4.3Å; M222-L597 HydrophobicContact CE-CD2 3.7Å; M222-L597 HydrophobicContact CG-CD2 3.7Å; M222-L597 HydrophobicContact SD-CD2 3.67Å; L234-L597 HydrophobicContact CD1-CD2 4.22Å; F593-L597 HydrophobicContact CZ-CB 4.47Å; F593-L597 HydrophobicContact CZ-CD2 4.37Å; F593-L597 PolarHBondContact O-N 3.16Å; S594-L597 PolarHBondContact O-N 3.18Å; A595-L597 PolarHBondContact O-N 3.18Å; L597-Q599 VanDerWaalsContact C-N 3.34Å; L597-V600 WeakPolarHBondContact O-CB 3.44Å; L597-V600 PolarHBondContact O-N 3.29Å; L597-L601 HydrophobicContact CD1-CG 4.47Å; L597-L601 HydrophobicContact CG-CD1 4.36Å; L597-L601 HydrophobicContact CG-CG 4.48Å; L597-L601 VanDerWaalsContact O-CG 3.32Å; L597-L601 WeakPolarHBondContact O-CG 3.49Å; L597-L601 PolarHBondContact O-N 3.21Å
598	R	79.9	Confident	68.4	Low	125 Å²	125	59.7 Å²	59.7	47%	0.472	34%	0.338	S	S	.	.	H	α-helix	trans	-61.8	-43.1	174	-73.9	-171.5	-167.2	128	-2.6	111.7	D227 V230 S594 A595 V600 L601 E602	D227-R598 IonicContact OD2-CZ 3.7Å; D227-R598 VanDerWaalsContact OD2-CZ 3.28Å; D227-R598 IonicContact OD2-NE 2.81Å; D227-R598 PolarHBondContact OD2-NE 3.07Å; D227-R598 VanDerWaalsContact OD2-NE 3.14Å; D227-R598 IonicContact OD2-NH2 2.76Å; D227-R598 PolarHBondContact OD2-NH2 2.97Å; V230-R598 HydrophobicContact CG2-CG 4.49Å; S594-R598 WeakPolarHBondContact O-CG 3.46Å; S594-R598 PolarHBondContact O-N 3.06Å; A595-R598 PolarHBondContact O-N 2.72Å; R598-V600 VanDerWaalsContact C-N 3.33Å; R598-V600 PolarHBondContact O-N 2.83Å; R598-L601 PolarHBondContact O-N 3.4Å; R598-E602 WeakPolarHBondContact O-CB 3.19Å; R598-E602 PolarHBondContact O-N 3.35Å
599	Q	79.2	Confident	68.8	Low	115 Å²	115	59.5 Å²	59.5	54%	0.537	33%	0.328	S	S	.	.	H	α-helix	trans	-60.1	-44.6	174.7	-174.7	-179	3.2	0	0	111.2	A595 T596 L597 L601 E602 M603	A595-Q599 PolarHBondContact O-N 3.01Å; T596-Q599 PolarHBondContact O-N 3.5Å; L597-Q599 VanDerWaalsContact C-N 3.34Å; Q599-L601 VanDerWaalsContact C-N 3.35Å; Q599-L601 PolarHBondContact O-N 2.94Å; Q599-E602 PolarHBondContact O-N 2.9Å; Q599-M603 HydrophobicContact CG-SD 4.18Å; Q599-M603 VanDerWaalsContact O-CG 3.23Å; Q599-M603 WeakPolarHBondContact O-CG 3.36Å; Q599-M603 PolarHBondContact O-N 3.48Å
600	V	76.2	Confident	68.5	Low	16 Å²	16	59.9 Å²	59.9	10%	0.097	34%	0.337	C	S	.	.	H	α-helix	trans	-58	-46.7	173.8	162.4	0	0	0	0	111	Y206 T596 L597 R598 E602 M603 I604	Y206-V600 HydrophobicContact CD2-CG1 4.11Å; Y206-V600 HydrophobicContact CD2-CG2 4.48Å; Y206-V600 HydrophobicContact CG-CG1 4.42Å; T596-V600 WeakPolarHBondContact O-CG2 3.31Å; T596-V600 PolarHBondContact O-N 2.99Å; L597-V600 WeakPolarHBondContact O-CB 3.44Å; L597-V600 PolarHBondContact O-N 3.29Å; R598-V600 VanDerWaalsContact C-N 3.33Å; R598-V600 PolarHBondContact O-N 2.83Å; V600-E602 PolarHBondContact O-N 3.47Å; V600-M603 PolarHBondContact O-N 3.18Å; V600-I604 HydrophobicContact CG1-CD1 3.71Å; V600-I604 WeakPolarHBondContact O-CD1 3.37Å; V600-I604 WeakPolarHBondContact O-CG1 3.3Å; V600-I604 PolarHBondContact O-N 2.97Å
601	L	79.6	Confident	67.9	Low	23 Å²	23	66.5 Å²	66.5	12%	0.12	37%	0.37	C	S	.	.	H	α-helix	trans	-66.3	-35.6	178.9	-70.1	177.8	0	0	0	113.1	L205 V230 L234 L597 R598 Q599 I604 D605	L205-L601 HydrophobicContact CD2-CD2 4.2Å; V230-L601 HydrophobicContact CG1-CD1 3.46Å; V230-L601 VanDerWaalsContact CG1-CD1 3.46Å; L234-L601 HydrophobicContact CD2-CD1 4.48Å; L234-L601 HydrophobicContact CD2-CD2 4.06Å; L597-L601 HydrophobicContact CD1-CG 4.47Å; L597-L601 HydrophobicContact CG-CD1 4.36Å; L597-L601 HydrophobicContact CG-CG 4.48Å; L597-L601 VanDerWaalsContact O-CG 3.32Å; L597-L601 WeakPolarHBondContact O-CG 3.49Å; L597-L601 PolarHBondContact O-N 3.21Å; R598-L601 PolarHBondContact O-N 3.4Å; Q599-L601 VanDerWaalsContact C-N 3.35Å; Q599-L601 PolarHBondContact O-N 2.94Å; L601-I604 HydrophobicContact CD2-CD1 4.49Å; L601-I604 PolarHBondContact O-N 2.91Å; L601-D605 PolarHBondContact O-N 3.34Å; L601-D605 VanDerWaalsContact O-N 3.09Å
602	E	79.8	Confident	66.8	Low	126 Å²	126	72.5 Å²	72.5	59%	0.589	39%	0.385	S	S	*	.	H	α-helix	trans	-68.6	-38.9	175.4	-175	175.5	-169.5	0	0	111.7	R598 Q599 V600 I604 D605 T608	R598-E602 WeakPolarHBondContact O-CB 3.19Å; R598-E602 PolarHBondContact O-N 3.35Å; Q599-E602 PolarHBondContact O-N 2.9Å; V600-E602 PolarHBondContact O-N 3.47Å; E602-I604 VanDerWaalsContact C-N 3.26Å; E602-I604 PolarHBondContact O-N 2.93Å; E602-D605 WeakPolarHBondContact O-CB 3.47Å; E602-D605 PolarHBondContact O-N 3.03Å; E602-T608 HydrophobicContact CG-CG2 3.98Å; E602-T608 WeakPolarHBondContact O-CG2 3.3Å; E602-T608 PolarHBondContact O-OG1 3.32Å
603	M	75.1	Confident	65	Low	91 Å²	91	74.6 Å²	74.6	45%	0.448	39%	0.392	S	S	.	.	H	α-helix	trans	-68.8	-25.2	174	-67.4	172.7	72.8	0	0	112.9	Y206 Q599 V600	Y206-M603 HydrophobicContact CD2-CB 4.44Å; Y206-M603 HydrophobicContact CE2-CB 3.74Å; Y206-M603 HydrophobicContact CE2-CE 3.67Å; Y206-M603 HydrophobicContact CE2-SD 4.09Å; Y206-M603 VanDerWaalsContact OH-CE 3.31Å; Y206-M603 WeakPolarHBondContact OH-CE 3.19Å; Q599-M603 HydrophobicContact CG-SD 4.18Å; Q599-M603 VanDerWaalsContact O-CG 3.23Å; Q599-M603 WeakPolarHBondContact O-CG 3.36Å; Q599-M603 PolarHBondContact O-N 3.48Å; V600-M603 PolarHBondContact O-N 3.18Å
604	I	77.1	Confident	63.2	Low	16 Å²	16	83.4 Å²	83.4	8%	0.082	43%	0.434	C	S	.	.	H	α-helix	trans	-82.1	-20.5	174.7	-66.2	165.3	0	0	0	111.5	P157 Y206 P209 V600 L601 E602 I606	P157-I604 HydrophobicContact CG-CG2 3.16Å; Y206-I604 HydrophobicContact CD2-CG1 4.19Å; P209-I604 HydrophobicContact CB-CG2 4.09Å; P209-I604 HydrophobicContact CG-CG2 4.04Å; V600-I604 HydrophobicContact CG1-CD1 3.71Å; V600-I604 WeakPolarHBondContact O-CD1 3.37Å; V600-I604 WeakPolarHBondContact O-CG1 3.3Å; V600-I604 PolarHBondContact O-N 2.97Å; L601-I604 HydrophobicContact CD2-CD1 4.49Å; L601-I604 PolarHBondContact O-N 2.91Å; E602-I604 VanDerWaalsContact C-N 3.26Å; E602-I604 PolarHBondContact O-N 2.93Å; I604-I606 PolarHBondContact O-N 3.17Å
605	D	74.6	Confident	61.3	Low	19 Å²	19	90.2 Å²	90.2	10%	0.102	47%	0.469	C	S	.	.			trans	-64.1	118.9	-178.8	-171.4	-19.1	0	0	0	110.4	T155 L601 E602 R607 T608 V609	T155-D605 WeakPolarHBondContact CA-OD1 3.42Å; T155-D605 WeakPolarHBondContact CG2-OD2 3.47Å; T155-D605 WeakPolarHBondContact O-CA 3.48Å; L601-D605 PolarHBondContact O-N 3.34Å; L601-D605 VanDerWaalsContact O-N 3.09Å; E602-D605 WeakPolarHBondContact O-CB 3.47Å; E602-D605 PolarHBondContact O-N 3.03Å; D605-R607 PolarHBondContact O-N 2.83Å; D605-R607 WeakPolarHBondContact OD1-CB 3.49Å; D605-R607 WeakPolarHBondContact OD1-CG 3.37Å; D605-R607 PolarHBondContact OD1-N 2.99Å; D605-R607 IonicContact OD1-NE 3.28Å; D605-R607 PolarHBondContact OD1-NE 3.27Å; D605-R607 IonicContact OD2-CZ 3.44Å; D605-R607 IonicContact OD2-NE 3.18Å; D605-R607 PolarHBondContact OD2-NE 3.26Å; D605-R607 IonicContact OD2-NH2 2.73Å; D605-R607 PolarHBondContact OD2-NH2 3.49Å; D605-T608 HydrophobicContact CB-CG2 4.14Å; D605-T608 PolarHBondContact O-N 2.79Å; D605-T608 PolarHBondContact O-OG1 2.92Å; D605-V609 PolarHBondContact O-N 2.77Å
606	I	68.8	Low	59.3	Low	75 Å²	75	92.1 Å²	92.1	39%	0.385	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.7	-179.5	63	171	0	0	0	113.5	S154 I604 V609	S154-I606 WeakPolarHBondContact O-CD1 3.23Å; S154-I606 WeakPolarHBondContact O-CG1 3.31Å; I604-I606 PolarHBondContact O-N 3.17Å; I606-V609 VanDerWaalsContact O-O 3.11Å
607	R	65.7	Low	57.2	Low	155 Å²	155	97.1 Å²	97.1	59%	0.585	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-22.8	176.2	-59.6	178.6	-59.9	175.4	7.8	112.9	D605	D605-R607 PolarHBondContact O-N 2.83Å; D605-R607 WeakPolarHBondContact OD1-CB 3.49Å; D605-R607 WeakPolarHBondContact OD1-CG 3.37Å; D605-R607 PolarHBondContact OD1-N 2.99Å; D605-R607 IonicContact OD1-NE 3.28Å; D605-R607 PolarHBondContact OD1-NE 3.27Å; D605-R607 IonicContact OD2-CZ 3.44Å; D605-R607 IonicContact OD2-NE 3.18Å; D605-R607 PolarHBondContact OD2-NE 3.26Å; D605-R607 IonicContact OD2-NH2 2.73Å; D605-R607 PolarHBondContact OD2-NH2 3.49Å
608	T	55.7	Low	55.1	Low	73 Å²	73	105.8 Å²	105.8	45%	0.448	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-28.5	177.8	62.6	0	0	0	0	111.1	E602 D605 G610	E602-T608 HydrophobicContact CG-CG2 3.98Å; E602-T608 WeakPolarHBondContact O-CG2 3.3Å; E602-T608 PolarHBondContact O-OG1 3.32Å; D605-T608 HydrophobicContact CB-CG2 4.14Å; D605-T608 PolarHBondContact O-N 2.79Å; D605-T608 PolarHBondContact O-OG1 2.92Å; T608-G610 VanDerWaalsContact C-N 3.33Å; T608-G610 PolarHBondContact O-N 3.19Å
609	V	50.8	Low	52.8	Low	86 Å²	86	106.9 Å²	106.9	52%	0.521	56%	0.559	S	S	.	*	S	Bend	trans	-75.1	89.1	166.2	-173	0	0	0	0	107.5	D605 I606 L611	D605-V609 PolarHBondContact O-N 2.77Å; I606-V609 VanDerWaalsContact O-O 3.11Å; V609-L611 PolarHBondContact O-N 3.29Å
610	G	39.6	Very low	50.5	Low	63 Å²	63	109.6 Å²	109.6	65%	0.649	58%	0.577	S	S	*	*			trans	-50.1	104.7	173.5	0	0	0	0	0	109.6	T608 E612	T608-G610 VanDerWaalsContact C-N 3.33Å; T608-G610 PolarHBondContact O-N 3.19Å; G610-E612 PolarHBondContact O-N 3.19Å
611	L	36.7	Very low	48.6	Very low	149 Å²	149	113.5 Å²	113.5	78%	0.78	61%	0.605	S	S	*	*			trans	-63.9	99.7	158.1	-69.3	173.2	0	0	0	103.8	V609 D613	V609-L611 PolarHBondContact O-N 3.29Å; L611-D613 VanDerWaalsContact C-N 3.3Å; L611-D613 PolarHBondContact O-N 3.09Å
612	E	30.9	Very low	46.3	Very low	177 Å²	177	116.7 Å²	116.7	83%	0.827	63%	0.63	S	S	*	*			trans	-49.7	108.5	158.7	-69	-179.3	165.4	0	0	104.8	G610 E614	G610-E612 PolarHBondContact O-N 3.19Å; E612-E614 VanDerWaalsContact C-N 3.27Å; E612-E614 PolarHBondContact O-N 3.26Å
613	D	31.3	Very low	44.4	Very low	137 Å²	137	118.3 Å²	118.3	73%	0.733	64%	0.642	S	S	*	*			trans	-54.8	99.2	172	-74.6	-44.8	0	0	0	105.9	L611 D615	L611-D613 VanDerWaalsContact C-N 3.3Å; L611-D613 PolarHBondContact O-N 3.09Å; D613-D615 PolarHBondContact O-N 3.32Å
614	E	30.8	Very low	42.3	Very low	187 Å²	187	123.6 Å²	123.6	87%	0.874	67%	0.666	S	S	*	*			trans	-68.3	54.2	164.7	-74.8	-164	158.9	0	0	109.2	E612 S616	E612-E614 VanDerWaalsContact C-N 3.27Å; E612-E614 PolarHBondContact O-N 3.26Å; E614-S616 VanDerWaalsContact C-N 3.34Å
615	D	32.5	Very low	40.3	Very low	155 Å²	155	127.7 Å²	127.7	83%	0.829	70%	0.702	S	S	*	*			trans	-100	19.1	166.3	-89.7	-11.9	0	0	0	110.6	D613	D613-D615 PolarHBondContact O-N 3.32Å
616	S	32.3	Very low	38.8	Very low	95 Å²	95	135.3 Å²	135.3	66%	0.664	77%	0.767	S	S	*	*			trans	-116.9	61.8	171.4	71	0	0	0	0	111.9	E614	E614-S616 VanDerWaalsContact C-N 3.34Å
617	N	29.5	Very low	37.3	Very low	156 Å²	156	138.3 Å²	138.3	83%	0.834	79%	0.787	S	S	*	*			trans	-161.6	54.8	155.9	-96.7	-23.8	0	0	0	112.3
618	H	31.5	Very low	35.8	Very low	182 Å²	182	137.4 Å²	137.4	84%	0.843	80%	0.797	S	S	*	*			trans	-118.7	79.2	157.7	-83.9	-38.9	0	0	0	108.9
619	N	31.4	Very low	34.7	Very low	149 Å²	149	141 Å²	141	80%	0.797	82%	0.817	S	S	*	*			trans	-169.7	75.4	152.7	-92.5	-18.6	0	0	0	108.5
620	N	31	Very low	33.7	Very low	172 Å²	172	144.2 Å²	144.2	92%	0.92	83%	0.834	S	S	*	*			trans	-151.8	66.5	155.5	-95.5	-17.7	0	0	0	107
621	S	35.1	Very low	33.4	Very low	97 Å²	97	149.3 Å²	149.3	68%	0.678	85%	0.846	S	S	*	*			trans	-95.2	113.3	160.7	56.7	0	0	0	0	107.8
622	S	32.8	Very low	33.1	Very low	91 Å²	91	149.3 Å²	149.3	64%	0.636	85%	0.85	S	S	*	*			trans	54.9	113	136.7	54.6	0	0	0	0	118.1
623	D	40	Very low	33.3	Very low	160 Å²	160	147.4 Å²	147.4	86%	0.856	85%	0.852	S	S	*	*				-176.2	85	108.7	-84.5	-17.9	0	0	0	110.4
624	E	31.3	Very low	33.5	Very low	202 Å²	202	148.2 Å²	148.2	94%	0.944	86%	0.861	S	S	*	*			trans	-94.1	104.6	148.2	-89.5	-174.3	152.2	0	0	106.9
625	A	33.9	Very low	33.7	Very low	101 Å²	101	144.9 Å²	144.9	84%	0.835	86%	0.86	S	S	*	*			trans	179.4	89.9	151.5	0	0	0	0	0	111.1
626	A	43	Very low	33.8	Very low	179 Å²	179	144 Å²	144	100%	1.479	86%	0.862	S	S	*	*			trans	-172.4	0	141.5	0	0	0	0	0	109.5

Retrieved 626 of 626 residues in 359.2 ms (Link to these results)

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