A0A060XZS3_ONCMY Loading...

2-methoxy-6-polyprenyl-1,4-benzoquinol methylase, mitochondrial

Methyltransferase required for the conversion of 2-decaprenyl-6-methoxy-1,4-benzoquinol (DDMQH2) to 2-decaprenyl-3-methyl-6-methoxy-1,4-benzoquinol (DMQH2). Methyltransferase required for the conversion of 2-polyprenyl-6-methoxy-1,4-benzoquinol (DDMQH2) to 2-polyprenyl-3-methyl-6-methoxy-1,4-benzoquinol (DMQH2).

AlphaFold DB , UniProt , Accession A0A060XZS3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene coq5, Length 333 aa.

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(Predicted Aligned Error values between residue pairs)

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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	41.4	Very low	39	Very low	212 Å²	212	127.1 Å²	127.1	100%	1.044	66%	0.655	S	S	*	*				0	-42.7	0	-98	-171.8	-88.8	0	0	114.3	A3 S4	M1-A3 PolarHBondContact O-N 3.1Å; M1-S4 PolarHBondContact O-N 2.67Å
2	A	36.9	Very low	39.4	Very low	75 Å²	75	126.3 Å²	126.3	62%	0.62	65%	0.651	S	S	*	*	H	α-helix	trans	-66.9	-27.2	-176.9	0	0	0	0	0	116.2
3	A	33.9	Very low	40	Very low	71 Å²	71	123.5 Å²	123.5	59%	0.587	64%	0.642	S	S	*	*	H	α-helix	trans	-73.3	-33.5	179	0	0	0	0	0	113.3	M1 L7	M1-A3 PolarHBondContact O-N 3.1Å; A3-L7 PolarHBondContact O-N 3.4Å
4	S	36.2	Very low	40	Very low	87 Å²	87	127.6 Å²	127.6	61%	0.608	65%	0.645	S	S	*	*	H	α-helix	trans	-74.2	-29.2	-178	-57.1	0	0	0	0	112.9	M1 L7 L8	M1-S4 PolarHBondContact O-N 2.67Å; S4-L7 PolarHBondContact O-N 2.88Å; S4-L8 PolarHBondContact O-N 3Å
5	I	43.4	Very low	39.7	Very low	121 Å²	121	126.8 Å²	126.8	62%	0.621	64%	0.643	S	S	*	*	H	α-helix	trans	-72	-38	177.1	-61.9	173.3	0	0	0	111	L7 L8 A9	I5-L7 VanDerWaalsContact C-N 3.31Å; I5-L7 PolarHBondContact O-N 3.32Å; I5-L8 PolarHBondContact O-N 2.81Å; I5-A9 PolarHBondContact O-N 3.09Å
6	R	40.6	Very low	39.6	Very low	188 Å²	188	124 Å²	124	71%	0.709	65%	0.646	S	S	*	*	H	α-helix	trans	-63.9	-33.6	175.2	-74.1	-176.5	-177.6	-176.6	0.4	113	R10	R6-R10 WeakPolarHBondContact O-CG 3.41Å; R6-R10 PolarHBondContact O-N 2.78Å
7	L	39.4	Very low	39.5	Very low	118 Å²	118	125.5 Å²	125.5	62%	0.618	65%	0.646	S	S	*	*	H	α-helix	trans	-74.9	-36.2	176.6	-90.6	152.6	0	0	0	112.2	A3 S4 I5 R10 R11	A3-L7 PolarHBondContact O-N 3.4Å; S4-L7 PolarHBondContact O-N 2.88Å; I5-L7 VanDerWaalsContact C-N 3.31Å; I5-L7 PolarHBondContact O-N 3.32Å; L7-R10 PolarHBondContact O-N 2.88Å; L7-R11 PolarHBondContact O-N 2.88Å
8	L	35.8	Very low	39.3	Very low	112 Å²	112	130.8 Å²	130.8	59%	0.586	66%	0.657	S	S	*	*	H	α-helix	trans	-68.5	-42.7	178	-154.2	78.1	0	0	0	111.7	S4 I5 R10 R11 I12	S4-L8 PolarHBondContact O-N 3Å; I5-L8 PolarHBondContact O-N 2.81Å; L8-R10 VanDerWaalsContact C-N 3.32Å; L8-R10 PolarHBondContact O-N 3.11Å; L8-R11 PolarHBondContact O-N 3.3Å; L8-R11 VanDerWaalsContact O-N 3.1Å; L8-I12 PolarHBondContact O-N 2.94Å
9	A	41.3	Very low	39.1	Very low	55 Å²	55	131.2 Å²	131.2	46%	0.455	67%	0.666	S	S	.	*	H	α-helix	trans	-61.7	-37.9	175.6	0	0	0	0	0	112.6	I5 R11 V13	I5-A9 PolarHBondContact O-N 3.09Å; A9-R11 PolarHBondContact O-N 3.06Å; A9-V13 VanDerWaalsContact O-CG2 3.3Å; A9-V13 WeakPolarHBondContact O-CG2 3.01Å; A9-V13 PolarHBondContact O-N 3.29Å
10	R	43.8	Very low	39	Very low	178 Å²	178	130.7 Å²	130.7	67%	0.672	66%	0.664	S	S	*	*	H	α-helix	trans	-67	-21.6	175.7	-76.9	176.5	176.6	-177.5	-0	114	R6 L7 L8	R6-R10 WeakPolarHBondContact O-CG 3.41Å; R6-R10 PolarHBondContact O-N 2.78Å; L7-R10 PolarHBondContact O-N 2.88Å; L8-R10 VanDerWaalsContact C-N 3.32Å; L8-R10 PolarHBondContact O-N 3.11Å
11	R	36.1	Very low	38.8	Very low	181 Å²	181	132.2 Å²	132.2	68%	0.683	67%	0.674	S	S	*	*	H	α-helix	trans	-85.5	-42.5	-178.6	-145.7	172.8	-175.7	173.1	0.4	111	L7 L8 A9 V13 R14	L7-R11 PolarHBondContact O-N 2.88Å; L8-R11 PolarHBondContact O-N 3.3Å; L8-R11 VanDerWaalsContact O-N 3.1Å; A9-R11 PolarHBondContact O-N 3.06Å; R11-V13 VanDerWaalsContact C-N 3.32Å; R11-V13 PolarHBondContact O-N 3.43Å; R11-R14 PolarHBondContact O-N 3.12Å
12	I	44.5	Very low	38.2	Very low	118 Å²	118	127.5 Å²	127.5	61%	0.605	66%	0.662	S	S	*	*	H	α-helix	trans	-64.3	-36.6	177.3	-63.4	171.7	0	0	0	111.6	L8 R14	L8-I12 PolarHBondContact O-N 2.94Å; I12-R14 VanDerWaalsContact C-N 3.29Å; I12-R14 PolarHBondContact O-N 3.31Å
13	V	46.6	Very low	37.9	Very low	89 Å²	89	129.6 Å²	129.6	54%	0.539	67%	0.672	S	S	.	*	H	α-helix	trans	-69	-26	177.3	173.5	0	0	0	0	112.7	A9 R11	A9-V13 VanDerWaalsContact O-CG2 3.3Å; A9-V13 WeakPolarHBondContact O-CG2 3.01Å; A9-V13 PolarHBondContact O-N 3.29Å; R11-V13 VanDerWaalsContact C-N 3.32Å; R11-V13 PolarHBondContact O-N 3.43Å
14	R	39.6	Very low	37.7	Very low	181 Å²	181	132.3 Å²	132.3	68%	0.683	68%	0.681	S	S	*	*	H	α-helix	trans	-77.9	-32.9	-178.1	-161	-177.6	-60.6	174.5	0.4	112.6	R11 I12	R11-R14 PolarHBondContact O-N 3.12Å; I12-R14 VanDerWaalsContact C-N 3.29Å; I12-R14 PolarHBondContact O-N 3.31Å
15	D	35.4	Very low	37.2	Very low	116 Å²	116	134.2 Å²	134.2	62%	0.62	69%	0.694	S	S	*	*	H	α-helix	trans	-81.4	-20.2	-176.3	-70.2	-25.4	0	0	0	112.9	F17	D15-F17 PolarHBondContact O-N 2.84Å
16	A	38.3	Very low	36.5	Very low	82 Å²	82	133.9 Å²	133.9	68%	0.678	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-10.1	175	0	0	0	0	0	114.5
17	F	38.6	Very low	35.7	Very low	150 Å²	150	136.4 Å²	136.4	66%	0.658	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	6.3	-171.4	-99.7	-87.7	0	0	0	115.4	D15	D15-F17 PolarHBondContact O-N 2.84Å
18	R	35.3	Very low	35.1	Very low	221 Å²	221	138.1 Å²	138.1	83%	0.834	72%	0.715	S	S	*	*	S	Bend	trans	-89.5	-0.5	-174.1	-100.3	-178.9	175.5	174	-2.4	116.6
19	T	36.2	Very low	34.7	Very low	137 Å²	137	139 Å²	139	84%	0.84	73%	0.726	S	S	*	*			trans	-119.1	67.5	-176.3	-38.5	0	0	0	0	111.3
20	I	37.8	Very low	34	Very low	121 Å²	121	141.7 Å²	141.7	62%	0.621	74%	0.741	S	S	*	*			trans	-137.8	98	170	-56	176.8	0	0	0	107.7
21	N	33	Very low	33.4	Very low	163 Å²	163	138.6 Å²	138.6	87%	0.872	75%	0.747	S	S	*	*			trans	-177.7	103.8	146.2	-97.3	-14.3	0	0	0	110
22	S	30.1	Very low	33	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	75%	0.754	S	S	*	*			trans	-171.1	123.7	139.2	58.7	0	0	0	0	112.3
23	S	30.2	Very low	32.1	Very low	119 Å²	119	136.2 Å²	136.2	83%	0.832	77%	0.766	S	S	*	*			trans	64.3	103.9	147.7	57.8	0	0	0	0	120.2
24	V	30.6	Very low	31.4	Very low	128 Å²	128	137.8 Å²	137.8	78%	0.776	78%	0.778	S	S	*	*			trans	-88.7	136.3	157	172.1	0	0	0	0	109.2	V26	V24-V26 HydrophobicContact CG1-CG2 3.9Å
25	S	24.9	Very low	31	Very low	127 Å²	127	133.8 Å²	133.8	89%	0.888	78%	0.778	S	S	*	*			trans	-137.5	112.2	156.4	-92.8	0	0	0	0	109.6
26	V	27.9	Very low	30.7	Very low	115 Å²	115	135 Å²	135	70%	0.697	79%	0.785	S	S	*	*			trans	-94.3	130.1	174.2	174.9	0	0	0	0	108	V24 I28	V24-V26 HydrophobicContact CG1-CG2 3.9Å; V26-I28 HydrophobicContact CG1-CG1 4.08Å
27	R	24.6	Very low	30.3	Very low	240 Å²	240	138.5 Å²	138.5	91%	0.906	79%	0.791	S	S	*	*			trans	-113.6	117.5	163.1	-84.1	-174	175.5	-173.5	-1	108.3
28	I	25.8	Very low	30	Very low	154 Å²	154	136.7 Å²	136.7	79%	0.79	80%	0.797	S	S	*	*			trans	-85.8	128.9	172.3	-62.6	171.9	0	0	0	107.5	V26	V26-I28 HydrophobicContact CG1-CG1 4.08Å
29	V	27.9	Very low	29.7	Very low	132 Å²	132	130.4 Å²	130.4	80%	0.8	79%	0.792	S	S	*	*			trans	-122.8	115.2	166	-176.3	0	0	0	0	107.5
30	S	28	Very low	29.4	Very low	110 Å²	110	130 Å²	130	77%	0.769	79%	0.794	S	S	*	*			trans	-82.9	132.4	171.2	56.4	0	0	0	0	110.1
31	S	29.5	Very low	29	Very low	114 Å²	114	134 Å²	134	80%	0.797	80%	0.801	S	S	*	*			trans	-141.1	128.6	159.3	62.8	0	0	0	0	111.3
32	S	28.8	Very low	28.9	Very low	120 Å²	120	132.5 Å²	132.5	84%	0.839	80%	0.802	S	S	*	*			trans	-73.6	145.2	-172.6	14.8	0	0	0	0	113.9
33	C	26	Very low	28.9	Very low	128 Å²	128	135 Å²	135	87%	0.865	80%	0.799	S	S	*	*			trans	-72	157.5	167.1	-58.4	0	0	0	0	112.2
34	P	31.3	Very low	29.2	Very low	122 Å²	122	134.4 Å²	134.4	79%	0.792	80%	0.795	S	S	*	*			trans	-121.4	136	144	26.7	-10.3	0	0	0	112.4
35	S	30.9	Very low	29.3	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	80%	0.801	S	S	*	*			trans	-64.2	139.8	166.5	48	0	0	0	0	113.1
36	N	28.2	Very low	29.8	Very low	142 Å²	142	133.4 Å²	133.4	76%	0.759	79%	0.79	S	S	*	*				165.6	148.3	111.2	-94.4	-25.9	0	0	0	115.6
37	L	30.1	Very low	30.6	Very low	155 Å²	155	132.7 Å²	132.7	81%	0.812	80%	0.796	S	S	*	*			trans	81.3	94.9	145.7	-72	154.1	0	0	0	120.6
38	S	32.4	Very low	31.6	Very low	113 Å²	113	125.2 Å²	125.2	79%	0.79	79%	0.786	S	S	*	*				40.3	113.2	116	-151.4	0	0	0	0	119.4
39	A	28.8	Very low	33.2	Very low	88 Å²	88	124.3 Å²	124.3	73%	0.727	78%	0.782	S	S	*	*			trans	-148.9	111.6	145	0	0	0	0	0	109.3	R41	A39-R41 PolarHBondContact O-N 3.26Å
40	C	30.9	Very low	35.7	Very low	128 Å²	128	124.8 Å²	124.8	87%	0.865	77%	0.773	S	S	*	*			trans	-51.8	122.8	162.1	-84.8	0	0	0	0	109.4
41	R	29.1	Very low	38.3	Very low	207 Å²	207	123.5 Å²	123.5	78%	0.781	76%	0.764	S	S	*	*			trans	-126.3	106.6	155	-73.6	-172	-174	-175.9	2.7	107.8	A39 F43	A39-R41 PolarHBondContact O-N 3.26Å; R41-F43 HydrophobicContact CB-CD2 4.12Å; R41-F43 PolarHBondContact O-N 3.43Å
42	C	30.6	Very low	41.1	Very low	130 Å²	130	119.1 Å²	119.1	88%	0.878	73%	0.733	S	S	*	*			trans	-56.3	115.4	156.6	-58.4	0	0	0	0	107.2
43	F	30.6	Very low	43.5	Very low	166 Å²	166	117.3 Å²	117.3	73%	0.728	71%	0.711	S	S	*	*			trans	-123.2	122.7	164.9	-106.1	-89.7	0	0	0	107.6	R41 D45	R41-F43 HydrophobicContact CB-CD2 4.12Å; R41-F43 PolarHBondContact O-N 3.43Å; F43-D45 PolarHBondContact O-N 3Å
44	S	35.5	Very low	46.3	Very low	107 Å²	107	112.6 Å²	112.6	75%	0.748	68%	0.676	S	S	*	*			trans	-45.4	118.6	169.7	46.1	0	0	0	0	112	G46	S44-G46 PolarHBondContact O-N 2.91Å
45	D	33.7	Very low	48.9	Very low	171 Å²	171	106.9 Å²	106.9	91%	0.914	64%	0.64	S	S	*	*			trans	-69.3	83.3	163.3	-88.5	-27.1	0	0	0	109.2	F43	F43-D45 PolarHBondContact O-N 3Å
46	G	35.7	Very low	51.5	Low	63 Å²	63	107.2 Å²	107.2	65%	0.649	63%	0.629	S	S	*	*			trans	-78.7	106.2	143	0	0	0	0	0	105.8	S44 A48	S44-G46 PolarHBondContact O-N 2.91Å; G46-A48 PolarHBondContact O-N 3.34Å
47	A	43.2	Very low	54.2	Low	100 Å²	100	105.5 Å²	105.5	83%	0.826	62%	0.617	S	S	*	*			trans	-59.5	91.8	166.2	0	0	0	0	0	107.4	D49	A47-D49 PolarHBondContact O-N 3.23Å; A47-D49 VanDerWaalsContact O-N 3.09Å
48	A	46	Very low	57	Low	83 Å²	83	102.6 Å²	102.6	69%	0.686	61%	0.605	S	S	*	*			trans	-60.1	114.3	166.2	0	0	0	0	0	105.5	G46 K50	G46-A48 PolarHBondContact O-N 3.34Å; A48-K50 VanDerWaalsContact C-N 3.29Å; A48-K50 PolarHBondContact O-N 3.35Å
49	D	59.8	Low	59.6	Low	134 Å²	134	97.6 Å²	97.6	72%	0.717	57%	0.57	S	S	*	*			trans	-60.4	95.5	178.2	-160.7	12	0	0	0	107.4	A47 S51 S60	A47-D49 PolarHBondContact O-N 3.23Å; A47-D49 VanDerWaalsContact O-N 3.09Å; D49-S51 PolarHBondContact O-N 3.22Å; D49-S60 WeakPolarHBondContact OD1-CB 3.43Å
50	K	79.9	Confident	62.7	Low	142 Å²	142	94.8 Å²	94.8	62%	0.617	55%	0.545	S	S	*	.			trans	-68	130.7	-177.1	-65.8	-178.2	-177.3	174.3	0	107.2	A48 E61	A48-K50 VanDerWaalsContact C-N 3.29Å; A48-K50 PolarHBondContact O-N 3.35Å; K50-E61 HydrophobicContact CB-CG 4.25Å; K50-E61 WeakPolarHBondContact CB-OE1 3.45Å; K50-E61 WeakPolarHBondContact O-CG 3.4Å; K50-E61 PolarHBondContact O-N 3.41Å; K50-E61 VanDerWaalsContact O-N 3.14Å
51	S	82.6	Confident	65.4	Low	83 Å²	83	91 Å²	91	58%	0.58	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	148.5	-175.7	59.1	0	0	0	0	111.3	D49 V59	D49-S51 PolarHBondContact O-N 3.22Å; S51-V59 CarbonylContact C-O 3.53Å; S51-V59 VanDerWaalsContact CA-O 3.3Å; S51-V59 WeakPolarHBondContact CA-O 3.44Å
52	T	87.9	Confident	68	Low	23 Å²	23	83.7 Å²	83.7	14%	0.141	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	-176.9	-179.2	-170.4	0	0	0	0	109.7	T58 V59 E61 K64 T229	T52-T58 WeakPolarHBondContact O-CA 3.3Å; T52-V59 HydrophobicContact CG2-CG2 4.2Å; T52-V59 PolarHBondContact N-O 2.89Å; T52-V59 PolarHBondContact O-N 3.43Å; T52-V59 VanDerWaalsContact O-O 3.1Å; T52-E61 HydrophobicContact CG2-CB 4.47Å; T52-E61 HydrophobicContact CG2-CG 4.05Å; T52-K64 HydrophobicContact CG2-CB 3.49Å; T52-K64 VanDerWaalsContact CG2-CB 3.49Å; T52-K64 HydrophobicContact CG2-CD 3.4Å; T52-K64 HydrophobicContact CG2-CG 4.04Å; T52-T229 HydrophobicContact CG2-CG2 4.29Å
53	H	81.3	Confident	70.8	Confident	82 Å²	82	80.9 Å²	80.9	38%	0.38	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.6	-177.3	-64.2	-55.9	0	0	0	112.9	E57 K64	H53-E57 WeakPolarHBondContact CA-O 3.37Å; H53-K64 WeakPolarHBondContact O-CD 3.28Å; H53-K64 WeakPolarHBondContact O-CE 3.45Å
54	F	84.2	Confident	73.5	Confident	28 Å²	28	73.7 Å²	73.7	12%	0.123	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	96.3	162.6	-178.8	-93.5	0	0	0	107.6	F56 E57 V59 R67 V68 V71 Y289	F54-F56 PolarHBondContact O-N 2.86Å; F54-E57 PolarHBondContact N-O 3.2Å; F54-E57 PolarHBondContact O-N 3.02Å; F54-V59 HydrophobicContact CB-CG1 4.29Å; F54-V59 HydrophobicContact CB-CG2 3.78Å; F54-R67 HydrophobicContact CD2-CB 3.73Å; F54-R67 HydrophobicContact CE2-CB 3.53Å; F54-R67 HydrophobicContact CG-CB 4.4Å; F54-R67 HydrophobicContact CZ-CB 4.05Å; F54-V68 HydrophobicContact CD2-CG2 4.07Å; F54-V68 HydrophobicContact CE2-CG2 4.04Å; F54-V71 HydrophobicContact CZ-CG2 4.2Å; F54-Y289 HydrophobicContact CD1-CD2 4.1Å; F54-Y289 AromaticContact CD2-CD2 3.84Å; F54-Y289 HydrophobicContact CD2-CD2 3.84Å; F54-Y289 AromaticContact CD2-CE2 3.53Å; F54-Y289 HydrophobicContact CD2-CE2 3.53Å; F54-Y289 AromaticContact CE1-CD2 3.74Å; F54-Y289 HydrophobicContact CE1-CD2 3.74Å; F54-Y289 HydrophobicContact CE1-CE2 4.43Å; F54-Y289 HydrophobicContact CE1-CG 4.37Å; F54-Y289 AromaticContact CE2-CD2 3.45Å; F54-Y289 HydrophobicContact CE2-CD2 3.45Å; F54-Y289 VanDerWaalsContact CE2-CD2 3.45Å; F54-Y289 AromaticContact CE2-CE2 3.43Å; F54-Y289 HydrophobicContact CE2-CE2 3.43Å; F54-Y289 VanDerWaalsContact CE2-CE2 3.43Å; F54-Y289 HydrophobicContact CE2-CG 4.09Å; F54-Y289 HydrophobicContact CG-CD2 4.15Å; F54-Y289 HydrophobicContact CG-CE2 4.08Å; F54-Y289 AromaticContact CZ-CD2 3.4Å; F54-Y289 HydrophobicContact CZ-CD2 3.4Å; F54-Y289 VanDerWaalsContact CZ-CD2 3.4Å; F54-Y289 AromaticContact CZ-CE2 3.92Å; F54-Y289 HydrophobicContact CZ-CE2 3.92Å; F54-Y289 AromaticContact CZ-CG 3.81Å; F54-Y289 HydrophobicContact CZ-CG 3.81Å
55	G	86	Confident	75.9	Confident	3 Å²	3	70.8 Å²	70.8	3%	0.031	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	-118.3	-170.5	0	0	0	0	0	111.7	E292 K296	G55-E292 VanDerWaalsContact CA-CB 3.42Å; G55-E292 WeakPolarHBondContact CA-OE2 3.48Å; G55-K296 VanDerWaalsContact O-CE 3.32Å; G55-K296 WeakPolarHBondContact O-CE 3.37Å; G55-K296 WeakPolarHBondContact O-CG 3.38Å
56	F	84.9	Confident	78.6	Confident	103 Å²	103	67.8 Å²	67.8	45%	0.452	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-6.3	174.8	-62.3	-25	0	0	0	114.9	F54 E292 R295	F54-F56 PolarHBondContact O-N 2.86Å; F56-E292 HydrophobicContact CD1-CB 4.17Å; F56-E292 HydrophobicContact CD1-CG 4.22Å; F56-E292 HydrophobicContact CD2-CG 3.79Å; F56-E292 HydrophobicContact CE1-CB 4.13Å; F56-E292 HydrophobicContact CE1-CG 4.19Å; F56-E292 HydrophobicContact CE2-CG 3.76Å; F56-E292 HydrophobicContact CG-CB 4.41Å; F56-E292 HydrophobicContact CG-CG 4.03Å; F56-E292 HydrophobicContact CZ-CB 4.33Å; F56-E292 HydrophobicContact CZ-CG 3.96Å; F56-E292 PolarHBondContact N-OE2 3.22Å; F56-R295 HydrophobicContact CE1-CB 4.37Å
57	E	85.5	Confident	81.2	Confident	107 Å²	107	68.6 Å²	68.6	50%	0.5	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	146.6	176.1	-63.9	179.2	-170.5	0	0	111.4	H53 F54 V59 R67	H53-E57 WeakPolarHBondContact CA-O 3.37Å; F54-E57 PolarHBondContact N-O 3.2Å; F54-E57 PolarHBondContact O-N 3.02Å; E57-V59 HydrophobicContact CB-CG1 4.47Å; E57-R67 IonicContact OE2-CZ 3.11Å; E57-R67 IonicContact OE2-NH1 2.91Å; E57-R67 PolarHBondContact OE2-NH1 3.07Å; E57-R67 IonicContact OE2-NH2 2.63Å
58	T	87.6	Confident	83.2	Confident	93 Å²	93	64.6 Å²	64.6	57%	0.571	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.3	170.3	-55.4	0	0	0	0	108.4	T52	T52-T58 WeakPolarHBondContact O-CA 3.3Å
59	V	88.4	Confident	85.3	Confident	8 Å²	8	63.9 Å²	63.9	5%	0.048	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	167.2	-173.5	-65.6	0	0	0	0	109.7	S51 T52 F54 E57 E63 K64	S51-V59 CarbonylContact C-O 3.53Å; S51-V59 VanDerWaalsContact CA-O 3.3Å; S51-V59 WeakPolarHBondContact CA-O 3.44Å; T52-V59 HydrophobicContact CG2-CG2 4.2Å; T52-V59 PolarHBondContact N-O 2.89Å; T52-V59 PolarHBondContact O-N 3.43Å; T52-V59 VanDerWaalsContact O-O 3.1Å; F54-V59 HydrophobicContact CB-CG1 4.29Å; F54-V59 HydrophobicContact CB-CG2 3.78Å; E57-V59 HydrophobicContact CB-CG1 4.47Å; V59-E63 HydrophobicContact CB-CB 4.29Å; V59-E63 HydrophobicContact CB-CG 4.14Å; V59-E63 HydrophobicContact CG1-CG 4.39Å; V59-K64 HydrophobicContact CG2-CB 3.85Å
60	S	92.4	Very high	86.6	Confident	29 Å²	29	62.8 Å²	62.8	20%	0.203	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	157.9	169.5	68.9	0	0	0	0	111.1	D49 G62 E63 K64	D49-S60 WeakPolarHBondContact OD1-CB 3.43Å; S60-G62 PolarHBondContact O-N 3.07Å; S60-E63 PolarHBondContact O-N 3.35Å; S60-E63 VanDerWaalsContact OG-CB 3.28Å; S60-E63 WeakPolarHBondContact OG-CB 3.42Å; S60-E63 PolarHBondContact OG-N 2.89Å; S60-K64 PolarHBondContact O-N 3.24Å
61	E	88.3	Confident	86.8	Confident	48 Å²	48	57 Å²	57	22%	0.224	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-45.8	178.5	-74.6	174.4	-167.8	0	0	112.9	K50 T52 E63 K64 A65 T229 H230	K50-E61 HydrophobicContact CB-CG 4.25Å; K50-E61 WeakPolarHBondContact CB-OE1 3.45Å; K50-E61 WeakPolarHBondContact O-CG 3.4Å; K50-E61 PolarHBondContact O-N 3.41Å; K50-E61 VanDerWaalsContact O-N 3.14Å; T52-E61 HydrophobicContact CG2-CB 4.47Å; T52-E61 HydrophobicContact CG2-CG 4.05Å; E61-E63 VanDerWaalsContact C-N 3.31Å; E61-E63 PolarHBondContact O-N 3.32Å; E61-K64 PolarHBondContact O-N 3.17Å; E61-A65 PolarHBondContact O-N 3.31Å; E61-T229 HydrophobicContact CB-CG2 3.98Å; E61-T229 HydrophobicContact CG-CG2 3.82Å; E61-H230 IonicContact OE1-CE1 2.62Å; E61-H230 PolarHBondContact OE1-CE1 3.06Å; E61-H230 IonicContact OE1-NE2 3.89Å; E61-H230 PolarHBondContact OE1-NE2 3.41Å; E61-H230 IonicContact OE2-CE1 3.12Å; E61-H230 PolarHBondContact OE2-CE1 2.81Å; E61-H230 IonicContact OE2-NE2 2.75Å; E61-H230 PolarHBondContact OE2-NE2 2.89Å
62	G	84.4	Confident	86.9	Confident	54 Å²	54	54.5 Å²	54.5	56%	0.557	28%	0.282	S	S	*	.	H	α-helix	trans	-62.6	-38.5	177	0	0	0	0	0	112.6	S60 A65 E66	S60-G62 PolarHBondContact O-N 3.07Å; G62-A65 PolarHBondContact O-N 3.37Å; G62-E66 PolarHBondContact O-N 3.03Å; G62-E66 VanDerWaalsContact O-N 3.16Å
63	E	88.7	Confident	86.9	Confident	71 Å²	71	57.5 Å²	57.5	33%	0.332	29%	0.294	S	S	.	.	H	α-helix	trans	-67.3	-39.3	177.1	-179.8	175.4	-166.8	0	0	112.2	V59 S60 E61 E66 R67	V59-E63 HydrophobicContact CB-CB 4.29Å; V59-E63 HydrophobicContact CB-CG 4.14Å; V59-E63 HydrophobicContact CG1-CG 4.39Å; S60-E63 PolarHBondContact O-N 3.35Å; S60-E63 VanDerWaalsContact OG-CB 3.28Å; S60-E63 WeakPolarHBondContact OG-CB 3.42Å; S60-E63 PolarHBondContact OG-N 2.89Å; E61-E63 VanDerWaalsContact C-N 3.31Å; E61-E63 PolarHBondContact O-N 3.32Å; E63-E66 PolarHBondContact O-N 3.4Å; E63-R67 HydrophobicContact CG-CG 4.22Å; E63-R67 WeakPolarHBondContact O-CB 3.39Å; E63-R67 VanDerWaalsContact O-CG 3.28Å; E63-R67 WeakPolarHBondContact O-CG 3.36Å; E63-R67 PolarHBondContact O-N 3.42Å; E63-R67 IonicContact OE1-CZ 3.47Å; E63-R67 IonicContact OE1-NE 3.71Å; E63-R67 PolarHBondContact OE1-NE 3.18Å; E63-R67 IonicContact OE1-NH2 3.6Å; E63-R67 PolarHBondContact OE1-NH2 3.41Å
64	K	88.3	Confident	87	Confident	16 Å²	16	57.2 Å²	57.2	7%	0.07	30%	0.301	C	S	.	.	H	α-helix	trans	-58.5	-51.4	174.8	177.9	-176.2	169.4	-179.2	0	110.6	T52 H53 V59 S60 E61 E66 R67 V68 V228 T229	T52-K64 HydrophobicContact CG2-CB 3.49Å; T52-K64 VanDerWaalsContact CG2-CB 3.49Å; T52-K64 HydrophobicContact CG2-CD 3.4Å; T52-K64 HydrophobicContact CG2-CG 4.04Å; H53-K64 WeakPolarHBondContact O-CD 3.28Å; H53-K64 WeakPolarHBondContact O-CE 3.45Å; V59-K64 HydrophobicContact CG2-CB 3.85Å; S60-K64 PolarHBondContact O-N 3.24Å; E61-K64 PolarHBondContact O-N 3.17Å; K64-E66 VanDerWaalsContact C-N 3.31Å; K64-E66 PolarHBondContact O-N 3.25Å; K64-R67 PolarHBondContact O-N 3.1Å; K64-V68 HydrophobicContact CG-CG2 4.22Å; K64-V68 WeakPolarHBondContact O-CB 3.33Å; K64-V68 VanDerWaalsContact O-CG2 3.27Å; K64-V68 WeakPolarHBondContact O-CG2 3.4Å; K64-V68 PolarHBondContact O-N 3.4Å; K64-V228 PolarHBondContact NZ-O 2.87Å; K64-T229 HydrophobicContact CD-CG2 4.27Å
65	A	85.6	Confident	87	Confident	46 Å²	46	56.1 Å²	56.1	38%	0.38	30%	0.297	S	S	.	.	H	α-helix	trans	-57.4	-44.8	-178.6	0	0	0	0	0	111.5	E61 G62 Y69	E61-A65 PolarHBondContact O-N 3.31Å; G62-A65 PolarHBondContact O-N 3.37Å; A65-Y69 WeakPolarHBondContact O-CB 3.15Å; A65-Y69 PolarHBondContact O-N 3.38Å
66	E	89.8	Confident	86.9	Confident	108 Å²	108	56.1 Å²	56.1	51%	0.505	30%	0.297	S	S	.	.	H	α-helix	trans	-65.4	-44.8	178.2	-169.4	-174.2	170.6	0	0	112.6	G62 E63 K64 Y69 K70	G62-E66 PolarHBondContact O-N 3.03Å; G62-E66 VanDerWaalsContact O-N 3.16Å; E63-E66 PolarHBondContact O-N 3.4Å; K64-E66 VanDerWaalsContact C-N 3.31Å; K64-E66 PolarHBondContact O-N 3.25Å; E66-Y69 PolarHBondContact O-N 3.33Å; E66-K70 HydrophobicContact CG-CD 4.49Å; E66-K70 WeakPolarHBondContact O-CG 3.47Å; E66-K70 PolarHBondContact O-N 3.46Å; E66-K70 VanDerWaalsContact OE1-CE 3.22Å; E66-K70 WeakPolarHBondContact OE1-CE 3.48Å; E66-K70 IonicContact OE1-NZ 2.63Å; E66-K70 PolarHBondContact OE1-NZ 3.4Å
67	R	89.7	Confident	86.9	Confident	80 Å²	80	59.7 Å²	59.7	30%	0.302	32%	0.315	S	S	.	.	H	α-helix	trans	-63.9	-43.9	179.1	-73.1	178.7	176.9	-149.8	7.2	111.5	F54 E57 E63 K64 K70 V71	F54-R67 HydrophobicContact CD2-CB 3.73Å; F54-R67 HydrophobicContact CE2-CB 3.53Å; F54-R67 HydrophobicContact CG-CB 4.4Å; F54-R67 HydrophobicContact CZ-CB 4.05Å; E57-R67 IonicContact OE2-CZ 3.11Å; E57-R67 IonicContact OE2-NH1 2.91Å; E57-R67 PolarHBondContact OE2-NH1 3.07Å; E57-R67 IonicContact OE2-NH2 2.63Å; E63-R67 HydrophobicContact CG-CG 4.22Å; E63-R67 WeakPolarHBondContact O-CB 3.39Å; E63-R67 VanDerWaalsContact O-CG 3.28Å; E63-R67 WeakPolarHBondContact O-CG 3.36Å; E63-R67 PolarHBondContact O-N 3.42Å; E63-R67 IonicContact OE1-CZ 3.47Å; E63-R67 IonicContact OE1-NE 3.71Å; E63-R67 PolarHBondContact OE1-NE 3.18Å; E63-R67 IonicContact OE1-NH2 3.6Å; E63-R67 PolarHBondContact OE1-NH2 3.41Å; K64-R67 PolarHBondContact O-N 3.1Å; R67-K70 PolarHBondContact O-N 3.07Å; R67-V71 WeakPolarHBondContact O-CG2 3.36Å; R67-V71 PolarHBondContact O-N 3.31Å; R67-V71 VanDerWaalsContact O-N 3.08Å
68	V	85.9	Confident	86.8	Confident	15 Å²	15	59.5 Å²	59.5	9%	0.091	31%	0.312	C	S	.	.	H	α-helix	trans	-60.8	-47.1	175.6	170.1	0	0	0	0	110.4	F54 K64 K70 V71 F72 N227 Y289	F54-V68 HydrophobicContact CD2-CG2 4.07Å; F54-V68 HydrophobicContact CE2-CG2 4.04Å; K64-V68 HydrophobicContact CG-CG2 4.22Å; K64-V68 WeakPolarHBondContact O-CB 3.33Å; K64-V68 VanDerWaalsContact O-CG2 3.27Å; K64-V68 WeakPolarHBondContact O-CG2 3.4Å; K64-V68 PolarHBondContact O-N 3.4Å; V68-K70 VanDerWaalsContact C-N 3.33Å; V68-K70 PolarHBondContact O-N 3.49Å; V68-V71 PolarHBondContact O-N 3.44Å; V68-F72 HydrophobicContact CG1-CD2 3.82Å; V68-F72 HydrophobicContact CG1-CE2 3.8Å; V68-F72 VanDerWaalsContact O-CD2 3.29Å; V68-F72 WeakPolarHBondContact O-CD2 3.41Å; V68-F72 PolarHBondContact O-N 3.47Å; V68-F72 VanDerWaalsContact O-N 3.12Å; V68-N227 HydrophobicContact CG1-CB 3.9Å; V68-Y289 HydrophobicContact CG2-CE2 4.43Å; V68-Y289 WeakPolarHBondContact CG2-OH 3.45Å
69	Y	89.5	Confident	86.6	Confident	69 Å²	69	55.9 Å²	55.9	27%	0.271	29%	0.288	S	S	.	.	H	α-helix	trans	-54.9	-48.8	177.6	-177.6	-81	0	0	0	111.6	A65 E66 V71 F72 E73 N179	A65-Y69 WeakPolarHBondContact O-CB 3.15Å; A65-Y69 PolarHBondContact O-N 3.38Å; E66-Y69 PolarHBondContact O-N 3.33Å; Y69-V71 PolarHBondContact O-N 2.92Å; Y69-F72 PolarHBondContact O-N 2.87Å; Y69-E73 HydrophobicContact CD1-CB 4.48Å; Y69-E73 HydrophobicContact CE1-CB 4.26Å; Y69-E73 HydrophobicContact CE1-CG 4.49Å; Y69-E73 WeakPolarHBondContact O-CB 3.46Å; Y69-E73 PolarHBondContact O-N 3.23Å; Y69-N179 HydrophobicContact CD2-CB 4.5Å; Y69-N179 HydrophobicContact CE2-CB 4.22Å; Y69-N179 PolarHBondContact O-ND2 3.02Å
70	K	87.8	Confident	86.3	Confident	110 Å²	110	57.5 Å²	57.5	48%	0.478	30%	0.297	S	S	.	.	H	α-helix	trans	-62	-39.2	179.7	-74.1	176.8	-176.1	168.2	0	113	E66 R67 V68 E73 S74	E66-K70 HydrophobicContact CG-CD 4.49Å; E66-K70 WeakPolarHBondContact O-CG 3.47Å; E66-K70 PolarHBondContact O-N 3.46Å; E66-K70 VanDerWaalsContact OE1-CE 3.22Å; E66-K70 WeakPolarHBondContact OE1-CE 3.48Å; E66-K70 IonicContact OE1-NZ 2.63Å; E66-K70 PolarHBondContact OE1-NZ 3.4Å; R67-K70 PolarHBondContact O-N 3.07Å; V68-K70 VanDerWaalsContact C-N 3.33Å; V68-K70 PolarHBondContact O-N 3.49Å; K70-E73 PolarHBondContact O-N 3.34Å; K70-S74 PolarHBondContact O-N 3.14Å; K70-S74 PolarHBondContact O-OG 3.31Å
71	V	84.4	Confident	85.9	Confident	22 Å²	22	59.8 Å²	59.8	13%	0.133	31%	0.31	C	S	.	.	H	α-helix	trans	-58.8	-50.7	174.6	165.5	0	0	0	0	110.2	F54 R67 V68 Y69 E73 S74 V75 Y289	F54-V71 HydrophobicContact CZ-CG2 4.2Å; R67-V71 WeakPolarHBondContact O-CG2 3.36Å; R67-V71 PolarHBondContact O-N 3.31Å; R67-V71 VanDerWaalsContact O-N 3.08Å; V68-V71 PolarHBondContact O-N 3.44Å; Y69-V71 PolarHBondContact O-N 2.92Å; V71-E73 VanDerWaalsContact C-N 3.35Å; V71-E73 PolarHBondContact O-N 3.14Å; V71-S74 PolarHBondContact O-N 3.38Å; V71-S74 PolarHBondContact O-OG 3.45Å; V71-V75 WeakPolarHBondContact O-CG2 3.43Å; V71-V75 PolarHBondContact O-N 2.95Å; V71-V75 VanDerWaalsContact O-N 3.14Å; V71-Y289 HydrophobicContact CG1-CD1 4.29Å
72	F	84.6	Confident	85.4	Confident	30 Å²	30	58 Å²	58	13%	0.132	30%	0.302	C	S	.	.	H	α-helix	trans	-70.3	-31.2	-178.8	-75.6	-75.8	0	0	0	113.3	V68 Y69 V75 A76 Y79 N227	V68-F72 HydrophobicContact CG1-CD2 3.82Å; V68-F72 HydrophobicContact CG1-CE2 3.8Å; V68-F72 VanDerWaalsContact O-CD2 3.29Å; V68-F72 WeakPolarHBondContact O-CD2 3.41Å; V68-F72 PolarHBondContact O-N 3.47Å; V68-F72 VanDerWaalsContact O-N 3.12Å; Y69-F72 PolarHBondContact O-N 2.87Å; F72-V75 HydrophobicContact CD1-CG2 4.38Å; F72-A76 WeakPolarHBondContact O-CA 3.22Å; F72-A76 WeakPolarHBondContact O-CB 3.32Å; F72-A76 PolarHBondContact O-N 3.1Å; F72-Y79 HydrophobicContact CD1-CD2 4.41Å; F72-Y79 HydrophobicContact CD1-CE2 4.22Å; F72-Y79 HydrophobicContact CE1-CD2 4.38Å; F72-Y79 AromaticContact CE1-CE2 3.78Å; F72-Y79 HydrophobicContact CE1-CE2 3.78Å; F72-N227 HydrophobicContact CE2-CB 4.24Å; F72-N227 WeakPolarHBondContact CZ-ND2 2.98Å
73	E	87.1	Confident	85.4	Confident	86 Å²	86	56.1 Å²	56.1	40%	0.402	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-45.4	173.7	-174.7	174.7	-126.4	0	0	111.4	Y69 K70 V71 V75 N179 E181	Y69-E73 HydrophobicContact CD1-CB 4.48Å; Y69-E73 HydrophobicContact CE1-CB 4.26Å; Y69-E73 HydrophobicContact CE1-CG 4.49Å; Y69-E73 WeakPolarHBondContact O-CB 3.46Å; Y69-E73 PolarHBondContact O-N 3.23Å; K70-E73 PolarHBondContact O-N 3.34Å; V71-E73 VanDerWaalsContact C-N 3.35Å; V71-E73 PolarHBondContact O-N 3.14Å; E73-V75 VanDerWaalsContact C-N 3.34Å; E73-V75 PolarHBondContact O-N 3.14Å; E73-N179 WeakPolarHBondContact CA-ND2 3.3Å; E73-N179 PolarHBondContact N-ND2 3.01Å; E73-N179 VanDerWaalsContact N-ND2 3.1Å; E73-E181 HydrophobicContact CG-CG 4.19Å
74	S	84.5	Confident	85.2	Confident	75 Å²	75	55 Å²	55	52%	0.524	28%	0.275	S	S	.	.	H	α-helix	trans	-68	-33.6	179.2	67.7	0	0	0	0	112.9	K70 V71	K70-S74 PolarHBondContact O-N 3.14Å; K70-S74 PolarHBondContact O-OG 3.31Å; V71-S74 PolarHBondContact O-N 3.38Å; V71-S74 PolarHBondContact O-OG 3.45Å
75	V	82.8	Confident	84.8	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.03	28%	0.279	C	S	.	.	H	α-helix	trans	-93.2	-3.9	-178.3	-55.9	0	0	0	0	114.5	V71 F72 E73 Q77 K78 Y79 M82 D283	V71-V75 WeakPolarHBondContact O-CG2 3.43Å; V71-V75 PolarHBondContact O-N 2.95Å; V71-V75 VanDerWaalsContact O-N 3.14Å; F72-V75 HydrophobicContact CD1-CG2 4.38Å; E73-V75 VanDerWaalsContact C-N 3.34Å; E73-V75 PolarHBondContact O-N 3.14Å; V75-Q77 VanDerWaalsContact C-N 3.31Å; V75-Q77 PolarHBondContact O-N 3.34Å; V75-Q77 VanDerWaalsContact O-N 3.13Å; V75-K78 CarbonylContact O-C 3.3Å; V75-K78 WeakPolarHBondContact O-CA 3.47Å; V75-K78 PolarHBondContact O-N 3.06Å; V75-Y79 HydrophobicContact CG2-CD2 4.23Å; V75-Y79 PolarHBondContact O-N 2.83Å; V75-M82 HydrophobicContact CG2-CE 4.27Å; V75-D283 WeakPolarHBondContact CG1-OD2 3.33Å
76	A	84.3	Confident	84.3	Confident	4 Å²	4	53.8 Å²	53.8	3%	0.033	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-50.8	-46.3	-169.7	0	0	0	0	0	113.9	F72 K78 E181 M182 V185	F72-A76 WeakPolarHBondContact O-CA 3.22Å; F72-A76 WeakPolarHBondContact O-CB 3.32Å; F72-A76 PolarHBondContact O-N 3.1Å; A76-K78 VanDerWaalsContact C-N 3.3Å; A76-K78 PolarHBondContact O-N 2.96Å; A76-E181 HydrophobicContact CB-CB 4.13Å; A76-M182 VanDerWaalsContact CA-SD 3.58Å; A76-M182 HydrophobicContact CB-CG 4.27Å; A76-M182 HydrophobicContact CB-SD 3.67Å; A76-V185 HydrophobicContact CB-CG2 4.33Å
77	Q	84.9	Confident	83.8	Confident	178 Å²	178	49.5 Å²	49.5	83%	0.832	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-70.2	-24.1	178.5	-66	-175.4	-4.6	0	0	113.9	V75	V75-Q77 VanDerWaalsContact C-N 3.31Å; V75-Q77 PolarHBondContact O-N 3.34Å; V75-Q77 VanDerWaalsContact O-N 3.13Å
78	K	83.9	Confident	83.6	Confident	102 Å²	102	52.2 Å²	52.2	44%	0.443	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-105.5	-1	-176.6	-63.6	177.5	-179.2	168.6	0	112.7	V75 A76 D80 V81 M82 A281	V75-K78 CarbonylContact O-C 3.3Å; V75-K78 WeakPolarHBondContact O-CA 3.47Å; V75-K78 PolarHBondContact O-N 3.06Å; A76-K78 VanDerWaalsContact C-N 3.3Å; A76-K78 PolarHBondContact O-N 2.96Å; K78-D80 VanDerWaalsContact C-N 3.35Å; K78-D80 PolarHBondContact O-N 3.25Å; K78-V81 WeakPolarHBondContact O-CB 3.48Å; K78-V81 PolarHBondContact O-N 2.91Å; K78-V81 VanDerWaalsContact O-N 3.09Å; K78-M82 WeakPolarHBondContact O-CB 3.45Å; K78-M82 PolarHBondContact O-N 3.35Å; K78-A281 HydrophobicContact CD-CB 3.99Å; K78-A281 PolarHBondContact NZ-O 2.96Å
79	Y	82.7	Confident	83.6	Confident	17 Å²	17	52.7 Å²	52.7	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-58.5	-43.8	-170.9	-177.2	-102.4	0	0	0	112.8	F72 V75 M82 N83 T117 M182	F72-Y79 HydrophobicContact CD1-CD2 4.41Å; F72-Y79 HydrophobicContact CD1-CE2 4.22Å; F72-Y79 HydrophobicContact CE1-CD2 4.38Å; F72-Y79 AromaticContact CE1-CE2 3.78Å; F72-Y79 HydrophobicContact CE1-CE2 3.78Å; V75-Y79 HydrophobicContact CG2-CD2 4.23Å; V75-Y79 PolarHBondContact O-N 2.83Å; Y79-M82 HydrophobicContact CD2-CE 3.52Å; Y79-M82 HydrophobicContact CE2-CE 3.71Å; Y79-M82 WeakPolarHBondContact O-CB 3.26Å; Y79-M82 PolarHBondContact O-N 2.88Å; Y79-N83 WeakPolarHBondContact CD1-ND2 3.47Å; Y79-N83 WeakPolarHBondContact CE1-ND2 3.46Å; Y79-N83 VanDerWaalsContact CZ-ND2 3.25Å; Y79-N83 PolarHBondContact O-N 2.96Å; Y79-N83 PolarHBondContact O-ND2 3.41Å; Y79-T117 HydrophobicContact CD1-CG2 3.94Å; Y79-M182 HydrophobicContact CD1-CE 3.9Å; Y79-M182 HydrophobicContact CD2-CE 4.11Å; Y79-M182 HydrophobicContact CE1-CE 4.13Å; Y79-M182 HydrophobicContact CE2-CE 4.42Å; Y79-M182 HydrophobicContact CG-CE 3.86Å
80	D	82.6	Confident	83.7	Confident	42 Å²	42	51.8 Å²	51.8	23%	0.225	28%	0.276	C	S	.	.	H	α-helix	trans	-66.2	-41.4	177.9	-80	-1.2	0	0	0	111.2	K78 M82 N83 D84 K189	K78-D80 VanDerWaalsContact C-N 3.35Å; K78-D80 PolarHBondContact O-N 3.25Å; D80-M82 VanDerWaalsContact C-N 3.34Å; D80-M82 PolarHBondContact O-N 3.37Å; D80-N83 PolarHBondContact O-N 3.33Å; D80-D84 PolarHBondContact O-N 3.13Å; D80-K189 IonicContact OD2-NZ 2.71Å; D80-K189 PolarHBondContact OD2-NZ 2.75Å
81	V	83.2	Confident	83.9	Confident	78 Å²	78	47 Å²	47	47%	0.473	26%	0.255	S	S	.	.	H	α-helix	trans	-62.8	-43	176.2	177.7	0	0	0	0	110.9	K78 D84 A85 I280	K78-V81 WeakPolarHBondContact O-CB 3.48Å; K78-V81 PolarHBondContact O-N 2.91Å; K78-V81 VanDerWaalsContact O-N 3.09Å; V81-D84 PolarHBondContact O-N 2.98Å; V81-A85 WeakPolarHBondContact O-CB 3.45Å; V81-A85 PolarHBondContact O-N 2.95Å; V81-I280 HydrophobicContact CG1-CG2 3.76Å
82	M	79.7	Confident	84.3	Confident	11 Å²	11	50.7 Å²	50.7	5%	0.054	27%	0.267	C	S	.	.	H	α-helix	trans	-58.1	-51.3	175.2	168.4	172.4	88.6	0	0	110.8	V75 K78 Y79 D80 D84 A85 M86 Y287	V75-M82 HydrophobicContact CG2-CE 4.27Å; K78-M82 WeakPolarHBondContact O-CB 3.45Å; K78-M82 PolarHBondContact O-N 3.35Å; Y79-M82 HydrophobicContact CD2-CE 3.52Å; Y79-M82 HydrophobicContact CE2-CE 3.71Å; Y79-M82 WeakPolarHBondContact O-CB 3.26Å; Y79-M82 PolarHBondContact O-N 2.88Å; D80-M82 VanDerWaalsContact C-N 3.34Å; D80-M82 PolarHBondContact O-N 3.37Å; M82-D84 VanDerWaalsContact C-N 3.32Å; M82-D84 PolarHBondContact O-N 3.29Å; M82-A85 PolarHBondContact O-N 3.43Å; M82-M86 HydrophobicContact CE-CE 4.24Å; M82-M86 HydrophobicContact CG-CE 3.35Å; M82-M86 HydrophobicContact CG-CG 4.4Å; M82-M86 HydrophobicContact CG-SD 3.59Å; M82-M86 VanDerWaalsContact CG-SD 3.59Å; M82-M86 WeakPolarHBondContact O-CB 3.29Å; M82-M86 WeakPolarHBondContact O-CG 3.46Å; M82-M86 PolarHBondContact O-N 3.24Å; M82-M86 HydrophobicContact SD-CE 4.23Å; M82-M86 HydrophobicContact SD-SD 4.34Å; M82-Y287 VanDerWaalsContact CA-OH 3.25Å; M82-Y287 WeakPolarHBondContact CA-OH 3.39Å; M82-Y287 HydrophobicContact CB-CE1 4.47Å; M82-Y287 HydrophobicContact CB-CE2 4.37Å; M82-Y287 WeakPolarHBondContact CB-OH 3.34Å; M82-Y287 HydrophobicContact CG-CE1 3.71Å; M82-Y287 HydrophobicContact CG-CE2 3.86Å; M82-Y287 VanDerWaalsContact CG-OH 3.31Å; M82-Y287 WeakPolarHBondContact CG-OH 3.43Å; M82-Y287 HydrophobicContact SD-CD2 4.1Å; M82-Y287 HydrophobicContact SD-CE1 4.34Å; M82-Y287 HydrophobicContact SD-CE2 3.66Å
83	N	82.9	Confident	84.7	Confident	13 Å²	13	54.3 Å²	54.3	7%	0.07	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-40	178	-74.2	-34.8	0	0	0	112.9	Y79 D80 S87 H91	Y79-N83 WeakPolarHBondContact CD1-ND2 3.47Å; Y79-N83 WeakPolarHBondContact CE1-ND2 3.46Å; Y79-N83 VanDerWaalsContact CZ-ND2 3.25Å; Y79-N83 PolarHBondContact O-N 2.96Å; Y79-N83 PolarHBondContact O-ND2 3.41Å; D80-N83 PolarHBondContact O-N 3.33Å; N83-S87 WeakPolarHBondContact O-CB 3.33Å; N83-S87 PolarHBondContact O-N 3.07Å; N83-S87 PolarHBondContact O-OG 2.88Å; N83-H91 PolarHBondContact O-ND1 3.23Å; N83-H91 VanDerWaalsContact O-ND1 3.16Å
84	D	84.7	Confident	85.1	Confident	48 Å²	48	51 Å²	51	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-61.5	-48.1	175.6	-82.4	-37.6	0	0	0	111.5	D80 V81 M82 L88 G89 H91 R92	D80-D84 PolarHBondContact O-N 3.13Å; V81-D84 PolarHBondContact O-N 2.98Å; M82-D84 VanDerWaalsContact C-N 3.32Å; M82-D84 PolarHBondContact O-N 3.29Å; D84-L88 CarbonylContact O-C 3.59Å; D84-L88 VanDerWaalsContact O-CA 3.22Å; D84-L88 WeakPolarHBondContact O-CA 3.44Å; D84-L88 PolarHBondContact O-N 3.49Å; D84-G89 PolarHBondContact O-N 2.97Å; D84-H91 PolarHBondContact N-CE1 2.9Å; D84-H91 IonicContact OD1-CE1 3.3Å; D84-H91 PolarHBondContact OD1-CE1 3.34Å; D84-H91 IonicContact OD1-ND1 2.76Å; D84-H91 IonicContact OD1-NE2 3.99Å; D84-R92 VanDerWaalsContact CG-NH2 3.31Å; D84-R92 IonicContact OD1-CZ 3.84Å; D84-R92 IonicContact OD1-NE 3.36Å; D84-R92 PolarHBondContact OD1-NE 3.36Å; D84-R92 IonicContact OD1-NH2 2.71Å; D84-R92 PolarHBondContact OD1-NH2 3.23Å; D84-R92 VanDerWaalsContact OD1-NH2 3.09Å; D84-R92 IonicContact OD2-CZ 2.64Å; D84-R92 IonicContact OD2-NE 3.72Å; D84-R92 IonicContact OD2-NH2 3.87Å; D84-R92 PolarHBondContact OD2-NH2 3.42Å
85	A	79.9	Confident	85.7	Confident	19 Å²	19	47.9 Å²	47.9	16%	0.157	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-48.5	-179.9	0	0	0	0	0	112	V81 M82 S87 L88 I280	V81-A85 WeakPolarHBondContact O-CB 3.45Å; V81-A85 PolarHBondContact O-N 2.95Å; M82-A85 PolarHBondContact O-N 3.43Å; A85-S87 PolarHBondContact O-N 2.69Å; A85-L88 PolarHBondContact O-N 3.02Å; A85-I280 HydrophobicContact CB-CD1 3.62Å
86	M	75.4	Confident	86.2	Confident	18 Å²	18	51.3 Å²	51.3	9%	0.089	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-37.9	-173.1	-65.6	-179.1	-46.8	0	0	113.1	M82 Y268 I273 Y287 L290	M82-M86 HydrophobicContact CE-CE 4.24Å; M82-M86 HydrophobicContact CG-CE 3.35Å; M82-M86 HydrophobicContact CG-CG 4.4Å; M82-M86 HydrophobicContact CG-SD 3.59Å; M82-M86 VanDerWaalsContact CG-SD 3.59Å; M82-M86 WeakPolarHBondContact O-CB 3.29Å; M82-M86 WeakPolarHBondContact O-CG 3.46Å; M82-M86 PolarHBondContact O-N 3.24Å; M82-M86 HydrophobicContact SD-CE 4.23Å; M82-M86 HydrophobicContact SD-SD 4.34Å; M86-Y268 PolarHBondContact O-OH 2.99Å; M86-I273 HydrophobicContact CG-CG2 4.05Å; M86-I273 HydrophobicContact SD-CG2 4.14Å; M86-Y287 HydrophobicContact CG-CD1 3.91Å; M86-Y287 HydrophobicContact CG-CE1 3.54Å; M86-Y287 HydrophobicContact SD-CD1 3.49Å; M86-Y287 WeakPolarHBondContact SD-CD1 3.34Å; M86-Y287 HydrophobicContact SD-CE1 3.45Å; M86-Y287 WeakPolarHBondContact SD-CE1 3.42Å; M86-Y287 HydrophobicContact SD-CG 4.45Å; M86-L290 HydrophobicContact CE-CD2 3.3Å; M86-L290 HydrophobicContact SD-CD2 3.04Å; M86-L290 WeakPolarHBondContact SD-CD2 3.47Å
87	S	80.4	Confident	86.7	Confident	17 Å²	17	53.2 Å²	53.2	12%	0.119	28%	0.275	C	S	.	.	H	α-helix	trans	-97.8	1.4	-178.6	67.4	0	0	0	0	113.6	N83 A85 G89 V90 H91	N83-S87 WeakPolarHBondContact O-CB 3.33Å; N83-S87 PolarHBondContact O-N 3.07Å; N83-S87 PolarHBondContact O-OG 2.88Å; A85-S87 PolarHBondContact O-N 2.69Å; S87-G89 PolarHBondContact O-N 3.48Å; S87-G89 PolarHBondContact OG-N 2.86Å; S87-V90 VanDerWaalsContact O-CB 3.27Å; S87-V90 WeakPolarHBondContact O-CB 3.46Å; S87-V90 VanDerWaalsContact O-CG2 3.25Å; S87-V90 WeakPolarHBondContact O-CG2 3.37Å; S87-V90 PolarHBondContact O-N 2.78Å; S87-H91 WeakPolarHBondContact OG-CB 3.49Å; S87-H91 PolarHBondContact OG-N 3.36Å; S87-H91 PolarHBondContact OG-ND1 2.93Å
88	L	83.8	Confident	87.3	Confident	138 Å²	138	44.7 Å²	44.7	72%	0.723	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	38.8	-170	-55.6	173.7	0	0	0	111.8	D84 A85 V90	D84-L88 CarbonylContact O-C 3.59Å; D84-L88 VanDerWaalsContact O-CA 3.22Å; D84-L88 WeakPolarHBondContact O-CA 3.44Å; D84-L88 PolarHBondContact O-N 3.49Å; A85-L88 PolarHBondContact O-N 3.02Å; L88-V90 PolarHBondContact O-N 3.35Å
89	G	87.5	Confident	87.8	Confident	24 Å²	24	40.1 Å²	40.1	25%	0.247	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-3.2	-177.3	0	0	0	0	0	116.1	D84 S87 H91 R92	D84-G89 PolarHBondContact O-N 2.97Å; S87-G89 PolarHBondContact O-N 3.48Å; S87-G89 PolarHBondContact OG-N 2.86Å; G89-H91 PolarHBondContact O-N 3.05Å; G89-R92 WeakPolarHBondContact O-CB 3.43Å; G89-R92 PolarHBondContact O-N 3.06Å
90	V	91.5	Very high	88.3	Confident	51 Å²	51	45.4 Å²	45.4	31%	0.309	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.4	-177.4	-179.1	0	0	0	0	111.9	S87 L88 R92 L93 W94	S87-V90 VanDerWaalsContact O-CB 3.27Å; S87-V90 WeakPolarHBondContact O-CB 3.46Å; S87-V90 VanDerWaalsContact O-CG2 3.25Å; S87-V90 WeakPolarHBondContact O-CG2 3.37Å; S87-V90 PolarHBondContact O-N 2.78Å; L88-V90 PolarHBondContact O-N 3.35Å; V90-R92 PolarHBondContact O-N 2.92Å; V90-R92 VanDerWaalsContact O-N 3.08Å; V90-L93 WeakPolarHBondContact O-CB 3.27Å; V90-L93 PolarHBondContact O-N 3.3Å; V90-W94 HydrophobicContact CB-CZ2 4.29Å; V90-W94 HydrophobicContact CG1-CD2 4.35Å; V90-W94 HydrophobicContact CG1-CH2 4.46Å; V90-W94 HydrophobicContact CG1-CZ2 3.68Å; V90-W94 PolarHBondContact O-N 3.27Å
91	H	90.1	Very high	88.9	Confident	8 Å²	8	45.2 Å²	45.2	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-56.6	-29.2	177.2	76.2	-92	0	0	0	113.6	N83 D84 S87 G89 L93 W94 K95	N83-H91 PolarHBondContact O-ND1 3.23Å; N83-H91 VanDerWaalsContact O-ND1 3.16Å; D84-H91 PolarHBondContact N-CE1 2.9Å; D84-H91 IonicContact OD1-CE1 3.3Å; D84-H91 PolarHBondContact OD1-CE1 3.34Å; D84-H91 IonicContact OD1-ND1 2.76Å; D84-H91 IonicContact OD1-NE2 3.99Å; S87-H91 WeakPolarHBondContact OG-CB 3.49Å; S87-H91 PolarHBondContact OG-N 3.36Å; S87-H91 PolarHBondContact OG-ND1 2.93Å; G89-H91 PolarHBondContact O-N 3.05Å; H91-L93 VanDerWaalsContact C-N 3.26Å; H91-L93 PolarHBondContact O-N 2.77Å; H91-W94 HydrophobicContact CB-CE3 3.78Å; H91-W94 HydrophobicContact CB-CZ3 4.08Å; H91-W94 PolarHBondContact O-N 3.47Å; H91-K95 WeakPolarHBondContact O-CG 3.25Å; H91-K95 PolarHBondContact O-N 2.8Å
92	R	93.2	Very high	89.5	Confident	100 Å²	100	42 Å²	42	38%	0.377	22%	0.221	S	C	.	.	H	α-helix	trans	-62.6	-37.5	176.7	-61.1	177	177.8	-92.2	-0.5	111	D84 G89 V90 D96 R123	D84-R92 VanDerWaalsContact CG-NH2 3.31Å; D84-R92 IonicContact OD1-CZ 3.84Å; D84-R92 IonicContact OD1-NE 3.36Å; D84-R92 PolarHBondContact OD1-NE 3.36Å; D84-R92 IonicContact OD1-NH2 2.71Å; D84-R92 PolarHBondContact OD1-NH2 3.23Å; D84-R92 VanDerWaalsContact OD1-NH2 3.09Å; D84-R92 IonicContact OD2-CZ 2.64Å; D84-R92 IonicContact OD2-NE 3.72Å; D84-R92 IonicContact OD2-NH2 3.87Å; D84-R92 PolarHBondContact OD2-NH2 3.42Å; G89-R92 WeakPolarHBondContact O-CB 3.43Å; G89-R92 PolarHBondContact O-N 3.06Å; V90-R92 PolarHBondContact O-N 2.92Å; V90-R92 VanDerWaalsContact O-N 3.08Å; R92-D96 VanDerWaalsContact O-CG 3.24Å; R92-D96 PolarHBondContact O-N 2.9Å; R92-R123 PolarHBondContact O-NH1 3.44Å
93	L	94.3	Very high	90.1	Very high	107 Å²	107	45.5 Å²	45.5	56%	0.56	24%	0.239	S	C	*	.	H	α-helix	trans	-71.1	-37.2	176.1	-58.7	177.3	0	0	0	111.8	V90 H91 D96 M97	V90-L93 WeakPolarHBondContact O-CB 3.27Å; V90-L93 PolarHBondContact O-N 3.3Å; H91-L93 VanDerWaalsContact C-N 3.26Å; H91-L93 PolarHBondContact O-N 2.77Å; L93-D96 PolarHBondContact O-N 2.84Å; L93-M97 WeakPolarHBondContact O-CB 3.38Å; L93-M97 PolarHBondContact O-N 3.46Å
94	W	95.8	Very high	90.5	Very high	16 Å²	16	44.9 Å²	44.9	6%	0.061	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-42.7	175.2	-59.4	-31.2	0	0	0	111.5	V90 H91 M97 L98 F223 L251 F253 L320 T321 V324 V325	V90-W94 HydrophobicContact CB-CZ2 4.29Å; V90-W94 HydrophobicContact CG1-CD2 4.35Å; V90-W94 HydrophobicContact CG1-CH2 4.46Å; V90-W94 HydrophobicContact CG1-CZ2 3.68Å; V90-W94 PolarHBondContact O-N 3.27Å; H91-W94 HydrophobicContact CB-CE3 3.78Å; H91-W94 HydrophobicContact CB-CZ3 4.08Å; H91-W94 PolarHBondContact O-N 3.47Å; W94-M97 WeakPolarHBondContact O-CB 3.25Å; W94-M97 PolarHBondContact O-N 3.21Å; W94-L98 PolarHBondContact O-N 3.16Å; W94-F223 AromaticContact CE3-CZ 3.84Å; W94-F223 HydrophobicContact CE3-CZ 3.84Å; W94-F223 HydrophobicContact CZ3-CZ 4.48Å; W94-L251 HydrophobicContact CB-CD1 4.43Å; W94-L251 HydrophobicContact CB-CD2 4.12Å; W94-F253 HydrophobicContact CZ3-CE1 4.19Å; W94-L320 HydrophobicContact CB-CD1 3.85Å; W94-L320 HydrophobicContact CG-CB 4.46Å; W94-L320 HydrophobicContact CG-CD1 3.9Å; W94-T321 HydrophobicContact CZ2-CG2 4.41Å; W94-T321 WeakPolarHBondContact CZ2-OG1 3.35Å; W94-T321 PolarHBondContact NE1-OG1 2.75Å; W94-V324 HydrophobicContact CH2-CG1 4.1Å; W94-V324 HydrophobicContact CZ2-CG1 4.45Å; W94-V325 HydrophobicContact CD2-CB 4.19Å; W94-V325 HydrophobicContact CD2-CG1 4.48Å; W94-V325 HydrophobicContact CD2-CG2 3.89Å; W94-V325 HydrophobicContact CE3-CB 4.26Å; W94-V325 HydrophobicContact CE3-CG2 3.49Å; W94-V325 VanDerWaalsContact CE3-CG2 3.49Å; W94-V325 HydrophobicContact CH2-CG2 3.76Å; W94-V325 HydrophobicContact CZ2-CG2 4.1Å; W94-V325 HydrophobicContact CZ3-CG2 3.45Å; W94-V325 VanDerWaalsContact CZ3-CG2 3.45Å
95	K	95.3	Very high	90.6	Very high	9 Å²	9	47.6 Å²	47.6	4%	0.039	25%	0.248	C	C	.	.	H	α-helix	trans	-65.2	-41.4	174.6	-65.1	-178.8	-174	178.9	0	111.9	H91 M97 L98 L99 D119 I120 F223 L251	H91-K95 WeakPolarHBondContact O-CG 3.25Å; H91-K95 PolarHBondContact O-N 2.8Å; K95-M97 VanDerWaalsContact C-N 3.26Å; K95-M97 PolarHBondContact O-N 3.37Å; K95-L98 WeakPolarHBondContact O-CB 3.33Å; K95-L98 PolarHBondContact O-N 2.97Å; K95-L98 VanDerWaalsContact O-N 3.16Å; K95-L99 WeakPolarHBondContact O-CD2 3.4Å; K95-L99 PolarHBondContact O-N 2.92Å; K95-L99 VanDerWaalsContact O-N 3.14Å; K95-D119 WeakPolarHBondContact CD-OD2 3.38Å; K95-D119 WeakPolarHBondContact CE-OD2 3.12Å; K95-D119 IonicContact NZ-OD2 3.09Å; K95-D119 PolarHBondContact NZ-OD2 3.08Å; K95-I120 HydrophobicContact CB-CD1 3.79Å; K95-I120 HydrophobicContact CD-CD1 3.89Å; K95-I120 HydrophobicContact CG-CD1 3.71Å; K95-F223 HydrophobicContact CG-CE2 4.44Å; K95-L251 HydrophobicContact CG-CD2 4.12Å
96	D	94.3	Very high	90.9	Very high	78 Å²	78	49.5 Å²	49.5	42%	0.417	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-38	173	-72.8	-25.2	0	0	0	112.3	R92 L93 L99 H100 R123	R92-D96 VanDerWaalsContact O-CG 3.24Å; R92-D96 PolarHBondContact O-N 2.9Å; L93-D96 PolarHBondContact O-N 2.84Å; D96-L99 PolarHBondContact O-N 3.28Å; D96-H100 WeakPolarHBondContact O-CB 3.36Å; D96-H100 PolarHBondContact O-N 2.98Å; D96-R123 VanDerWaalsContact CG-NH1 3.35Å; D96-R123 IonicContact OD1-CZ 2.74Å; D96-R123 IonicContact OD1-NH1 3.7Å; D96-R123 PolarHBondContact OD1-NH1 3.07Å; D96-R123 IonicContact OD2-NH1 3.39Å
97	M	95.1	Very high	91.5	Very high	43 Å²	43	49.7 Å²	49.7	21%	0.212	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-41.2	175.6	-161.5	-65.4	-50.8	0	0	111	L93 W94 K95 L99 H100 V101 L320 L327	L93-M97 WeakPolarHBondContact O-CB 3.38Å; L93-M97 PolarHBondContact O-N 3.46Å; W94-M97 WeakPolarHBondContact O-CB 3.25Å; W94-M97 PolarHBondContact O-N 3.21Å; K95-M97 VanDerWaalsContact C-N 3.26Å; K95-M97 PolarHBondContact O-N 3.37Å; M97-L99 VanDerWaalsContact C-N 3.34Å; M97-L99 PolarHBondContact O-N 2.9Å; M97-H100 WeakPolarHBondContact O-CB 3.32Å; M97-H100 PolarHBondContact O-N 3.37Å; M97-H100 VanDerWaalsContact O-N 3.13Å; M97-V101 HydrophobicContact CE-CG2 4.27Å; M97-V101 PolarHBondContact O-N 3.25Å; M97-V101 HydrophobicContact SD-CB 4.25Å; M97-V101 HydrophobicContact SD-CG2 3.26Å; M97-V101 WeakPolarHBondContact SD-CG2 3.46Å; M97-L320 HydrophobicContact CE-CD1 3.79Å; M97-L320 HydrophobicContact CE-CD2 3.84Å; M97-L320 HydrophobicContact CE-CG 4.3Å; M97-L320 HydrophobicContact CG-CD2 4.13Å; M97-L320 HydrophobicContact SD-CD2 4.37Å; M97-L327 HydrophobicContact CE-CB 3.74Å; M97-L327 HydrophobicContact CE-CD2 3.28Å; M97-L327 HydrophobicContact CE-CG 4.06Å; M97-L327 HydrophobicContact SD-CD2 4.24Å
98	L	96.8	Very high	92.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-55.3	-48.9	173.3	174.6	148.7	0	0	0	111.1	W94 K95 H100 V101 M102 I120 T220 M249 L251 L327	W94-L98 PolarHBondContact O-N 3.16Å; K95-L98 WeakPolarHBondContact O-CB 3.33Å; K95-L98 PolarHBondContact O-N 2.97Å; K95-L98 VanDerWaalsContact O-N 3.16Å; L98-H100 VanDerWaalsContact C-N 3.31Å; L98-H100 PolarHBondContact O-N 3.24Å; L98-V101 PolarHBondContact O-N 3.23Å; L98-M102 HydrophobicContact CD2-CE 3.71Å; L98-M102 VanDerWaalsContact O-CB 3.25Å; L98-M102 WeakPolarHBondContact O-CB 3.42Å; L98-M102 PolarHBondContact O-N 3.22Å; L98-I120 HydrophobicContact CD2-CD1 4.34Å; L98-I120 HydrophobicContact CD2-CG2 3.89Å; L98-T220 HydrophobicContact CD2-CG2 4.22Å; L98-M249 HydrophobicContact CG-CE 4.37Å; L98-L251 HydrophobicContact CB-CD2 4.46Å; L98-L251 HydrophobicContact CD1-CB 3.69Å; L98-L251 HydrophobicContact CD1-CD2 4.41Å; L98-L327 HydrophobicContact CB-CD1 4.35Å; L98-L327 HydrophobicContact CD1-CD1 3.91Å; L98-L327 HydrophobicContact CG-CD1 4.18Å
99	L	95.3	Very high	92.8	Very high	6 Å²	6	49.1 Å²	49.1	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-36.1	177.9	-81.1	-51.3	0	0	0	112.1	K95 D96 M97 M102 N103 P104 I120 R123 F124	K95-L99 WeakPolarHBondContact O-CD2 3.4Å; K95-L99 PolarHBondContact O-N 2.92Å; K95-L99 VanDerWaalsContact O-N 3.14Å; D96-L99 PolarHBondContact O-N 3.28Å; M97-L99 VanDerWaalsContact C-N 3.34Å; M97-L99 PolarHBondContact O-N 2.9Å; L99-M102 HydrophobicContact CD1-CE 4.13Å; L99-M102 HydrophobicContact CD1-SD 3.98Å; L99-M102 PolarHBondContact O-N 3.42Å; L99-N103 PolarHBondContact O-N 3.42Å; L99-P104 WeakPolarHBondContact O-CD 3.47Å; L99-I120 HydrophobicContact CD2-CD1 4.37Å; L99-I120 HydrophobicContact CD2-CG2 4.43Å; L99-R123 HydrophobicContact CD2-CB 3.72Å; L99-R123 HydrophobicContact CG-CB 3.93Å; L99-F124 HydrophobicContact CD1-CB 3.89Å
100	H	93.4	Very high	93.3	Very high	127 Å²	127	48 Å²	48	59%	0.588	24%	0.241	S	C	*	.	H	α-helix	trans	-64.9	-44.3	177	-173.6	59.7	0	0	0	112.4	D96 M97 L98 N103	D96-H100 WeakPolarHBondContact O-CB 3.36Å; D96-H100 PolarHBondContact O-N 2.98Å; M97-H100 WeakPolarHBondContact O-CB 3.32Å; M97-H100 PolarHBondContact O-N 3.37Å; M97-H100 VanDerWaalsContact O-N 3.13Å; L98-H100 VanDerWaalsContact C-N 3.31Å; L98-H100 PolarHBondContact O-N 3.24Å; H100-N103 PolarHBondContact O-N 3.14Å
101	V	94.3	Very high	93.6	Very high	39 Å²	39	45.6 Å²	45.6	24%	0.236	23%	0.226	C	C	.	.	H	α-helix	trans	-72.1	-33.4	177.2	169.8	0	0	0	0	111.7	M97 L98 N103 R247 M249 L327	M97-V101 HydrophobicContact CE-CG2 4.27Å; M97-V101 PolarHBondContact O-N 3.25Å; M97-V101 HydrophobicContact SD-CB 4.25Å; M97-V101 HydrophobicContact SD-CG2 3.26Å; M97-V101 WeakPolarHBondContact SD-CG2 3.46Å; L98-V101 PolarHBondContact O-N 3.23Å; V101-N103 VanDerWaalsContact C-N 3.25Å; V101-N103 PolarHBondContact O-N 3.38Å; V101-R247 PolarHBondContact O-NH1 2.97Å; V101-M249 HydrophobicContact CB-CE 4.14Å; V101-M249 HydrophobicContact CG1-CE 3.8Å; V101-L327 HydrophobicContact CB-CD2 3.77Å; V101-L327 HydrophobicContact CG1-CD2 3.71Å; V101-L327 HydrophobicContact CG2-CD2 4.09Å
102	M	95.3	Very high	94	Very high	11 Å²	11	45.2 Å²	45.2	5%	0.054	22%	0.224	C	C	.	.	H	α-helix	trans	-60	-41	172.2	-177	-170.2	-67.6	0	0	110.4	L98 L99 P104 L110 F124 V218 T220 M249	L98-M102 HydrophobicContact CD2-CE 3.71Å; L98-M102 VanDerWaalsContact O-CB 3.25Å; L98-M102 WeakPolarHBondContact O-CB 3.42Å; L98-M102 PolarHBondContact O-N 3.22Å; L99-M102 HydrophobicContact CD1-CE 4.13Å; L99-M102 HydrophobicContact CD1-SD 3.98Å; L99-M102 PolarHBondContact O-N 3.42Å; M102-P104 HydrophobicContact CG-CB 4.24Å; M102-P104 HydrophobicContact CG-CG 4.39Å; M102-P104 HydrophobicContact SD-CB 3.99Å; M102-P104 HydrophobicContact SD-CG 4.02Å; M102-L110 HydrophobicContact CE-CD1 4.16Å; M102-F124 HydrophobicContact SD-CD2 3.79Å; M102-F124 HydrophobicContact SD-CE2 4.3Å; M102-V218 HydrophobicContact CE-CG1 3.96Å; M102-V218 HydrophobicContact CG-CG1 4.27Å; M102-V218 HydrophobicContact SD-CG1 4.24Å; M102-T220 HydrophobicContact CE-CG2 3.34Å; M102-M249 HydrophobicContact CB-CE 4.03Å; M102-M249 HydrophobicContact CB-SD 3.57Å; M102-M249 VanDerWaalsContact CB-SD 3.57Å; M102-M249 HydrophobicContact CE-SD 4.31Å; M102-M249 HydrophobicContact CG-SD 3.87Å
103	N	93	Very high	94.3	Very high	83 Å²	83	40.6 Å²	40.6	44%	0.444	21%	0.207	S	C	.	.			trans	45	56.5	-176.8	-174.1	40.7	0	0	0	112.8	L99 H100 V101 Q105 Y127	L99-N103 PolarHBondContact O-N 3.42Å; H100-N103 PolarHBondContact O-N 3.14Å; V101-N103 VanDerWaalsContact C-N 3.25Å; V101-N103 PolarHBondContact O-N 3.38Å; N103-Q105 PolarHBondContact O-N 3.2Å; N103-Q105 PolarHBondContact O-NE2 2.94Å; N103-Y127 PolarHBondContact OD1-OH 3.33Å
104	P	90.8	Very high	94.4	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-66.4	135	-170.1	27.5	-34.1	0	0	0	111.6	L99 M102 I108 F124 Y127 V128	L99-P104 WeakPolarHBondContact O-CD 3.47Å; M102-P104 HydrophobicContact CG-CB 4.24Å; M102-P104 HydrophobicContact CG-CG 4.39Å; M102-P104 HydrophobicContact SD-CB 3.99Å; M102-P104 HydrophobicContact SD-CG 4.02Å; P104-I108 HydrophobicContact CB-CD1 4.09Å; P104-F124 HydrophobicContact CB-CD2 3.65Å; P104-F124 HydrophobicContact CB-CE2 3.36Å; P104-F124 HydrophobicContact CB-CZ 4.49Å; P104-F124 HydrophobicContact CG-CD2 3.8Å; P104-F124 HydrophobicContact CG-CE2 4.04Å; P104-Y127 HydrophobicContact CG-CD1 3.5Å; P104-Y127 VanDerWaalsContact CG-CD1 3.5Å; P104-Y127 HydrophobicContact CG-CE1 3.83Å; P104-Y127 HydrophobicContact CG-CG 4.25Å; P104-V128 HydrophobicContact CB-CG2 3.95Å; P104-V128 HydrophobicContact CG-CG2 4.02Å
105	Q	86.9	Confident	94.2	Very high	105 Å²	105	36.9 Å²	36.9	49%	0.491	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-92.5	156.1	172.9	-59.6	-54.4	-51.1	0	0	110.7	N103 I108	N103-Q105 PolarHBondContact O-N 3.2Å; N103-Q105 PolarHBondContact O-NE2 2.94Å; Q105-I108 HydrophobicContact CB-CD1 4.3Å; Q105-I108 VanDerWaalsContact N-CD1 3.27Å; Q105-I108 WeakPolarHBondContact O-CG1 3.47Å
106	P	85.9	Confident	94	Very high	58 Å²	58	36.5 Å²	36.5	38%	0.377	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	138.9	170.2	-23.9	34.8	0	0	0	112.4	V128 Q132	P106-V128 HydrophobicContact CB-CG1 4.21Å; P106-V128 HydrophobicContact CG-CG1 4.17Å; P106-Q132 HydrophobicContact CB-CG 4.14Å; P106-Q132 HydrophobicContact CG-CG 3.78Å
107	G	89.2	Confident	94	Very high	22 Å²	22	33.1 Å²	33.1	23%	0.227	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.9	-3.5	178.2	0	0	0	0	0	114.8	R169 S171	G107-R169 WeakPolarHBondContact CA-O 3.44Å; G107-R169 PolarHBondContact N-O 2.78Å; G107-S171 PolarHBondContact N-OG 2.92Å
108	I	93.3	Very high	93.9	Very high	30 Å²	30	31.1 Å²	31.1	15%	0.154	17%	0.167	C	C	.	.			trans	-67.2	138	176.5	-74.3	178.9	0	0	0	111	P104 Q105 F124 S171 R172 D217 V218	P104-I108 HydrophobicContact CB-CD1 4.09Å; Q105-I108 HydrophobicContact CB-CD1 4.3Å; Q105-I108 VanDerWaalsContact N-CD1 3.27Å; Q105-I108 WeakPolarHBondContact O-CG1 3.47Å; I108-F124 HydrophobicContact CB-CE2 4.28Å; I108-F124 HydrophobicContact CB-CZ 4.04Å; I108-F124 HydrophobicContact CG2-CE2 3.81Å; I108-F124 HydrophobicContact CG2-CZ 3.76Å; I108-S171 WeakPolarHBondContact O-CA 3.5Å; I108-R172 PolarHBondContact O-N 3.15Å; I108-R172 VanDerWaalsContact O-N 3.07Å; I108-D217 HydrophobicContact CG2-CB 4.19Å; I108-V218 HydrophobicContact CD1-CG2 4.44Å; I108-V218 HydrophobicContact CG2-CB 4.38Å; I108-V218 HydrophobicContact CG2-CG2 3.85Å
109	R	97	Very high	93.7	Very high	114 Å²	114	32 Å²	32	43%	0.43	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	113.7	163.5	-61.8	-172.2	-177.8	-172.1	0.6	109.9	R172 F216 D217 V218	R109-R172 CarbonylContact C-O 3.46Å; R109-R172 WeakPolarHBondContact CA-O 3.25Å; R109-F216 HydrophobicContact CB-CD1 4.28Å; R109-D217 WeakPolarHBondContact CB-OD2 3.44Å; R109-D217 PolarHBondContact N-OD2 3.49Å; R109-D217 PolarHBondContact O-N 2.96Å; R109-V218 PolarHBondContact O-N 3.4Å
110	L	98.4	Very high	93.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.4	176.7	173.3	67.6	0	0	0	110.2	M102 F124 R172 A173 V174 V218 T220	M102-L110 HydrophobicContact CE-CD1 4.16Å; L110-F124 HydrophobicContact CB-CD1 4.27Å; L110-F124 HydrophobicContact CB-CD2 4.45Å; L110-F124 HydrophobicContact CB-CE1 4.04Å; L110-F124 HydrophobicContact CB-CE2 4.21Å; L110-F124 HydrophobicContact CB-CG 4.48Å; L110-F124 HydrophobicContact CB-CZ 4.02Å; L110-F124 HydrophobicContact CD2-CB 3.65Å; L110-F124 HydrophobicContact CD2-CD1 3.81Å; L110-F124 HydrophobicContact CD2-CD2 3.89Å; L110-F124 HydrophobicContact CD2-CE1 4.43Å; L110-F124 HydrophobicContact CD2-CE2 4.48Å; L110-F124 HydrophobicContact CD2-CG 3.52Å; L110-R172 PolarHBondContact N-O 3.21Å; L110-A173 HydrophobicContact CB-CB 4.27Å; L110-A173 HydrophobicContact CD2-CB 4.17Å; L110-A173 CarbonylContact O-C 3.56Å; L110-A173 WeakPolarHBondContact O-CA 3.3Å; L110-V174 PolarHBondContact O-N 2.68Å; L110-V218 WeakPolarHBondContact CA-O 3.38Å; L110-V218 HydrophobicContact CD1-CB 3.92Å; L110-V218 HydrophobicContact CD1-CG1 3.71Å; L110-T220 HydrophobicContact CD1-CG2 3.81Å
111	L	98.7	Very high	94	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.8	160.8	177.7	62	0	0	0	109.2	V113 V174 C176 L209 F211 F216 V218 Y219 T220 V241	L111-V113 HydrophobicContact CD1-CG2 4.23Å; L111-V113 HydrophobicContact CD2-CG2 3.83Å; L111-V113 HydrophobicContact CG-CG2 3.7Å; L111-V174 HydrophobicContact CD1-CB 4.08Å; L111-V174 HydrophobicContact CD1-CG1 4.07Å; L111-C176 HydrophobicContact CD1-CB 3.98Å; L111-L209 HydrophobicContact CD2-CD1 4.13Å; L111-F211 HydrophobicContact CD1-CD2 4.2Å; L111-F211 HydrophobicContact CD1-CE2 3.47Å; L111-F211 VanDerWaalsContact CD1-CE2 3.47Å; L111-F211 HydrophobicContact CD1-CZ 3.8Å; L111-F211 HydrophobicContact CD2-CD2 3.91Å; L111-F211 HydrophobicContact CD2-CE2 3.94Å; L111-F211 HydrophobicContact CG-CE2 4.38Å; L111-F216 HydrophobicContact CB-CB 4.23Å; L111-F216 HydrophobicContact CB-CD1 3.6Å; L111-F216 HydrophobicContact CB-CD2 3.91Å; L111-F216 HydrophobicContact CB-CE1 3.84Å; L111-F216 HydrophobicContact CB-CE2 4.14Å; L111-F216 HydrophobicContact CB-CG 3.63Å; L111-F216 HydrophobicContact CB-CZ 4.1Å; L111-F216 HydrophobicContact CD1-CE1 4.4Å; L111-F216 HydrophobicContact CD1-CE2 4.41Å; L111-F216 HydrophobicContact CD1-CZ 4.11Å; L111-F216 HydrophobicContact CD2-CD2 3.92Å; L111-F216 HydrophobicContact CD2-CE2 3.84Å; L111-F216 HydrophobicContact CD2-CG 4.48Å; L111-F216 HydrophobicContact CD2-CZ 4.35Å; L111-F216 HydrophobicContact CG-CD2 4.46Å; L111-F216 HydrophobicContact CG-CE2 4.36Å; L111-F216 HydrophobicContact CG-CZ 4.41Å; L111-V218 PolarHBondContact N-O 2.84Å; L111-Y219 HydrophobicContact CD2-CD2 3.86Å; L111-Y219 HydrophobicContact CD2-CE2 4Å; L111-Y219 HydrophobicContact CG-CD2 4.39Å; L111-Y219 CarbonylContact O-C 3.35Å; L111-Y219 WeakPolarHBondContact O-CA 3.49Å; L111-T220 PolarHBondContact O-N 3.09Å; L111-T220 PolarHBondContact O-OG1 2.92Å; L111-V241 HydrophobicContact CD2-CG2 3.79Å
112	D	98.6	Very high	94	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	96.8	-179.4	-171	28.9	0	0	0	109.6	S121 V174 V175 C176 T220	D112-S121 WeakPolarHBondContact CB-OG 3.44Å; D112-S121 PolarHBondContact OD2-N 3.46Å; D112-S121 PolarHBondContact OD2-OG 3.33Å; D112-V174 PolarHBondContact N-O 3.18Å; D112-V175 WeakPolarHBondContact O-CA 3.48Å; D112-C176 PolarHBondContact O-N 3.39Å; D112-T220 WeakPolarHBondContact CA-O 3.38Å; D112-T220 WeakPolarHBondContact CA-OG1 3.45Å; D112-T220 PolarHBondContact OD1-OG1 2.71Å
113	V	98.6	Very high	94	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.018	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	143.2	-174.9	-176	0	0	0	0	110.9	L111 G115 C176 A206 L209 Y219 T220 I221	L111-V113 HydrophobicContact CD1-CG2 4.23Å; L111-V113 HydrophobicContact CD2-CG2 3.83Å; L111-V113 HydrophobicContact CG-CG2 3.7Å; V113-G115 PolarHBondContact O-N 2.99Å; V113-C176 CarbonylContact C-O 3.41Å; V113-C176 WeakPolarHBondContact CA-O 3.42Å; V113-C176 HydrophobicContact CG2-CB 4.46Å; V113-A206 HydrophobicContact CG1-CB 3.63Å; V113-L209 HydrophobicContact CG1-CD2 4.3Å; V113-L209 HydrophobicContact CG2-CD1 4.47Å; V113-L209 HydrophobicContact CG2-CD2 4.08Å; V113-Y219 HydrophobicContact CB-CE1 4.34Å; V113-Y219 HydrophobicContact CB-CE2 4.28Å; V113-Y219 WeakPolarHBondContact CB-OH 3.43Å; V113-Y219 HydrophobicContact CG2-CD2 4.22Å; V113-Y219 HydrophobicContact CG2-CE1 4.23Å; V113-Y219 HydrophobicContact CG2-CE2 3.39Å; V113-Y219 WeakPolarHBondContact CG2-OH 3.28Å; V113-T220 PolarHBondContact N-O 3.31Å; V113-I221 HydrophobicContact CB-CD1 4.38Å; V113-I221 HydrophobicContact CG1-CD1 4.19Å; V113-I221 WeakPolarHBondContact O-CG1 3.49Å
114	A	96.4	Very high	94.2	Very high	34 Å²	34	21.7 Å²	21.7	28%	0.281	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	30.6	-168.8	0	0	0	0	0	112	C176 D177 I221	A114-C176 PolarHBondContact N-O 3.19Å; A114-D177 WeakPolarHBondContact CA-OD2 3.48Å; A114-I221 HydrophobicContact CB-CD1 4.11Å; A114-I221 HydrophobicContact CB-CG1 4.22Å
115	G	92.1	Very high	94.3	Very high	10 Å²	10	22.5 Å²	22.5	10%	0.103	12%	0.121	C	C	.	.			trans	-97.6	24.9	-173.7	0	0	0	0	0	112.8	V113 T117 G118 V175 C176 D177	V113-G115 PolarHBondContact O-N 2.99Å; G115-T117 PolarHBondContact O-N 2.64Å; G115-G118 WeakPolarHBondContact O-CA 3.43Å; G115-G118 PolarHBondContact O-N 2.84Å; G115-V175 WeakPolarHBondContact O-CG1 3.21Å; G115-C176 PolarHBondContact N-O 3.14Å; G115-D177 PolarHBondContact N-OD2 3.47Å
116	G	91.6	Very high	94.6	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.01	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-29.7	-159.9	0	0	0	0	0	117.1	G118 D177 M182 L183 G186 W201	G116-G118 VanDerWaalsContact C-N 3.31Å; G116-G118 PolarHBondContact O-N 3.33Å; G116-D177 VanDerWaalsContact CA-OD2 3.26Å; G116-D177 WeakPolarHBondContact CA-OD2 3.47Å; G116-D177 PolarHBondContact N-OD2 3.48Å; G116-M182 CarbonylContact C-O 3.58Å; G116-M182 CarbonylContact O-C 3.54Å; G116-L183 WeakPolarHBondContact O-CA 3.2Å; G116-G186 WeakPolarHBondContact O-CA 3.13Å; G116-W201 VanDerWaalsContact O-CZ3 3.3Å; G116-W201 WeakPolarHBondContact O-CZ3 3.01Å
117	T	92.7	Very high	94.9	Very high	8 Å²	8	20.2 Å²	20.2	5%	0.049	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.9	174.7	59.2	0	0	0	0	114.6	Y79 G115 D119 M182 V185	Y79-T117 HydrophobicContact CD1-CG2 3.94Å; G115-T117 PolarHBondContact O-N 2.64Å; T117-D119 VanDerWaalsContact C-N 3.32Å; T117-D119 PolarHBondContact O-N 3.41Å; T117-M182 HydrophobicContact CG2-CE 3.86Å; T117-V185 HydrophobicContact CG2-CG1 4.34Å
118	G	93.9	Very high	94.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.			trans	71.1	12.9	177.2	0	0	0	0	0	115.4	G115 G116 I120 S121 L122	G115-G118 WeakPolarHBondContact O-CA 3.43Å; G115-G118 PolarHBondContact O-N 2.84Å; G116-G118 VanDerWaalsContact C-N 3.31Å; G116-G118 PolarHBondContact O-N 3.33Å; G118-I120 PolarHBondContact O-N 3.17Å; G118-S121 PolarHBondContact O-N 2.82Å; G118-L122 VanDerWaalsContact O-CB 3.27Å; G118-L122 WeakPolarHBondContact O-CB 3.34Å; G118-L122 WeakPolarHBondContact O-CG 3.16Å; G118-L122 PolarHBondContact O-N 3.22Å
119	D	93.4	Very high	94.7	Very high	18 Å²	18	22.9 Å²	22.9	10%	0.096	11%	0.107	C	C	.	.	H	α-helix	trans	-60.1	-40.9	-172.6	-170.9	31.6	0	0	0	112.9	K95 T117 R123	K95-D119 WeakPolarHBondContact CD-OD2 3.38Å; K95-D119 WeakPolarHBondContact CE-OD2 3.12Å; K95-D119 IonicContact NZ-OD2 3.09Å; K95-D119 PolarHBondContact NZ-OD2 3.08Å; T117-D119 VanDerWaalsContact C-N 3.32Å; T117-D119 PolarHBondContact O-N 3.41Å; D119-R123 WeakPolarHBondContact O-CB 3.23Å; D119-R123 WeakPolarHBondContact O-CD 3.26Å; D119-R123 WeakPolarHBondContact O-CG 3.42Å; D119-R123 PolarHBondContact O-N 2.87Å; D119-R123 IonicContact OD1-CZ 2.82Å; D119-R123 IonicContact OD1-NE 3.19Å; D119-R123 PolarHBondContact OD1-NE 3.17Å; D119-R123 IonicContact OD1-NH2 3.49Å; D119-R123 PolarHBondContact OD1-NH2 3.03Å; D119-R123 IonicContact OD2-CZ 3.92Å; D119-R123 IonicContact OD2-NE 3.22Å; D119-R123 PolarHBondContact OD2-NE 3.13Å; D119-R123 IonicContact OD2-NH2 3.78Å; D119-R123 PolarHBondContact OD2-NH2 2.89Å
120	I	96.6	Very high	94.3	Very high	5 Å²	5	19.8 Å²	19.8	3%	0.026	10%	0.103	C	C	.	.	H	α-helix	trans	-70.6	-49.5	176.8	-59.6	-56	0	0	0	110.7	K95 L98 L99 G118 L122 R123 F124 T220 A222	K95-I120 HydrophobicContact CB-CD1 3.79Å; K95-I120 HydrophobicContact CD-CD1 3.89Å; K95-I120 HydrophobicContact CG-CD1 3.71Å; L98-I120 HydrophobicContact CD2-CD1 4.34Å; L98-I120 HydrophobicContact CD2-CG2 3.89Å; L99-I120 HydrophobicContact CD2-CD1 4.37Å; L99-I120 HydrophobicContact CD2-CG2 4.43Å; G118-I120 PolarHBondContact O-N 3.17Å; I120-L122 PolarHBondContact O-N 2.85Å; I120-R123 WeakPolarHBondContact O-CB 3.42Å; I120-R123 PolarHBondContact O-N 3.28Å; I120-R123 VanDerWaalsContact O-N 3.15Å; I120-F124 WeakPolarHBondContact O-CB 3.49Å; I120-F124 PolarHBondContact O-N 2.97Å; I120-T220 HydrophobicContact CG2-CG2 4.34Å; I120-A222 HydrophobicContact CD1-CB 4.2Å; I120-A222 HydrophobicContact CG1-CB 3.83Å
121	S	96.9	Very high	93.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58	-42.8	178.8	-68.5	0	0	0	0	113.6	D112 G118 F124 L125 V175	D112-S121 WeakPolarHBondContact CB-OG 3.44Å; D112-S121 PolarHBondContact OD2-N 3.46Å; D112-S121 PolarHBondContact OD2-OG 3.33Å; G118-S121 PolarHBondContact O-N 2.82Å; S121-F124 WeakPolarHBondContact O-CB 3.23Å; S121-F124 PolarHBondContact O-N 3.22Å; S121-L125 WeakPolarHBondContact O-CG 3.46Å; S121-L125 PolarHBondContact O-N 2.78Å; S121-V175 VanDerWaalsContact OG-CG2 3.28Å; S121-V175 WeakPolarHBondContact OG-CG2 3.34Å
122	L	95.5	Very high	93	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-65.6	-40.8	175.6	-70.3	168	0	0	0	111.6	G118 I120 N126 K189 A190 M193 V195 L199	G118-L122 VanDerWaalsContact O-CB 3.27Å; G118-L122 WeakPolarHBondContact O-CB 3.34Å; G118-L122 WeakPolarHBondContact O-CG 3.16Å; G118-L122 PolarHBondContact O-N 3.22Å; I120-L122 PolarHBondContact O-N 2.85Å; L122-N126 WeakPolarHBondContact O-CB 3.45Å; L122-N126 PolarHBondContact O-N 3.19Å; L122-N126 VanDerWaalsContact O-N 3.07Å; L122-N126 PolarHBondContact O-ND2 3.46Å; L122-N126 VanDerWaalsContact O-ND2 3.13Å; L122-K189 HydrophobicContact CD1-CD 4.32Å; L122-K189 HydrophobicContact CD1-CG 4.33Å; L122-A190 HydrophobicContact CD2-CB 4.05Å; L122-M193 HydrophobicContact CD1-SD 4.05Å; L122-V195 HydrophobicContact CD2-CB 4.23Å; L122-V195 HydrophobicContact CD2-CG1 4.27Å; L122-V195 HydrophobicContact CD2-CG2 3.88Å; L122-L199 HydrophobicContact CD2-CD2 4Å
123	R	95.3	Very high	92.3	Very high	42 Å²	42	29.6 Å²	29.6	16%	0.158	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-41.1	174.2	-73.8	169.4	-166.8	-107.9	5.3	111.9	R92 D96 L99 D119 I120 N126 Y127	R92-R123 PolarHBondContact O-NH1 3.44Å; D96-R123 VanDerWaalsContact CG-NH1 3.35Å; D96-R123 IonicContact OD1-CZ 2.74Å; D96-R123 IonicContact OD1-NH1 3.7Å; D96-R123 PolarHBondContact OD1-NH1 3.07Å; D96-R123 IonicContact OD2-NH1 3.39Å; L99-R123 HydrophobicContact CD2-CB 3.72Å; L99-R123 HydrophobicContact CG-CB 3.93Å; D119-R123 WeakPolarHBondContact O-CB 3.23Å; D119-R123 WeakPolarHBondContact O-CD 3.26Å; D119-R123 WeakPolarHBondContact O-CG 3.42Å; D119-R123 PolarHBondContact O-N 2.87Å; D119-R123 IonicContact OD1-CZ 2.82Å; D119-R123 IonicContact OD1-NE 3.19Å; D119-R123 PolarHBondContact OD1-NE 3.17Å; D119-R123 IonicContact OD1-NH2 3.49Å; D119-R123 PolarHBondContact OD1-NH2 3.03Å; D119-R123 IonicContact OD2-CZ 3.92Å; D119-R123 IonicContact OD2-NE 3.22Å; D119-R123 PolarHBondContact OD2-NE 3.13Å; D119-R123 IonicContact OD2-NH2 3.78Å; D119-R123 PolarHBondContact OD2-NH2 2.89Å; I120-R123 WeakPolarHBondContact O-CB 3.42Å; I120-R123 PolarHBondContact O-N 3.28Å; I120-R123 VanDerWaalsContact O-N 3.15Å; R123-N126 PolarHBondContact O-N 3.48Å; R123-Y127 VanDerWaalsContact O-CB 3.29Å; R123-Y127 WeakPolarHBondContact O-CB 3.35Å; R123-Y127 PolarHBondContact O-N 2.88Å
124	F	96.1	Very high	91.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.4	-52.2	175.9	165.8	-94.9	0	0	0	111.3	L99 M102 P104 I108 L110 I120 S121 N126 Y127 V128 A173	L99-F124 HydrophobicContact CD1-CB 3.89Å; M102-F124 HydrophobicContact SD-CD2 3.79Å; M102-F124 HydrophobicContact SD-CE2 4.3Å; P104-F124 HydrophobicContact CB-CD2 3.65Å; P104-F124 HydrophobicContact CB-CE2 3.36Å; P104-F124 HydrophobicContact CB-CZ 4.49Å; P104-F124 HydrophobicContact CG-CD2 3.8Å; P104-F124 HydrophobicContact CG-CE2 4.04Å; I108-F124 HydrophobicContact CB-CE2 4.28Å; I108-F124 HydrophobicContact CB-CZ 4.04Å; I108-F124 HydrophobicContact CG2-CE2 3.81Å; I108-F124 HydrophobicContact CG2-CZ 3.76Å; L110-F124 HydrophobicContact CB-CD1 4.27Å; L110-F124 HydrophobicContact CB-CD2 4.45Å; L110-F124 HydrophobicContact CB-CE1 4.04Å; L110-F124 HydrophobicContact CB-CE2 4.21Å; L110-F124 HydrophobicContact CB-CG 4.48Å; L110-F124 HydrophobicContact CB-CZ 4.02Å; L110-F124 HydrophobicContact CD2-CB 3.65Å; L110-F124 HydrophobicContact CD2-CD1 3.81Å; L110-F124 HydrophobicContact CD2-CD2 3.89Å; L110-F124 HydrophobicContact CD2-CE1 4.43Å; L110-F124 HydrophobicContact CD2-CE2 4.48Å; L110-F124 HydrophobicContact CD2-CG 3.52Å; I120-F124 WeakPolarHBondContact O-CB 3.49Å; I120-F124 PolarHBondContact O-N 2.97Å; S121-F124 WeakPolarHBondContact O-CB 3.23Å; S121-F124 PolarHBondContact O-N 3.22Å; F124-N126 PolarHBondContact O-N 3.43Å; F124-Y127 WeakPolarHBondContact O-CB 3.35Å; F124-Y127 PolarHBondContact O-N 3.36Å; F124-Y127 VanDerWaalsContact O-N 3.17Å; F124-V128 HydrophobicContact CD2-CG2 4.34Å; F124-V128 HydrophobicContact CE2-CG2 4.03Å; F124-V128 HydrophobicContact CZ-CG2 4.12Å; F124-V128 WeakPolarHBondContact O-CG2 3.48Å; F124-V128 PolarHBondContact O-N 3.04Å; F124-A173 HydrophobicContact CD1-CB 4.03Å; F124-A173 HydrophobicContact CE1-CB 4.32Å
125	L	94	Very high	91.1	Very high	17 Å²	17	38.5 Å²	38.5	9%	0.089	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-43.7	-179.4	-68.4	175.8	0	0	0	111.9	S121 Y127 V128 R129 A173 V195 L199	S121-L125 WeakPolarHBondContact O-CG 3.46Å; S121-L125 PolarHBondContact O-N 2.78Å; L125-Y127 VanDerWaalsContact C-N 3.35Å; L125-Y127 PolarHBondContact O-N 3.25Å; L125-V128 PolarHBondContact O-N 3.41Å; L125-R129 WeakPolarHBondContact O-CB 3.17Å; L125-R129 PolarHBondContact O-N 2.88Å; L125-A173 HydrophobicContact CD2-CB 4.42Å; L125-A173 HydrophobicContact CG-CB 4.36Å; L125-V195 HydrophobicContact CD1-CG1 4.12Å; L125-L199 HydrophobicContact CD1-CB 3.89Å; L125-L199 HydrophobicContact CD1-CD1 4.13Å; L125-L199 HydrophobicContact CD1-CG 4.47Å
126	N	92.1	Very high	90.6	Very high	66 Å²	66	41 Å²	41	35%	0.353	20%	0.203	S	C	.	.	H	α-helix	trans	-62.9	-41.1	175.7	-75	-32.2	0	0	0	112.1	L122 R123 F124 S130	L122-N126 WeakPolarHBondContact O-CB 3.45Å; L122-N126 PolarHBondContact O-N 3.19Å; L122-N126 VanDerWaalsContact O-N 3.07Å; L122-N126 PolarHBondContact O-ND2 3.46Å; L122-N126 VanDerWaalsContact O-ND2 3.13Å; R123-N126 PolarHBondContact O-N 3.48Å; F124-N126 PolarHBondContact O-N 3.43Å; N126-S130 WeakPolarHBondContact O-CB 3.26Å; N126-S130 PolarHBondContact O-N 2.78Å
127	Y	91.9	Very high	90.3	Very high	50 Å²	50	49.3 Å²	49.3	20%	0.196	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-51.5	177.1	-176.2	-82.4	0	0	0	110.7	N103 P104 R123 F124 L125 S130 Q131	N103-Y127 PolarHBondContact OD1-OH 3.33Å; P104-Y127 HydrophobicContact CG-CD1 3.5Å; P104-Y127 VanDerWaalsContact CG-CD1 3.5Å; P104-Y127 HydrophobicContact CG-CE1 3.83Å; P104-Y127 HydrophobicContact CG-CG 4.25Å; R123-Y127 VanDerWaalsContact O-CB 3.29Å; R123-Y127 WeakPolarHBondContact O-CB 3.35Å; R123-Y127 PolarHBondContact O-N 2.88Å; F124-Y127 WeakPolarHBondContact O-CB 3.35Å; F124-Y127 PolarHBondContact O-N 3.36Å; F124-Y127 VanDerWaalsContact O-N 3.17Å; L125-Y127 VanDerWaalsContact C-N 3.35Å; L125-Y127 PolarHBondContact O-N 3.25Å; Y127-S130 PolarHBondContact O-N 3.18Å; Y127-S130 PolarHBondContact O-OG 2.84Å; Y127-Q131 HydrophobicContact CD1-CG 4.01Å; Y127-Q131 HydrophobicContact CE1-CG 3.72Å; Y127-Q131 WeakPolarHBondContact O-CG 3.31Å; Y127-Q131 PolarHBondContact O-N 3.18Å
128	V	90.8	Very high	89.8	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-43.7	-177.3	177.2	0	0	0	0	111.5	P104 P106 F124 L125 S130 Q131 Q132 S171	P104-V128 HydrophobicContact CB-CG2 3.95Å; P104-V128 HydrophobicContact CG-CG2 4.02Å; P106-V128 HydrophobicContact CB-CG1 4.21Å; P106-V128 HydrophobicContact CG-CG1 4.17Å; F124-V128 HydrophobicContact CD2-CG2 4.34Å; F124-V128 HydrophobicContact CE2-CG2 4.03Å; F124-V128 HydrophobicContact CZ-CG2 4.12Å; F124-V128 WeakPolarHBondContact O-CG2 3.48Å; F124-V128 PolarHBondContact O-N 3.04Å; L125-V128 PolarHBondContact O-N 3.41Å; V128-S130 VanDerWaalsContact C-N 3.29Å; V128-S130 PolarHBondContact O-N 3.34Å; V128-Q131 WeakPolarHBondContact O-CB 3.38Å; V128-Q131 PolarHBondContact O-N 3.15Å; V128-Q132 HydrophobicContact CG1-CG 4.44Å; V128-Q132 WeakPolarHBondContact O-CG 3.4Å; V128-Q132 PolarHBondContact O-N 3.33Å; V128-S171 WeakPolarHBondContact CG1-OG 3.2Å
129	R	88.6	Confident	89.1	Confident	106 Å²	106	61 Å²	61	40%	0.4	29%	0.285	S	S	.	.	H	α-helix	trans	-55.5	-45.8	174.3	-174.3	-176.2	-65.6	173.4	-1.8	111.3	L125 Q131 Q132 E133	L125-R129 WeakPolarHBondContact O-CB 3.17Å; L125-R129 PolarHBondContact O-N 2.88Å; R129-Q131 VanDerWaalsContact C-N 3.29Å; R129-Q131 PolarHBondContact O-N 3.42Å; R129-Q132 PolarHBondContact O-N 3.26Å; R129-E133 WeakPolarHBondContact O-CG 3.32Å; R129-E133 PolarHBondContact O-N 2.92Å
130	S	87.8	Confident	88.4	Confident	48 Å²	48	62.5 Å²	62.5	34%	0.336	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-33.5	178	81.5	0	0	0	0	113.1	N126 Y127 V128 R134	N126-S130 WeakPolarHBondContact O-CB 3.26Å; N126-S130 PolarHBondContact O-N 2.78Å; Y127-S130 PolarHBondContact O-N 3.18Å; Y127-S130 PolarHBondContact O-OG 2.84Å; V128-S130 VanDerWaalsContact C-N 3.29Å; V128-S130 PolarHBondContact O-N 3.34Å; S130-R134 WeakPolarHBondContact O-CD 3.39Å; S130-R134 WeakPolarHBondContact O-CG 3.37Å; S130-R134 PolarHBondContact O-N 2.81Å; S130-R134 VanDerWaalsContact O-N 3.14Å
131	Q	84.8	Confident	87.7	Confident	51 Å²	51	71.2 Å²	71.2	24%	0.238	33%	0.333	C	S	.	.	H	α-helix	trans	-70.1	-44.7	175.5	-68.4	-66.4	-20.5	0	0	111.1	Y127 V128 R129 E133 R134 V135	Y127-Q131 HydrophobicContact CD1-CG 4.01Å; Y127-Q131 HydrophobicContact CE1-CG 3.72Å; Y127-Q131 WeakPolarHBondContact O-CG 3.31Å; Y127-Q131 PolarHBondContact O-N 3.18Å; V128-Q131 WeakPolarHBondContact O-CB 3.38Å; V128-Q131 PolarHBondContact O-N 3.15Å; R129-Q131 VanDerWaalsContact C-N 3.29Å; R129-Q131 PolarHBondContact O-N 3.42Å; Q131-E133 VanDerWaalsContact C-N 3.35Å; Q131-E133 PolarHBondContact O-N 3.4Å; Q131-R134 WeakPolarHBondContact O-CB 3.46Å; Q131-R134 PolarHBondContact O-N 3.48Å; Q131-R134 VanDerWaalsContact O-N 3.14Å; Q131-V135 WeakPolarHBondContact O-CG2 3.36Å; Q131-V135 PolarHBondContact O-N 2.81Å
132	Q	84.5	Confident	86.6	Confident	69 Å²	69	73.8 Å²	73.8	32%	0.322	35%	0.354	S	S	.	.	H	α-helix	trans	-58.1	-46.8	175.8	-70.6	175.5	-39.2	0	0	111.3	P106 V128 R129 R134 V135 A136	P106-Q132 HydrophobicContact CB-CG 4.14Å; P106-Q132 HydrophobicContact CG-CG 3.78Å; V128-Q132 HydrophobicContact CG1-CG 4.44Å; V128-Q132 WeakPolarHBondContact O-CG 3.4Å; V128-Q132 PolarHBondContact O-N 3.33Å; R129-Q132 PolarHBondContact O-N 3.26Å; Q132-R134 VanDerWaalsContact C-N 3.29Å; Q132-R134 PolarHBondContact O-N 2.91Å; Q132-V135 PolarHBondContact O-N 2.82Å; Q132-A136 WeakPolarHBondContact O-CB 3.24Å; Q132-A136 PolarHBondContact O-N 2.93Å
133	E	85.5	Confident	85.6	Confident	87 Å²	87	79.5 Å²	79.5	41%	0.407	39%	0.385	S	S	.	.	H	α-helix	trans	-59.7	-38.7	176	-73.7	179.1	-156.9	0	0	112.5	R129 Q131 R137	R129-E133 WeakPolarHBondContact O-CG 3.32Å; R129-E133 PolarHBondContact O-N 2.92Å; Q131-E133 VanDerWaalsContact C-N 3.35Å; Q131-E133 PolarHBondContact O-N 3.4Å; E133-R137 WeakPolarHBondContact O-CB 3.31Å; E133-R137 VanDerWaalsContact O-CG 3.22Å; E133-R137 WeakPolarHBondContact O-CG 3.35Å; E133-R137 PolarHBondContact O-N 2.9Å; E133-R137 IonicContact OE2-NH2 3.38Å; E133-R137 PolarHBondContact OE2-NH2 2.79Å
134	R	85.6	Confident	84.6	Confident	141 Å²	141	85 Å²	85	53%	0.532	41%	0.412	S	S	.	.	H	α-helix	trans	-68	-40.2	178	-73	169.5	105.6	-174.6	6.2	112	S130 Q131 Q132 R138	S130-R134 WeakPolarHBondContact O-CD 3.39Å; S130-R134 WeakPolarHBondContact O-CG 3.37Å; S130-R134 PolarHBondContact O-N 2.81Å; S130-R134 VanDerWaalsContact O-N 3.14Å; Q131-R134 WeakPolarHBondContact O-CB 3.46Å; Q131-R134 PolarHBondContact O-N 3.48Å; Q131-R134 VanDerWaalsContact O-N 3.14Å; Q132-R134 VanDerWaalsContact C-N 3.29Å; Q132-R134 PolarHBondContact O-N 2.91Å; R134-R138 WeakPolarHBondContact O-CB 3.44Å; R134-R138 VanDerWaalsContact O-CG 3.28Å; R134-R138 WeakPolarHBondContact O-CG 3.16Å; R134-R138 PolarHBondContact O-N 2.91Å; R134-R138 VanDerWaalsContact O-N 3.07Å
135	V	83.1	Confident	83.5	Confident	84 Å²	84	90 Å²	90	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-64.6	-50.8	174.8	173.8	0	0	0	0	109.6	Q131 Q132 R137 R138 T139	Q131-V135 WeakPolarHBondContact O-CG2 3.36Å; Q131-V135 PolarHBondContact O-N 2.81Å; Q132-V135 PolarHBondContact O-N 2.82Å; V135-R137 VanDerWaalsContact C-N 3.34Å; V135-R137 PolarHBondContact O-N 2.83Å; V135-R138 WeakPolarHBondContact O-CB 3.45Å; V135-R138 PolarHBondContact O-N 2.78Å; V135-T139 PolarHBondContact O-N 3.36Å; V135-T139 PolarHBondContact O-OG1 3.11Å; V135-T139 VanDerWaalsContact O-OG1 3.1Å
136	A	82.8	Confident	82.2	Confident	61 Å²	61	92.2 Å²	92.2	50%	0.504	46%	0.458	S	S	.	.	H	α-helix	trans	-56.4	-45.2	178.4	0	0	0	0	0	112.4	Q132 R138 T139 A140	Q132-A136 WeakPolarHBondContact O-CB 3.24Å; Q132-A136 PolarHBondContact O-N 2.93Å; A136-R138 VanDerWaalsContact C-N 3.34Å; A136-R138 PolarHBondContact O-N 3.38Å; A136-T139 PolarHBondContact O-N 2.97Å; A136-A140 VanDerWaalsContact O-CB 3.32Å; A136-A140 WeakPolarHBondContact O-CB 3.27Å; A136-A140 PolarHBondContact O-N 2.96Å
137	R	84.6	Confident	81.3	Confident	177 Å²	177	91.3 Å²	91.3	67%	0.668	46%	0.457	S	S	*	.	H	α-helix	trans	-62.7	-37.3	175.4	-73.7	178.1	-160.9	-172.5	10.6	112.8	E133 V135 R141	E133-R137 WeakPolarHBondContact O-CB 3.31Å; E133-R137 VanDerWaalsContact O-CG 3.22Å; E133-R137 WeakPolarHBondContact O-CG 3.35Å; E133-R137 PolarHBondContact O-N 2.9Å; E133-R137 IonicContact OE2-NH2 3.38Å; E133-R137 PolarHBondContact OE2-NH2 2.79Å; V135-R137 VanDerWaalsContact C-N 3.34Å; V135-R137 PolarHBondContact O-N 2.83Å; R137-R141 WeakPolarHBondContact O-CB 3.22Å; R137-R141 PolarHBondContact O-N 2.85Å
138	R	82.1	Confident	80.4	Confident	181 Å²	181	99.5 Å²	99.5	68%	0.683	49%	0.488	S	S	*	.	H	α-helix	trans	-68.7	-45.8	177.1	-78.3	175.1	176.5	-178.1	-1	111.4	R134 V135 A136 R141 A142	R134-R138 WeakPolarHBondContact O-CB 3.44Å; R134-R138 VanDerWaalsContact O-CG 3.28Å; R134-R138 WeakPolarHBondContact O-CG 3.16Å; R134-R138 PolarHBondContact O-N 2.91Å; R134-R138 VanDerWaalsContact O-N 3.07Å; V135-R138 WeakPolarHBondContact O-CB 3.45Å; V135-R138 PolarHBondContact O-N 2.78Å; A136-R138 VanDerWaalsContact C-N 3.34Å; A136-R138 PolarHBondContact O-N 3.38Å; R138-R141 PolarHBondContact O-N 3.07Å; R138-A142 WeakPolarHBondContact O-CB 3.48Å; R138-A142 PolarHBondContact O-N 3.06Å
139	T	79.1	Confident	79.7	Confident	71 Å²	71	106.5 Å²	106.5	44%	0.436	52%	0.52	S	S	.	.	H	α-helix	trans	-61.9	-44.9	176.6	-52.1	0	0	0	0	110.9	V135 A136 R141 A142 N143	V135-T139 PolarHBondContact O-N 3.36Å; V135-T139 PolarHBondContact O-OG1 3.11Å; V135-T139 VanDerWaalsContact O-OG1 3.1Å; A136-T139 PolarHBondContact O-N 2.97Å; T139-R141 VanDerWaalsContact C-N 3.3Å; T139-R141 PolarHBondContact O-N 2.86Å; T139-A142 PolarHBondContact O-N 2.86Å; T139-N143 WeakPolarHBondContact O-CB 3.44Å; T139-N143 PolarHBondContact O-N 2.86Å; T139-N143 PolarHBondContact O-OD1 3.43Å
140	A	79.4	Confident	78.7	Confident	50 Å²	50	106.8 Å²	106.8	41%	0.413	53%	0.526	S	S	.	.	H	α-helix	trans	-58.9	-41	175.2	0	0	0	0	0	112.3	A136 Q144	A136-A140 VanDerWaalsContact O-CB 3.32Å; A136-A140 WeakPolarHBondContact O-CB 3.27Å; A136-A140 PolarHBondContact O-N 2.96Å; A140-Q144 WeakPolarHBondContact O-CG 3.46Å; A140-Q144 PolarHBondContact O-N 2.89Å
141	R	80.6	Confident	78	Confident	188 Å²	188	106.9 Å²	106.9	71%	0.709	52%	0.522	S	S	*	.	H	α-helix	trans	-68.9	-39.3	176.3	-173.9	177.8	178.8	-178.3	-0	112.8	R137 R138 T139 Q144 T145	R137-R141 WeakPolarHBondContact O-CB 3.22Å; R137-R141 PolarHBondContact O-N 2.85Å; R138-R141 PolarHBondContact O-N 3.07Å; T139-R141 VanDerWaalsContact C-N 3.3Å; T139-R141 PolarHBondContact O-N 2.86Å; R141-Q144 PolarHBondContact O-N 2.9Å; R141-T145 PolarHBondContact O-N 3.45Å; R141-T145 PolarHBondContact O-OG1 3.22Å
142	A	75.8	Confident	77.3	Confident	54 Å²	54	107.4 Å²	107.4	45%	0.446	53%	0.532	S	S	.	.	H	α-helix	trans	-64.9	-44.4	176.6	0	0	0	0	0	111	R138 T139 Q144 T145	R138-A142 WeakPolarHBondContact O-CB 3.48Å; R138-A142 PolarHBondContact O-N 3.06Å; T139-A142 PolarHBondContact O-N 2.86Å; A142-Q144 PolarHBondContact O-N 2.84Å; A142-T145 CarbonylContact O-C 3.59Å; A142-T145 PolarHBondContact O-N 2.88Å
143	N	72.8	Confident	76.6	Confident	124 Å²	124	107.6 Å²	107.6	66%	0.663	54%	0.538	S	S	*	.	H	α-helix	trans	-62.9	-27.2	176.4	-70.7	3.6	0	0	0	112.9	T139 T145	T139-N143 WeakPolarHBondContact O-CB 3.44Å; T139-N143 PolarHBondContact O-N 2.86Å; T139-N143 PolarHBondContact O-OD1 3.43Å; N143-T145 VanDerWaalsContact C-N 3.34Å
144	Q	74.8	Confident	75.9	Confident	159 Å²	159	107.4 Å²	107.4	74%	0.743	55%	0.546	S	S	*	.	H	α-helix	trans	-76	-20	172.6	-74.4	174.5	4.6	0	0	113.4	A140 R141 A142	A140-Q144 WeakPolarHBondContact O-CG 3.46Å; A140-Q144 PolarHBondContact O-N 2.89Å; R141-Q144 PolarHBondContact O-N 2.9Å; A142-Q144 PolarHBondContact O-N 2.84Å
145	T	72.3	Confident	74.7	Confident	105 Å²	105	110 Å²	110	64%	0.644	56%	0.557	S	S	*	*	S	Bend	trans	-132.7	70.1	-178.1	-33.1	0	0	0	0	110	R141 A142 N143	R141-T145 PolarHBondContact O-N 3.45Å; R141-T145 PolarHBondContact O-OG1 3.22Å; A142-T145 CarbonylContact O-C 3.59Å; A142-T145 PolarHBondContact O-N 2.88Å; N143-T145 VanDerWaalsContact C-N 3.34Å
146	P	67.4	Low	73.8	Confident	63 Å²	63	111.3 Å²	111.3	41%	0.409	57%	0.565	S	S	.	*			trans	-61.9	145.9	-176.5	24.7	-32.6	0	0	0	111.2	E150 I151	P146-E150 WeakPolarHBondContact CA-OE2 3.4Å; P146-E150 HydrophobicContact CB-CB 4.27Å; P146-I151 HydrophobicContact CB-CG1 4.12Å; P146-I151 HydrophobicContact CG-CD1 4.28Å; P146-I151 HydrophobicContact CG-CG1 4.04Å
147	S	74	Confident	72.2	Confident	46 Å²	46	112.2 Å²	112.2	32%	0.322	57%	0.565	S	S	.	*			trans	-70.8	158.6	176.5	71	0	0	0	0	111.6	Q149 E150 I151	S147-Q149 PolarHBondContact O-N 3.39Å; S147-Q149 VanDerWaalsContact O-N 3.1Å; S147-E150 PolarHBondContact N-OE2 2.96Å; S147-E150 PolarHBondContact O-N 3.3Å; S147-E150 VanDerWaalsContact O-N 3.09Å; S147-E150 WeakPolarHBondContact OG-CG 2.95Å; S147-E150 PolarHBondContact OG-N 2.8Å; S147-E150 PolarHBondContact OG-OE2 3.4Å; S147-E150 VanDerWaalsContact OG-OE2 3.11Å; S147-I151 VanDerWaalsContact O-CG1 3.3Å; S147-I151 WeakPolarHBondContact O-CG1 3.18Å; S147-I151 PolarHBondContact O-N 2.76Å
148	W	72.5	Confident	70.6	Confident	223 Å²	223	109.5 Å²	109.5	85%	0.845	57%	0.57	S	S	*	*	H	α-helix	trans	-55.9	-28.6	175.4	-68.9	111.7	0	0	0	113.4	I151 S152	W148-I151 HydrophobicContact CE3-CD1 4.3Å; W148-S152 WeakPolarHBondContact O-CB 3.27Å; W148-S152 PolarHBondContact O-N 2.75Å; W148-S152 PolarHBondContact O-OG 3.16Å
149	Q	75.9	Confident	69	Low	149 Å²	149	107.6 Å²	107.6	70%	0.696	58%	0.579	S	S	*	*	H	α-helix	trans	-73.8	-40.1	177.8	-67.4	166.3	-41.4	0	0	112.1	S147 S152 T153	S147-Q149 PolarHBondContact O-N 3.39Å; S147-Q149 VanDerWaalsContact O-N 3.1Å; Q149-S152 WeakPolarHBondContact CA-OG 3.35Å; Q149-S152 PolarHBondContact O-N 2.96Å; Q149-S152 PolarHBondContact O-OG 2.63Å; Q149-T153 WeakPolarHBondContact O-CB 3.38Å; Q149-T153 PolarHBondContact O-N 3.43Å; Q149-T153 PolarHBondContact O-OG1 3.32Å
150	E	68.4	Low	67.3	Low	111 Å²	111	112.8 Å²	112.8	52%	0.519	60%	0.598	S	S	.	*	H	α-helix	trans	-68.5	-39.6	174.3	-70	161.8	156.3	0	0	110.7	P146 S147 T153 S154	P146-E150 WeakPolarHBondContact CA-OE2 3.4Å; P146-E150 HydrophobicContact CB-CB 4.27Å; S147-E150 PolarHBondContact N-OE2 2.96Å; S147-E150 PolarHBondContact O-N 3.3Å; S147-E150 VanDerWaalsContact O-N 3.09Å; S147-E150 WeakPolarHBondContact OG-CG 2.95Å; S147-E150 PolarHBondContact OG-N 2.8Å; S147-E150 PolarHBondContact OG-OE2 3.4Å; S147-E150 VanDerWaalsContact OG-OE2 3.11Å; E150-T153 PolarHBondContact O-N 3.19Å; E150-S154 PolarHBondContact O-N 3.09Å
151	I	72.1	Confident	65.4	Low	51 Å²	51	113.8 Å²	113.8	26%	0.262	61%	0.613	S	S	.	*	H	α-helix	trans	-62.3	-43.7	172.9	-64.7	165.8	0	0	0	110.5	P146 S147 W148 S154 Y155	P146-I151 HydrophobicContact CB-CG1 4.12Å; P146-I151 HydrophobicContact CG-CD1 4.28Å; P146-I151 HydrophobicContact CG-CG1 4.04Å; S147-I151 VanDerWaalsContact O-CG1 3.3Å; S147-I151 WeakPolarHBondContact O-CG1 3.18Å; S147-I151 PolarHBondContact O-N 2.76Å; W148-I151 HydrophobicContact CE3-CD1 4.3Å; I151-S154 PolarHBondContact O-OG 3.49Å; I151-Y155 HydrophobicContact CG2-CD2 4.42Å; I151-Y155 HydrophobicContact CG2-CE2 3.7Å; I151-Y155 WeakPolarHBondContact O-CD2 3.37Å; I151-Y155 WeakPolarHBondContact O-CE2 3.36Å
152	S	70.9	Confident	63.6	Low	62 Å²	62	111.9 Å²	111.9	43%	0.434	62%	0.616	S	S	.	*	H	α-helix	trans	-67.5	-38.7	178.9	64.3	0	0	0	0	112.6	W148 Q149 Y155 T156	W148-S152 WeakPolarHBondContact O-CB 3.27Å; W148-S152 PolarHBondContact O-N 2.75Å; W148-S152 PolarHBondContact O-OG 3.16Å; Q149-S152 WeakPolarHBondContact CA-OG 3.35Å; Q149-S152 PolarHBondContact O-N 2.96Å; Q149-S152 PolarHBondContact O-OG 2.63Å; S152-Y155 PolarHBondContact O-N 3.4Å; S152-T156 PolarHBondContact O-OG1 2.84Å
153	T	69.9	Low	61.8	Low	73 Å²	73	117.4 Å²	117.4	45%	0.448	63%	0.632	S	S	.	*	H	α-helix	trans	-69.7	-32.8	-178.2	-52.7	0	0	0	0	111.9	Q149 E150 Y155 T156 T157	Q149-T153 WeakPolarHBondContact O-CB 3.38Å; Q149-T153 PolarHBondContact O-N 3.43Å; Q149-T153 PolarHBondContact O-OG1 3.32Å; E150-T153 PolarHBondContact O-N 3.19Å; T153-Y155 PolarHBondContact O-N 3.15Å; T153-T156 PolarHBondContact O-N 3.33Å; T153-T156 VanDerWaalsContact O-N 3.12Å; T153-T157 PolarHBondContact O-N 2.71Å; T153-T157 PolarHBondContact O-OG1 3.28Å
154	S	70.2	Confident	60.2	Low	82 Å²	82	119.1 Å²	119.1	57%	0.573	64%	0.638	S	S	*	*	H	α-helix	trans	-66.1	-23.2	175.6	73.8	0	0	0	0	113.5	E150 I151	E150-S154 PolarHBondContact O-N 3.09Å; I151-S154 PolarHBondContact O-OG 3.49Å
155	Y	60.6	Low	58.5	Low	195 Å²	195	119.8 Å²	119.8	77%	0.765	64%	0.641	S	S	*	*	H	α-helix	trans	-83.9	-19.3	172.9	-65.8	-61.1	0	0	0	114	I151 S152 T153	I151-Y155 HydrophobicContact CG2-CD2 4.42Å; I151-Y155 HydrophobicContact CG2-CE2 3.7Å; I151-Y155 WeakPolarHBondContact O-CD2 3.37Å; I151-Y155 WeakPolarHBondContact O-CE2 3.36Å; S152-Y155 PolarHBondContact O-N 3.4Å; T153-Y155 PolarHBondContact O-N 3.15Å
156	T	64.2	Low	57.3	Low	113 Å²	113	120.2 Å²	120.2	69%	0.693	64%	0.644	S	S	*	*	H	α-helix	trans	-102.1	-14.9	-172.1	5.8	0	0	0	0	114.3	S152 T153	S152-T156 PolarHBondContact O-OG1 2.84Å; T153-T156 PolarHBondContact O-N 3.33Å; T153-T156 VanDerWaalsContact O-N 3.12Å
157	T	48.5	Very low	56.3	Low	80 Å²	80	125.9 Å²	125.9	49%	0.491	67%	0.665	S	S	.	*	S	Bend	trans	-130.5	122.3	-172.4	-1.1	0	0	0	0	111.1	T153	T153-T157 PolarHBondContact O-N 2.71Å; T153-T157 PolarHBondContact O-OG1 3.28Å
158	P	50.6	Low	55.6	Low	119 Å²	119	127.2 Å²	127.2	77%	0.773	68%	0.678	S	S	*	*			trans	-63.5	135	169.7	-15	28.6	0	0	0	110.2	E160	P158-E160 PolarHBondContact O-N 3.07Å
159	T	48.4	Very low	55.5	Low	142 Å²	142	126.5 Å²	126.5	87%	0.871	68%	0.676	S	S	*	*			trans	-67.8	94.3	-169.6	-29.5	0	0	0	0	112.4
160	E	43.7	Very low	55.9	Low	179 Å²	179	124.1 Å²	124.1	84%	0.836	67%	0.665	S	S	*	*			trans	-85.1	115.3	154	-76.2	-173.9	170.8	0	0	107.8	P158 I162	P158-E160 PolarHBondContact O-N 3.07Å; E160-I162 PolarHBondContact O-N 3.25Å
161	G	40.8	Very low	57	Low	71 Å²	71	119.2 Å²	119.2	73%	0.732	64%	0.643	S	S	*	*			trans	-65.1	103.3	-179	0	0	0	0	0	110.8	E163	G161-E163 VanDerWaalsContact C-N 3.35Å; G161-E163 PolarHBondContact O-N 2.94Å; G161-E163 VanDerWaalsContact O-N 3.14Å
162	I	41.3	Very low	58.2	Low	149 Å²	149	123.2 Å²	123.2	76%	0.764	65%	0.654	S	S	*	*			trans	-78.9	92	165	-57.7	175	0	0	0	106.4	E160 M164	E160-I162 PolarHBondContact O-N 3.25Å; I162-M164 VanDerWaalsContact C-N 3.35Å; I162-M164 HydrophobicContact CG2-CG 4.28Å; I162-M164 PolarHBondContact O-N 2.71Å
163	E	38.2	Very low	59.4	Low	170 Å²	170	120.2 Å²	120.2	79%	0.794	63%	0.634	S	S	*	*			trans	-64.5	98.3	162.1	-70.3	-178	169.1	0	0	107.5	G161 E165	G161-E163 VanDerWaalsContact C-N 3.35Å; G161-E163 PolarHBondContact O-N 2.94Å; G161-E163 VanDerWaalsContact O-N 3.14Å; E163-E165 PolarHBondContact O-N 3.09Å
164	M	39.1	Very low	60.8	Low	160 Å²	160	117.8 Å²	117.8	79%	0.788	62%	0.619	S	S	*	*			trans	-70.6	84.8	164.9	-78.8	-168.8	-168	0	0	108	I162 T166	I162-M164 VanDerWaalsContact C-N 3.35Å; I162-M164 HydrophobicContact CG2-CG 4.28Å; I162-M164 PolarHBondContact O-N 2.71Å; M164-T166 PolarHBondContact O-N 3.32Å
165	E	40.1	Very low	62.1	Low	173 Å²	173	113.9 Å²	113.9	81%	0.808	59%	0.591	S	S	*	*			trans	-66	76.8	158.6	-78.5	-173.3	153.2	0	0	108.6	E163 E167	E163-E165 PolarHBondContact O-N 3.09Å; E165-E167 VanDerWaalsContact C-N 3.35Å; E165-E167 PolarHBondContact O-N 3.37Å
166	T	45.5	Very low	63.9	Low	114 Å²	114	104.6 Å²	104.6	70%	0.699	56%	0.555	S	S	*	*			trans	-93	82.5	156.7	-30.7	0	0	0	0	105.5	M164 A168	M164-T166 PolarHBondContact O-N 3.32Å; T166-A168 PolarHBondContact O-N 2.94Å
167	E	48.3	Very low	65.5	Low	182 Å²	182	100 Å²	100	85%	0.85	53%	0.526	S	S	*	.			trans	-55.9	98.6	162.5	-95.2	-168.2	154.5	0	0	106.7	E165 R169	E165-E167 VanDerWaalsContact C-N 3.35Å; E165-E167 PolarHBondContact O-N 3.37Å; E167-R169 PolarHBondContact O-N 2.81Å
168	A	57.6	Low	67.8	Low	73 Å²	73	100 Å²	100	60%	0.603	52%	0.522	S	S	*	.			trans	-63.6	103.8	179.9	0	0	0	0	0	107.1	T166 E170	T166-A168 PolarHBondContact O-N 2.94Å; A168-E170 PolarHBondContact O-N 3.36Å
169	R	70.8	Confident	70	Confident	208 Å²	208	94.5 Å²	94.5	79%	0.785	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-49.9	120	177.8	-77.8	-177.6	160.1	175.6	-4.1	109.1	G107 E167 S171	G107-R169 WeakPolarHBondContact CA-O 3.44Å; G107-R169 PolarHBondContact N-O 2.78Å; E167-R169 PolarHBondContact O-N 2.81Å; R169-S171 PolarHBondContact O-N 2.79Å
170	E	84.9	Confident	72.2	Confident	100 Å²	100	93.8 Å²	93.8	47%	0.467	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-64.3	135.1	177.8	-165.5	-175.9	-169.4	0	0	109	A168 S197	A168-E170 PolarHBondContact O-N 3.36Å; E170-S197 PolarHBondContact OE1-OG 3.11Å
171	S	92.3	Very high	74.6	Confident	8 Å²	8	88.5 Å²	88.5	6%	0.056	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-77.4	140.6	176.5	-50	0	0	0	0	109.1	G107 I108 V128 R169	G107-S171 PolarHBondContact N-OG 2.92Å; I108-S171 WeakPolarHBondContact O-CA 3.5Å; V128-S171 WeakPolarHBondContact CG1-OG 3.2Å; R169-S171 PolarHBondContact O-N 2.79Å
172	R	95.6	Very high	77.2	Confident	134 Å²	134	85.5 Å²	85.5	51%	0.506	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.5	-177.2	-62.5	-176.9	-178.7	174.3	0	109.8	I108 R109 L110 G198	I108-R172 PolarHBondContact O-N 3.15Å; I108-R172 VanDerWaalsContact O-N 3.07Å; R109-R172 CarbonylContact C-O 3.46Å; R109-R172 WeakPolarHBondContact CA-O 3.25Å; L110-R172 PolarHBondContact N-O 3.21Å; R172-G198 CarbonylContact C-O 3.52Å; R172-G198 WeakPolarHBondContact CA-O 3.36Å
173	A	97.4	Very high	79.8	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.2	171.8	0	0	0	0	0	109.3	L110 F124 L125 G198 L199 S200	L110-A173 HydrophobicContact CB-CB 4.27Å; L110-A173 HydrophobicContact CD2-CB 4.17Å; L110-A173 CarbonylContact O-C 3.56Å; L110-A173 WeakPolarHBondContact O-CA 3.3Å; F124-A173 HydrophobicContact CD1-CB 4.03Å; F124-A173 HydrophobicContact CE1-CB 4.32Å; L125-A173 HydrophobicContact CD2-CB 4.42Å; L125-A173 HydrophobicContact CG-CB 4.36Å; A173-G198 PolarHBondContact N-O 3.48Å; A173-L199 HydrophobicContact CB-CD1 3.85Å; A173-L199 CarbonylContact O-C 3.37Å; A173-L199 WeakPolarHBondContact O-CA 3.3Å; A173-S200 PolarHBondContact O-N 2.78Å
174	V	98.3	Very high	82.5	Confident	22 Å²	22	75.3 Å²	75.3	13%	0.133	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119.3	172.4	-177.6	0	0	0	0	107.3	L110 L111 D112 S200 V202 F211 F216	L110-V174 PolarHBondContact O-N 2.68Å; L111-V174 HydrophobicContact CD1-CB 4.08Å; L111-V174 HydrophobicContact CD1-CG1 4.07Å; D112-V174 PolarHBondContact N-O 3.18Å; V174-S200 WeakPolarHBondContact CA-O 3.48Å; V174-V202 HydrophobicContact CG1-CB 4.48Å; V174-V202 HydrophobicContact CG1-CG2 3.82Å; V174-F211 HydrophobicContact CG1-CE1 3.96Å; V174-F211 HydrophobicContact CG1-CZ 3.78Å; V174-F216 HydrophobicContact CB-CE1 4.08Å; V174-F216 HydrophobicContact CB-CZ 4.43Å; V174-F216 HydrophobicContact CG2-CE1 3.79Å; V174-F216 HydrophobicContact CG2-CZ 4.28Å
175	V	98.4	Very high	85.2	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	124.9	171.4	-179.8	0	0	0	0	108.1	D112 G115 S121 L183 L199 S200 W201 V202	D112-V175 WeakPolarHBondContact O-CA 3.48Å; G115-V175 WeakPolarHBondContact O-CG1 3.21Å; S121-V175 VanDerWaalsContact OG-CG2 3.28Å; S121-V175 WeakPolarHBondContact OG-CG2 3.34Å; V175-L183 HydrophobicContact CG1-CD2 3.82Å; V175-L199 HydrophobicContact CG2-CD1 3.91Å; V175-S200 PolarHBondContact N-O 3.27Å; V175-W201 HydrophobicContact CB-CD2 4.24Å; V175-W201 HydrophobicContact CB-CE3 3.54Å; V175-W201 HydrophobicContact CB-CZ3 3.81Å; V175-W201 HydrophobicContact CG1-CE3 3.66Å; V175-W201 HydrophobicContact CG1-CZ3 3.66Å; V175-W201 HydrophobicContact CG2-CD2 4.5Å; V175-W201 HydrophobicContact CG2-CE3 3.93Å; V175-W201 HydrophobicContact CG2-CH2 4.24Å; V175-W201 HydrophobicContact CG2-CZ3 3.78Å; V175-W201 CarbonylContact O-C 3.19Å; V175-W201 WeakPolarHBondContact O-CA 3.38Å; V175-V202 PolarHBondContact O-N 2.83Å
176	C	98.4	Very high	87.8	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.7	176	-172.5	0	0	0	0	110.1	L111 D112 V113 A114 G115 V202 F211	L111-C176 HydrophobicContact CD1-CB 3.98Å; D112-C176 PolarHBondContact O-N 3.39Å; V113-C176 CarbonylContact C-O 3.41Å; V113-C176 WeakPolarHBondContact CA-O 3.42Å; V113-C176 HydrophobicContact CG2-CB 4.46Å; A114-C176 PolarHBondContact N-O 3.19Å; G115-C176 PolarHBondContact N-O 3.14Å; C176-V202 VanDerWaalsContact CA-O 3.31Å; C176-V202 WeakPolarHBondContact CA-O 3.46Å; C176-F211 HydrophobicContact CB-CE2 4.11Å; C176-F211 HydrophobicContact CB-CZ 4.21Å
177	D	98.1	Very high	90.2	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.08	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	144.2	177.3	-156.7	-64.7	0	0	0	110.1	A114 G115 G116 N179 L183 V202 V203 G204	A114-D177 WeakPolarHBondContact CA-OD2 3.48Å; G115-D177 PolarHBondContact N-OD2 3.47Å; G116-D177 VanDerWaalsContact CA-OD2 3.26Å; G116-D177 WeakPolarHBondContact CA-OD2 3.47Å; G116-D177 PolarHBondContact N-OD2 3.48Å; D177-N179 VanDerWaalsContact C-N 3.27Å; D177-N179 PolarHBondContact O-N 2.92Å; D177-N179 WeakPolarHBondContact OD1-CB 3.39Å; D177-N179 PolarHBondContact OD1-N 2.95Å; D177-L183 HydrophobicContact CB-CD1 4.33Å; D177-L183 HydrophobicContact CB-CD2 3.72Å; D177-L183 HydrophobicContact CB-CG 3.87Å; D177-V202 PolarHBondContact N-O 3.29Å; D177-V202 VanDerWaalsContact N-O 3.15Å; D177-V203 VanDerWaalsContact O-CA 3.29Å; D177-V203 WeakPolarHBondContact O-CA 3.25Å; D177-G204 CarbonylContact C-O 3.52Å; D177-G204 VanDerWaalsContact C-O 3.3Å; D177-G204 PolarHBondContact O-N 2.79Å; D177-G204 VanDerWaalsContact O-N 3.15Å
178	I	96.5	Very high	92.4	Very high	82 Å²	82	56.2 Å²	56.2	42%	0.421	26%	0.263	S	S	.	.	S	Bend	trans	-71.8	-27.4	177.3	-163.3	170.2	0	0	0	111	G204 D205	I178-G204 VanDerWaalsContact CA-O 3.32Å; I178-G204 WeakPolarHBondContact CA-O 3.43Å; I178-G204 PolarHBondContact N-O 3.32Å; I178-G204 VanDerWaalsContact N-O 3.11Å; I178-D205 HydrophobicContact CD1-CB 4.3Å
179	N	95.4	Very high	94.1	Very high	2 Å²	2	55 Å²	55	1%	0.011	24%	0.244	C	C	.	.			trans	-91.9	116.1	-175.3	-169.5	-51.9	0	0	0	112.3	Y69 E73 D177 E181 M182 L183	Y69-N179 HydrophobicContact CD2-CB 4.5Å; Y69-N179 HydrophobicContact CE2-CB 4.22Å; Y69-N179 PolarHBondContact O-ND2 3.02Å; E73-N179 WeakPolarHBondContact CA-ND2 3.3Å; E73-N179 PolarHBondContact N-ND2 3.01Å; E73-N179 VanDerWaalsContact N-ND2 3.1Å; D177-N179 VanDerWaalsContact C-N 3.27Å; D177-N179 PolarHBondContact O-N 2.92Å; D177-N179 WeakPolarHBondContact OD1-CB 3.39Å; D177-N179 PolarHBondContact OD1-N 2.95Å; N179-E181 PolarHBondContact O-N 3.01Å; N179-E181 PolarHBondContact OD1-N 3.35Å; N179-M182 HydrophobicContact CB-CB 4.11Å; N179-M182 HydrophobicContact CB-CG 3.84Å; N179-M182 PolarHBondContact O-N 3.29Å; N179-M182 PolarHBondContact OD1-N 3.32Å; N179-M182 VanDerWaalsContact OD1-N 3.13Å; N179-L183 PolarHBondContact O-N 2.92Å
180	K	95.5	Very high	95.2	Very high	128 Å²	128	45.3 Å²	45.3	56%	0.557	21%	0.208	S	C	*	.	H	α-helix	trans	-67.2	-36	-178.1	-67.7	177.7	-178.1	172.9	0	113.4	M182 L183 K184 V203	K180-M182 VanDerWaalsContact C-N 3.34Å; K180-L183 PolarHBondContact O-N 3.21Å; K180-K184 WeakPolarHBondContact O-CB 3.3Å; K180-K184 PolarHBondContact O-N 3.3Å; K180-V203 HydrophobicContact CG-CG1 4.19Å; K180-V203 HydrophobicContact CG-CG2 3.82Å
181	E	94.6	Very high	95.6	Very high	68 Å²	68	47.3 Å²	47.3	32%	0.318	22%	0.217	S	C	.	.	H	α-helix	trans	-70	-35.1	179.6	-67.7	-54.8	119.8	0	0	111.2	E73 A76 N179 K184 V185	E73-E181 HydrophobicContact CG-CG 4.19Å; A76-E181 HydrophobicContact CB-CB 4.13Å; N179-E181 PolarHBondContact O-N 3.01Å; N179-E181 PolarHBondContact OD1-N 3.35Å; E181-K184 WeakPolarHBondContact O-CB 3.44Å; E181-K184 PolarHBondContact O-N 2.67Å; E181-K184 IonicContact OE1-NZ 3.77Å; E181-K184 WeakPolarHBondContact OE2-CD 3.47Å; E181-K184 IonicContact OE2-NZ 3.72Å; E181-K184 PolarHBondContact OE2-NZ 2.97Å; E181-K184 VanDerWaalsContact OE2-NZ 3.1Å; E181-V185 WeakPolarHBondContact O-CG2 3.27Å; E181-V185 PolarHBondContact O-N 3.47Å
182	M	94	Very high	95.6	Very high	7 Å²	7	51.7 Å²	51.7	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-60.1	-49.2	172.2	-68.7	-68.9	-77.4	0	0	111.2	A76 Y79 G116 T117 N179 K180 K184 V185 G186	A76-M182 VanDerWaalsContact CA-SD 3.58Å; A76-M182 HydrophobicContact CB-CG 4.27Å; A76-M182 HydrophobicContact CB-SD 3.67Å; Y79-M182 HydrophobicContact CD1-CE 3.9Å; Y79-M182 HydrophobicContact CD2-CE 4.11Å; Y79-M182 HydrophobicContact CE1-CE 4.13Å; Y79-M182 HydrophobicContact CE2-CE 4.42Å; Y79-M182 HydrophobicContact CG-CE 3.86Å; G116-M182 CarbonylContact C-O 3.58Å; G116-M182 CarbonylContact O-C 3.54Å; T117-M182 HydrophobicContact CG2-CE 3.86Å; N179-M182 HydrophobicContact CB-CB 4.11Å; N179-M182 HydrophobicContact CB-CG 3.84Å; N179-M182 PolarHBondContact O-N 3.29Å; N179-M182 PolarHBondContact OD1-N 3.32Å; N179-M182 VanDerWaalsContact OD1-N 3.13Å; K180-M182 VanDerWaalsContact C-N 3.34Å; M182-K184 VanDerWaalsContact C-N 3.28Å; M182-K184 PolarHBondContact O-N 2.84Å; M182-V185 WeakPolarHBondContact O-CB 3.37Å; M182-V185 PolarHBondContact O-N 3.07Å; M182-G186 PolarHBondContact O-N 2.98Å
183	L	96.3	Very high	95.4	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-36	176.7	-66.1	170.7	0	0	0	112.7	G116 V175 D177 N179 K180 G186 K187 W201 V202 V203	G116-L183 WeakPolarHBondContact O-CA 3.2Å; V175-L183 HydrophobicContact CG1-CD2 3.82Å; D177-L183 HydrophobicContact CB-CD1 4.33Å; D177-L183 HydrophobicContact CB-CD2 3.72Å; D177-L183 HydrophobicContact CB-CG 3.87Å; N179-L183 PolarHBondContact O-N 2.92Å; K180-L183 PolarHBondContact O-N 3.21Å; L183-G186 PolarHBondContact O-N 3.09Å; L183-K187 WeakPolarHBondContact O-CB 3.49Å; L183-K187 VanDerWaalsContact O-CG 3.29Å; L183-K187 WeakPolarHBondContact O-CG 3.49Å; L183-K187 PolarHBondContact O-N 3.45Å; L183-W201 HydrophobicContact CD2-CE3 3.74Å; L183-W201 HydrophobicContact CD2-CZ3 4.42Å; L183-V202 WeakPolarHBondContact CD1-O 3.28Å; L183-V203 HydrophobicContact CD1-CB 4.29Å; L183-V203 HydrophobicContact CD1-CG2 3.56Å
184	K	96	Very high	95.1	Very high	101 Å²	101	52.6 Å²	52.6	44%	0.439	27%	0.274	S	S	.	.	H	α-helix	trans	-64.4	-44.1	176.2	-178.3	-176.2	174.1	-172.1	0	111.5	K180 E181 M182 G186 K187 Q188	K180-K184 WeakPolarHBondContact O-CB 3.3Å; K180-K184 PolarHBondContact O-N 3.3Å; E181-K184 WeakPolarHBondContact O-CB 3.44Å; E181-K184 PolarHBondContact O-N 2.67Å; E181-K184 IonicContact OE1-NZ 3.77Å; E181-K184 WeakPolarHBondContact OE2-CD 3.47Å; E181-K184 IonicContact OE2-NZ 3.72Å; E181-K184 PolarHBondContact OE2-NZ 2.97Å; E181-K184 VanDerWaalsContact OE2-NZ 3.1Å; M182-K184 VanDerWaalsContact C-N 3.28Å; M182-K184 PolarHBondContact O-N 2.84Å; K184-G186 VanDerWaalsContact C-N 3.33Å; K184-K187 PolarHBondContact O-N 3.3Å; K184-Q188 WeakPolarHBondContact O-CG 3.4Å; K184-Q188 PolarHBondContact O-N 3.48Å
185	V	94.4	Very high	94.6	Very high	31 Å²	31	52.5 Å²	52.5	19%	0.188	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-44.9	173	171.7	0	0	0	0	110.5	A76 T117 E181 M182 K187 Q188 K189	A76-V185 HydrophobicContact CB-CG2 4.33Å; T117-V185 HydrophobicContact CG2-CG1 4.34Å; E181-V185 WeakPolarHBondContact O-CG2 3.27Å; E181-V185 PolarHBondContact O-N 3.47Å; M182-V185 WeakPolarHBondContact O-CB 3.37Å; M182-V185 PolarHBondContact O-N 3.07Å; V185-K187 PolarHBondContact O-N 3.33Å; V185-Q188 PolarHBondContact O-N 3.48Å; V185-K189 WeakPolarHBondContact O-CB 3.28Å; V185-K189 PolarHBondContact O-N 2.89Å
186	G	95.4	Very high	93.5	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.8	-44.9	176.6	0	0	0	0	0	113.4	G116 M182 L183 K184 K189 A190 W201	G116-G186 WeakPolarHBondContact O-CA 3.13Å; M182-G186 PolarHBondContact O-N 2.98Å; L183-G186 PolarHBondContact O-N 3.09Å; K184-G186 VanDerWaalsContact C-N 3.33Å; G186-K189 WeakPolarHBondContact O-CB 3.46Å; G186-K189 PolarHBondContact O-N 3.15Å; G186-A190 PolarHBondContact O-N 2.81Å; G186-W201 VanDerWaalsContact C-CZ2 3.42Å; G186-W201 WeakPolarHBondContact O-CH2 3.17Å; G186-W201 WeakPolarHBondContact O-CZ2 3.36Å
187	K	95.3	Very high	92.9	Very high	91 Å²	91	61.1 Å²	61.1	40%	0.396	33%	0.334	S	S	.	.	H	α-helix	trans	-59.7	-50.4	176.5	-76.5	173.4	-178.3	-177.4	0	112	L183 K184 V185 K189 A190 E191 W201	L183-K187 WeakPolarHBondContact O-CB 3.49Å; L183-K187 VanDerWaalsContact O-CG 3.29Å; L183-K187 WeakPolarHBondContact O-CG 3.49Å; L183-K187 PolarHBondContact O-N 3.45Å; K184-K187 PolarHBondContact O-N 3.3Å; V185-K187 PolarHBondContact O-N 3.33Å; K187-K189 VanDerWaalsContact C-N 3.26Å; K187-K189 PolarHBondContact O-N 3.02Å; K187-A190 PolarHBondContact O-N 3.28Å; K187-A190 VanDerWaalsContact O-N 3.15Å; K187-E191 WeakPolarHBondContact O-CG 2.99Å; K187-E191 PolarHBondContact O-N 3.28Å; K187-W201 HydrophobicContact CD-CG 4.25Å; K187-W201 VanDerWaalsContact CE-CG 3.43Å; K187-W201 HydrophobicContact CG-CB 4.46Å; K187-W201 HydrophobicContact CG-CD2 3.71Å; K187-W201 HydrophobicContact CG-CE3 4.41Å; K187-W201 HydrophobicContact CG-CG 3.72Å; K187-W201 HydrophobicContact CG-CZ2 4.3Å
188	Q	94.6	Very high	92.5	Very high	106 Å²	106	61 Å²	61	50%	0.495	34%	0.337	S	S	.	.	H	α-helix	trans	-58.4	-40.6	177.6	-71.4	174.6	-10.8	0	0	111.7	K184 V185 E191 S192	K184-Q188 WeakPolarHBondContact O-CG 3.4Å; K184-Q188 PolarHBondContact O-N 3.48Å; V185-Q188 PolarHBondContact O-N 3.48Å; Q188-E191 PolarHBondContact O-N 3.45Å; Q188-S192 WeakPolarHBondContact O-CB 3.29Å; Q188-S192 PolarHBondContact O-N 3.04Å
189	K	93.4	Very high	92.5	Very high	48 Å²	48	58.5 Å²	58.5	21%	0.209	32%	0.324	C	S	.	.	H	α-helix	trans	-63.1	-47.4	175.7	-173.3	177	-177.9	173.4	0	111.6	D80 L122 V185 G186 K187 E191 S192 M193	D80-K189 IonicContact OD2-NZ 2.71Å; D80-K189 PolarHBondContact OD2-NZ 2.75Å; L122-K189 HydrophobicContact CD1-CD 4.32Å; L122-K189 HydrophobicContact CD1-CG 4.33Å; V185-K189 WeakPolarHBondContact O-CB 3.28Å; V185-K189 PolarHBondContact O-N 2.89Å; G186-K189 WeakPolarHBondContact O-CB 3.46Å; G186-K189 PolarHBondContact O-N 3.15Å; K187-K189 VanDerWaalsContact C-N 3.26Å; K187-K189 PolarHBondContact O-N 3.02Å; K189-E191 PolarHBondContact O-N 3.33Å; K189-S192 PolarHBondContact O-N 3.32Å; K189-S192 PolarHBondContact O-OG 2.75Å; K189-M193 HydrophobicContact CG-SD 4.29Å; K189-M193 WeakPolarHBondContact O-CG 3.32Å; K189-M193 PolarHBondContact O-N 2.71Å; K189-M193 VanDerWaalsContact O-N 3.14Å
190	A	94.4	Very high	92.5	Very high	3 Å²	3	61.5 Å²	61.5	3%	0.025	35%	0.345	C	S	.	.	H	α-helix	trans	-61.6	-41.9	177.6	0	0	0	0	0	112.5	L122 G186 K187 M193 G194 V195 L199 W201	L122-A190 HydrophobicContact CD2-CB 4.05Å; G186-A190 PolarHBondContact O-N 2.81Å; K187-A190 PolarHBondContact O-N 3.28Å; K187-A190 VanDerWaalsContact O-N 3.15Å; A190-M193 CarbonylContact O-C 3.56Å; A190-M193 PolarHBondContact O-N 3.16Å; A190-G194 PolarHBondContact O-N 2.94Å; A190-V195 HydrophobicContact CB-CB 4.39Å; A190-V195 PolarHBondContact O-N 3.12Å; A190-L199 HydrophobicContact CB-CD2 3.94Å; A190-W201 HydrophobicContact CB-CZ2 3.9Å
191	E	93.7	Very high	92.6	Very high	143 Å²	143	57.7 Å²	57.7	67%	0.668	33%	0.327	S	S	*	.	H	α-helix	trans	-60.1	-47	174.4	-72.7	168.9	-175.7	0	0	111.4	K187 Q188 K189 M193 G194	K187-E191 WeakPolarHBondContact O-CG 2.99Å; K187-E191 PolarHBondContact O-N 3.28Å; Q188-E191 PolarHBondContact O-N 3.45Å; K189-E191 PolarHBondContact O-N 3.33Å; E191-M193 PolarHBondContact O-N 3.28Å; E191-G194 PolarHBondContact O-N 2.87Å
192	S	92.8	Very high	92.8	Very high	99 Å²	99	56.3 Å²	56.3	69%	0.692	32%	0.323	S	S	*	.	H	α-helix	trans	-61.2	-25.7	177.2	78.3	0	0	0	0	113.5	Q188 K189	Q188-S192 WeakPolarHBondContact O-CB 3.29Å; Q188-S192 PolarHBondContact O-N 3.04Å; K189-S192 PolarHBondContact O-N 3.32Å; K189-S192 PolarHBondContact O-OG 2.75Å
193	M	91.1	Very high	93	Very high	97 Å²	97	59.5 Å²	59.5	48%	0.478	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-0.2	177.5	-67.2	178.4	66.9	0	0	113	L122 K189 A190 E191 V195	L122-M193 HydrophobicContact CD1-SD 4.05Å; K189-M193 HydrophobicContact CG-SD 4.29Å; K189-M193 WeakPolarHBondContact O-CG 3.32Å; K189-M193 PolarHBondContact O-N 2.71Å; K189-M193 VanDerWaalsContact O-N 3.14Å; A190-M193 CarbonylContact O-C 3.56Å; A190-M193 PolarHBondContact O-N 3.16Å; E191-M193 PolarHBondContact O-N 3.28Å; M193-V195 VanDerWaalsContact C-N 3.29Å; M193-V195 HydrophobicContact CB-CG2 4.15Å; M193-V195 PolarHBondContact O-N 3.03Å
194	G	89.9	Confident	93	Very high	57 Å²	57	59.7 Å²	59.7	59%	0.588	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	25.6	-178.2	0	0	0	0	0	113.9	A190 E191 S196	A190-G194 PolarHBondContact O-N 2.94Å; E191-G194 PolarHBondContact O-N 2.87Å; G194-S196 PolarHBondContact O-N 2.93Å
195	V	87.6	Confident	93.1	Very high	20 Å²	20	57.9 Å²	57.9	12%	0.121	34%	0.341	C	S	.	.			trans	-85.7	100.9	176.4	-178.9	0	0	0	0	108.8	L122 L125 A190 M193 L199	L122-V195 HydrophobicContact CD2-CB 4.23Å; L122-V195 HydrophobicContact CD2-CG1 4.27Å; L122-V195 HydrophobicContact CD2-CG2 3.88Å; L125-V195 HydrophobicContact CD1-CG1 4.12Å; A190-V195 HydrophobicContact CB-CB 4.39Å; A190-V195 PolarHBondContact O-N 3.12Å; M193-V195 VanDerWaalsContact C-N 3.29Å; M193-V195 HydrophobicContact CB-CG2 4.15Å; M193-V195 PolarHBondContact O-N 3.03Å; V195-L199 HydrophobicContact CG1-CB 4.43Å; V195-L199 HydrophobicContact CG1-CD2 4.44Å
196	S	75.7	Confident	93.2	Very high	125 Å²	125	56.9 Å²	56.9	87%	0.874	34%	0.336	S	S	*	.			trans	-107.6	-14.7	-175.9	55.7	0	0	0	0	115	G194	G194-S196 PolarHBondContact O-N 2.93Å
197	S	86.3	Confident	93.3	Very high	55 Å²	55	58.7 Å²	58.7	39%	0.385	35%	0.345	S	S	.	.	S	Bend	trans	-131.2	162.6	179.6	80	0	0	0	0	112.1	E170 L199	E170-S197 PolarHBondContact OE1-OG 3.11Å; S197-L199 PolarHBondContact O-N 3.25Å
198	G	90.3	Very high	93.5	Very high	14 Å²	14	61.9 Å²	61.9	14%	0.144	36%	0.361	C	S	.	.	S	Bend	trans	73.7	2.6	174.8	0	0	0	0	0	115.6	R172 A173	R172-G198 CarbonylContact C-O 3.52Å; R172-G198 WeakPolarHBondContact CA-O 3.36Å; A173-G198 PolarHBondContact N-O 3.48Å
199	L	95.3	Very high	93.6	Very high	29 Å²	29	57.2 Å²	57.2	15%	0.152	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.3	178.8	-166.3	62.3	0	0	0	111	L122 L125 A173 V175 A190 V195 S197 W201	L122-L199 HydrophobicContact CD2-CD2 4Å; L125-L199 HydrophobicContact CD1-CB 3.89Å; L125-L199 HydrophobicContact CD1-CD1 4.13Å; L125-L199 HydrophobicContact CD1-CG 4.47Å; A173-L199 HydrophobicContact CB-CD1 3.85Å; A173-L199 CarbonylContact O-C 3.37Å; A173-L199 WeakPolarHBondContact O-CA 3.3Å; V175-L199 HydrophobicContact CG2-CD1 3.91Å; A190-L199 HydrophobicContact CB-CD2 3.94Å; V195-L199 HydrophobicContact CG1-CB 4.43Å; V195-L199 HydrophobicContact CG1-CD2 4.44Å; S197-L199 PolarHBondContact O-N 3.25Å; L199-W201 HydrophobicContact CD2-CH2 4.23Å; L199-W201 HydrophobicContact CD2-CZ2 3.4Å; L199-W201 HydrophobicContact CG-CZ2 4.14Å
200	S	96.8	Very high	93.8	Very high	64 Å²	64	58.5 Å²	58.5	45%	0.448	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	153	174.7	-62.8	0	0	0	0	110.2	A173 V174 V175	A173-S200 PolarHBondContact O-N 2.78Å; V174-S200 WeakPolarHBondContact CA-O 3.48Å; V175-S200 PolarHBondContact N-O 3.27Å
201	W	97.9	Very high	94	Very high	49 Å²	49	59.5 Å²	59.5	19%	0.186	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.3	-173.7	-56.1	87.4	0	0	0	109.7	G116 V175 L183 G186 K187 A190 L199	G116-W201 VanDerWaalsContact O-CZ3 3.3Å; G116-W201 WeakPolarHBondContact O-CZ3 3.01Å; V175-W201 HydrophobicContact CB-CD2 4.24Å; V175-W201 HydrophobicContact CB-CE3 3.54Å; V175-W201 HydrophobicContact CB-CZ3 3.81Å; V175-W201 HydrophobicContact CG1-CE3 3.66Å; V175-W201 HydrophobicContact CG1-CZ3 3.66Å; V175-W201 HydrophobicContact CG2-CD2 4.5Å; V175-W201 HydrophobicContact CG2-CE3 3.93Å; V175-W201 HydrophobicContact CG2-CH2 4.24Å; V175-W201 HydrophobicContact CG2-CZ3 3.78Å; V175-W201 CarbonylContact O-C 3.19Å; V175-W201 WeakPolarHBondContact O-CA 3.38Å; L183-W201 HydrophobicContact CD2-CE3 3.74Å; L183-W201 HydrophobicContact CD2-CZ3 4.42Å; G186-W201 VanDerWaalsContact C-CZ2 3.42Å; G186-W201 WeakPolarHBondContact O-CH2 3.17Å; G186-W201 WeakPolarHBondContact O-CZ2 3.36Å; K187-W201 HydrophobicContact CD-CG 4.25Å; K187-W201 VanDerWaalsContact CE-CG 3.43Å; K187-W201 HydrophobicContact CG-CB 4.46Å; K187-W201 HydrophobicContact CG-CD2 3.71Å; K187-W201 HydrophobicContact CG-CE3 4.41Å; K187-W201 HydrophobicContact CG-CG 3.72Å; K187-W201 HydrophobicContact CG-CZ2 4.3Å; A190-W201 HydrophobicContact CB-CZ2 3.9Å; L199-W201 HydrophobicContact CD2-CH2 4.23Å; L199-W201 HydrophobicContact CD2-CZ2 3.4Å; L199-W201 HydrophobicContact CG-CZ2 4.14Å
202	V	98.1	Very high	94.2	Very high	39 Å²	39	58.3 Å²	58.3	24%	0.236	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.3	-174.1	179.8	0	0	0	0	109.2	V174 V175 C176 D177 L183 P210 F211	V174-V202 HydrophobicContact CG1-CB 4.48Å; V174-V202 HydrophobicContact CG1-CG2 3.82Å; V175-V202 PolarHBondContact O-N 2.83Å; C176-V202 VanDerWaalsContact CA-O 3.31Å; C176-V202 WeakPolarHBondContact CA-O 3.46Å; D177-V202 PolarHBondContact N-O 3.29Å; D177-V202 VanDerWaalsContact N-O 3.15Å; L183-V202 WeakPolarHBondContact CD1-O 3.28Å; V202-P210 HydrophobicContact CG1-CG 3.66Å; V202-F211 HydrophobicContact CB-CE1 4.43Å; V202-F211 HydrophobicContact CB-CZ 4.04Å; V202-F211 HydrophobicContact CG1-CE1 4.25Å; V202-F211 HydrophobicContact CG1-CZ 3.96Å; V202-F211 HydrophobicContact CG2-CE1 4.07Å; V202-F211 HydrophobicContact CG2-CZ 4.11Å
203	V	98	Very high	94.5	Very high	73 Å²	73	58 Å²	58	44%	0.442	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124	168.1	-177.8	0	0	0	0	107.2	D177 K180 L183	D177-V203 VanDerWaalsContact O-CA 3.29Å; D177-V203 WeakPolarHBondContact O-CA 3.25Å; K180-V203 HydrophobicContact CG-CG1 4.19Å; K180-V203 HydrophobicContact CG-CG2 3.82Å; L183-V203 HydrophobicContact CD1-CB 4.29Å; L183-V203 HydrophobicContact CD1-CG2 3.56Å
204	G	96.8	Very high	94.8	Very high	10 Å²	10	56.8 Å²	56.8	10%	0.103	34%	0.341	C	S	.	.			trans	-165.1	152.4	-179.3	0	0	0	0	0	112.4	D177 I178	D177-G204 CarbonylContact C-O 3.52Å; D177-G204 VanDerWaalsContact C-O 3.3Å; D177-G204 PolarHBondContact O-N 2.79Å; D177-G204 VanDerWaalsContact O-N 3.15Å; I178-G204 VanDerWaalsContact CA-O 3.32Å; I178-G204 WeakPolarHBondContact CA-O 3.43Å; I178-G204 PolarHBondContact N-O 3.32Å; I178-G204 VanDerWaalsContact N-O 3.11Å
205	D	97	Very high	95.2	Very high	63 Å²	63	56.8 Å²	56.8	34%	0.337	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-82.3	139.3	172.2	-162.6	-26.8	0	0	0	109.3	I178 E207 E208 L209	I178-D205 HydrophobicContact CD1-CB 4.3Å; D205-E207 PolarHBondContact O-N 2.97Å; D205-E207 PolarHBondContact OD1-N 3.23Å; D205-E208 CarbonylContact O-C 3.3Å; D205-E208 PolarHBondContact O-N 2.86Å; D205-L209 WeakPolarHBondContact O-CD2 3.29Å; D205-L209 PolarHBondContact O-N 2.86Å
206	A	97.6	Very high	95.7	Very high	10 Å²	10	56.1 Å²	56.1	8%	0.083	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-24.3	175.3	0	0	0	0	0	112.2	V113 V228 A234	V113-A206 HydrophobicContact CG1-CB 3.63Å; A206-V228 HydrophobicContact CB-CG2 4.17Å; A206-A234 HydrophobicContact CB-CB 4.18Å; A206-A234 WeakPolarHBondContact O-CA 3.24Å
207	E	97.7	Very high	96.8	Very high	38 Å²	38	52.3 Å²	52.3	18%	0.178	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-15.1	178.3	-58.6	-178.9	-155.8	0	0	112.9	D205 V228 T229 H230 L233 E237	D205-E207 PolarHBondContact O-N 2.97Å; D205-E207 PolarHBondContact OD1-N 3.23Å; E207-V228 HydrophobicContact CG-CG1 3.52Å; E207-V228 WeakPolarHBondContact OE1-CG1 3.35Å; E207-T229 VanDerWaalsContact OE1-CA 3.29Å; E207-T229 WeakPolarHBondContact OE1-CA 3.49Å; E207-T229 WeakPolarHBondContact OE1-CB 3.1Å; E207-T229 PolarHBondContact OE1-N 3.37Å; E207-H230 PolarHBondContact OE1-N 3.3Å; E207-H230 IonicContact OE2-CD2 2.83Å; E207-H230 PolarHBondContact OE2-CD2 3.32Å; E207-H230 VanDerWaalsContact OE2-CD2 3.3Å; E207-H230 IonicContact OE2-CG 2.71Å; E207-L233 HydrophobicContact CB-CB 4.24Å; E207-L233 HydrophobicContact CG-CB 4.39Å; E207-E237 VanDerWaalsContact O-CG 3.31Å; E207-E237 WeakPolarHBondContact O-CG 3.3Å
208	E	97.8	Very high	97.4	Very high	158 Å²	158	50.1 Å²	50.1	74%	0.738	28%	0.275	S	S	*	.	B	Isolated β-bridge	trans	-149.6	80.8	177.9	-170.2	-179	-172.3	0	0	109.2	D205	D205-E208 CarbonylContact O-C 3.3Å; D205-E208 PolarHBondContact O-N 2.86Å
209	L	98.2	Very high	97.8	Very high	7 Å²	7	49.4 Å²	49.4	4%	0.037	27%	0.268	C	S	.	.			trans	-74.9	133	-173.7	-70.6	170.5	0	0	0	111.1	L111 V113 D205 F211 Y219 E237 R240 V241	L111-L209 HydrophobicContact CD2-CD1 4.13Å; V113-L209 HydrophobicContact CG1-CD2 4.3Å; V113-L209 HydrophobicContact CG2-CD1 4.47Å; V113-L209 HydrophobicContact CG2-CD2 4.08Å; D205-L209 WeakPolarHBondContact O-CD2 3.29Å; D205-L209 PolarHBondContact O-N 2.86Å; L209-F211 HydrophobicContact CB-CD2 3.9Å; L209-F211 HydrophobicContact CB-CE2 4.44Å; L209-F211 HydrophobicContact CD2-CD2 4.45Å; L209-F211 HydrophobicContact CD2-CE2 4.23Å; L209-F211 PolarHBondContact O-N 2.87Å; L209-Y219 HydrophobicContact CD1-CE2 3.93Å; L209-E237 WeakPolarHBondContact CB-OE2 3.17Å; L209-E237 HydrophobicContact CD1-CB 3.89Å; L209-E237 HydrophobicContact CG-CB 4.18Å; L209-E237 PolarHBondContact N-OE2 3.34Å; L209-R240 PolarHBondContact O-NH2 3.18Å; L209-V241 HydrophobicContact CB-CG1 4.23Å; L209-V241 HydrophobicContact CD1-CG1 3.97Å; L209-V241 HydrophobicContact CD1-CG2 4.07Å
210	P	97.8	Very high	97.9	Very high	75 Å²	75	48 Å²	48	49%	0.487	26%	0.261	S	S	.	.	S	Bend	trans	-81.1	46.9	-178.5	36.4	-38.9	0	0	0	112.3	V202	V202-P210 HydrophobicContact CG1-CG 3.66Å
211	F	98.2	Very high	98	Very high	25 Å²	25	45 Å²	45	11%	0.11	24%	0.239	C	C	.	.	S	Bend	trans	-129.2	150.5	178.7	-53.2	-63.9	0	0	0	109.9	L111 V174 C176 V202 L209 F216 R240 V241	L111-F211 HydrophobicContact CD1-CD2 4.2Å; L111-F211 HydrophobicContact CD1-CE2 3.47Å; L111-F211 VanDerWaalsContact CD1-CE2 3.47Å; L111-F211 HydrophobicContact CD1-CZ 3.8Å; L111-F211 HydrophobicContact CD2-CD2 3.91Å; L111-F211 HydrophobicContact CD2-CE2 3.94Å; L111-F211 HydrophobicContact CG-CE2 4.38Å; V174-F211 HydrophobicContact CG1-CE1 3.96Å; V174-F211 HydrophobicContact CG1-CZ 3.78Å; C176-F211 HydrophobicContact CB-CE2 4.11Å; C176-F211 HydrophobicContact CB-CZ 4.21Å; V202-F211 HydrophobicContact CB-CE1 4.43Å; V202-F211 HydrophobicContact CB-CZ 4.04Å; V202-F211 HydrophobicContact CG1-CE1 4.25Å; V202-F211 HydrophobicContact CG1-CZ 3.96Å; V202-F211 HydrophobicContact CG2-CE1 4.07Å; V202-F211 HydrophobicContact CG2-CZ 4.11Å; L209-F211 HydrophobicContact CB-CD2 3.9Å; L209-F211 HydrophobicContact CB-CE2 4.44Å; L209-F211 HydrophobicContact CD2-CD2 4.45Å; L209-F211 HydrophobicContact CD2-CE2 4.23Å; L209-F211 PolarHBondContact O-N 2.87Å; F211-F216 HydrophobicContact CB-CE2 3.91Å; F211-F216 HydrophobicContact CD1-CE2 4.1Å; F211-F216 AromaticContact CD1-CZ 3.94Å; F211-F216 HydrophobicContact CD1-CZ 3.94Å; F211-F216 AromaticContact CD2-CE2 3.95Å; F211-F216 HydrophobicContact CD2-CE2 3.95Å; F211-F216 HydrophobicContact CD2-CZ 4.31Å; F211-F216 HydrophobicContact CE1-CZ 4.21Å; F211-F216 AromaticContact CG-CE2 3.71Å; F211-F216 HydrophobicContact CG-CE2 3.71Å; F211-F216 HydrophobicContact CG-CZ 4.01Å; F211-R240 PolarHBondContact O-NH1 3.34Å; F211-R240 PolarHBondContact O-NH2 3.44Å; F211-V241 HydrophobicContact CB-CG1 4.12Å
212	D	98.2	Very high	98	Very high	118 Å²	118	43.2 Å²	43.2	63%	0.631	24%	0.235	S	C	*	.			trans	-73.4	170	170.8	-43.3	-54.3	0	0	0	110.5	Q215	D212-Q215 HydrophobicContact CB-CG 4.31Å; D212-Q215 VanDerWaalsContact CG-NE2 3.3Å; D212-Q215 VanDerWaalsContact N-NE2 3.16Å; D212-Q215 WeakPolarHBondContact O-CG 3.25Å; D212-Q215 PolarHBondContact OD2-NE2 2.83Å
213	D	98.6	Very high	97.9	Very high	93 Å²	93	41.8 Å²	41.8	50%	0.497	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	153.3	177.4	-57.9	5	0	0	0	111.1	Q215 R240	D213-Q215 VanDerWaalsContact C-N 3.3Å; D213-Q215 PolarHBondContact O-N 2.81Å; D213-Q215 VanDerWaalsContact O-N 3.16Å; D213-R240 WeakPolarHBondContact CA-O 3.37Å; D213-R240 HydrophobicContact CB-CG 4.32Å; D213-R240 VanDerWaalsContact OD1-CD 3.24Å; D213-R240 WeakPolarHBondContact OD1-CD 3.36Å; D213-R240 WeakPolarHBondContact OD1-CG 3.33Å; D213-R240 IonicContact OD1-CZ 2.79Å; D213-R240 IonicContact OD1-NE 2.75Å; D213-R240 IonicContact OD1-NH1 3.83Å; D213-R240 PolarHBondContact OD1-NH1 3.35Å
214	D	98.3	Very high	97.7	Very high	71 Å²	71	38.6 Å²	38.6	38%	0.38	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	37.5	169.4	-59.6	-40.4	0	0	0	115.5	R240 K243 P244 K332	D214-R240 PolarHBondContact N-O 3.36Å; D214-K243 VanDerWaalsContact C-CG 3.5Å; D214-K243 HydrophobicContact CB-CG 4.29Å; D214-K243 WeakPolarHBondContact O-CG 3.28Å; D214-P244 WeakPolarHBondContact OD1-CD 3.32Å; D214-K332 IonicContact OD1-NZ 3.91Å; D214-K332 PolarHBondContact OD1-NZ 2.76Å
215	Q	97.5	Very high	97.7	Very high	56 Å²	56	38.2 Å²	38.2	26%	0.262	20%	0.203	S	C	.	.			trans	-93.1	-28.7	-178.3	-73.4	-157.6	23.8	0	0	114.6	D212 D213 V241 K243	D212-Q215 HydrophobicContact CB-CG 4.31Å; D212-Q215 VanDerWaalsContact CG-NE2 3.3Å; D212-Q215 VanDerWaalsContact N-NE2 3.16Å; D212-Q215 WeakPolarHBondContact O-CG 3.25Å; D212-Q215 PolarHBondContact OD2-NE2 2.83Å; D213-Q215 VanDerWaalsContact C-N 3.3Å; D213-Q215 PolarHBondContact O-N 2.81Å; D213-Q215 VanDerWaalsContact O-N 3.16Å; Q215-V241 PolarHBondContact N-O 3.12Å; Q215-K243 WeakPolarHBondContact O-CE 3.49Å
216	F	98.4	Very high	97.6	Very high	6 Å²	6	36 Å²	36	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.2	-167.7	-59.9	-80.4	0	0	0	113.1	R109 L111 V174 F211 V241 K243	R109-F216 HydrophobicContact CB-CD1 4.28Å; L111-F216 HydrophobicContact CB-CB 4.23Å; L111-F216 HydrophobicContact CB-CD1 3.6Å; L111-F216 HydrophobicContact CB-CD2 3.91Å; L111-F216 HydrophobicContact CB-CE1 3.84Å; L111-F216 HydrophobicContact CB-CE2 4.14Å; L111-F216 HydrophobicContact CB-CG 3.63Å; L111-F216 HydrophobicContact CB-CZ 4.1Å; L111-F216 HydrophobicContact CD1-CE1 4.4Å; L111-F216 HydrophobicContact CD1-CE2 4.41Å; L111-F216 HydrophobicContact CD1-CZ 4.11Å; L111-F216 HydrophobicContact CD2-CD2 3.92Å; L111-F216 HydrophobicContact CD2-CE2 3.84Å; L111-F216 HydrophobicContact CD2-CG 4.48Å; L111-F216 HydrophobicContact CD2-CZ 4.35Å; L111-F216 HydrophobicContact CG-CD2 4.46Å; L111-F216 HydrophobicContact CG-CE2 4.36Å; L111-F216 HydrophobicContact CG-CZ 4.41Å; V174-F216 HydrophobicContact CB-CE1 4.08Å; V174-F216 HydrophobicContact CB-CZ 4.43Å; V174-F216 HydrophobicContact CG2-CE1 3.79Å; V174-F216 HydrophobicContact CG2-CZ 4.28Å; F211-F216 HydrophobicContact CB-CE2 3.91Å; F211-F216 HydrophobicContact CD1-CE2 4.1Å; F211-F216 AromaticContact CD1-CZ 3.94Å; F211-F216 HydrophobicContact CD1-CZ 3.94Å; F211-F216 AromaticContact CD2-CE2 3.95Å; F211-F216 HydrophobicContact CD2-CE2 3.95Å; F211-F216 HydrophobicContact CD2-CZ 4.31Å; F211-F216 HydrophobicContact CE1-CZ 4.21Å; F211-F216 AromaticContact CG-CE2 3.71Å; F211-F216 HydrophobicContact CG-CE2 3.71Å; F211-F216 HydrophobicContact CG-CZ 4.01Å; F216-V241 HydrophobicContact CD2-CB 4.03Å; F216-V241 HydrophobicContact CD2-CG2 4.22Å; F216-V241 HydrophobicContact CE2-CB 4.43Å; F216-V241 PolarHBondContact N-O 3.25Å; F216-K243 PolarHBondContact O-N 3.32Å
217	D	98.1	Very high	97.4	Very high	46 Å²	46	36.2 Å²	36.2	25%	0.246	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-30.7	176.1	-51.9	-68.9	0	0	0	110.8	I108 R109 K243 G246 R247	I108-D217 HydrophobicContact CG2-CB 4.19Å; R109-D217 WeakPolarHBondContact CB-OD2 3.44Å; R109-D217 PolarHBondContact N-OD2 3.49Å; R109-D217 PolarHBondContact O-N 2.96Å; D217-K243 VanDerWaalsContact CG-NZ 3.33Å; D217-K243 VanDerWaalsContact OD1-CD 3.31Å; D217-K243 WeakPolarHBondContact OD1-CD 3.24Å; D217-K243 IonicContact OD1-NZ 3.98Å; D217-K243 PolarHBondContact OD1-NZ 3.08Å; D217-K243 IonicContact OD2-NZ 2.78Å; D217-K243 PolarHBondContact OD2-NZ 3.16Å; D217-G246 CarbonylContact O-C 3.54Å; D217-G246 VanDerWaalsContact O-CA 3.24Å; D217-G246 WeakPolarHBondContact O-CA 3.46Å; D217-R247 PolarHBondContact O-N 3.19Å
218	V	98.5	Very high	97.3	Very high	8 Å²	8	35.1 Å²	35.1	5%	0.048	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	135.9	179	-177.1	0	0	0	0	110.1	M102 I108 R109 L110 L111 T220 R247	M102-V218 HydrophobicContact CE-CG1 3.96Å; M102-V218 HydrophobicContact CG-CG1 4.27Å; M102-V218 HydrophobicContact SD-CG1 4.24Å; I108-V218 HydrophobicContact CD1-CG2 4.44Å; I108-V218 HydrophobicContact CG2-CB 4.38Å; I108-V218 HydrophobicContact CG2-CG2 3.85Å; R109-V218 PolarHBondContact O-N 3.4Å; L110-V218 WeakPolarHBondContact CA-O 3.38Å; L110-V218 HydrophobicContact CD1-CB 3.92Å; L110-V218 HydrophobicContact CD1-CG1 3.71Å; L111-V218 PolarHBondContact N-O 2.84Å; V218-T220 HydrophobicContact CG1-CG2 4.29Å; V218-R247 WeakPolarHBondContact CA-O 3.49Å
219	Y	98.8	Very high	97	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.1	171.9	-179	-71.8	0	0	0	108.8	L111 V113 L209 I221 A238 V241 R247 F248 M249	L111-Y219 HydrophobicContact CD2-CD2 3.86Å; L111-Y219 HydrophobicContact CD2-CE2 4Å; L111-Y219 HydrophobicContact CG-CD2 4.39Å; L111-Y219 CarbonylContact O-C 3.35Å; L111-Y219 WeakPolarHBondContact O-CA 3.49Å; V113-Y219 HydrophobicContact CB-CE1 4.34Å; V113-Y219 HydrophobicContact CB-CE2 4.28Å; V113-Y219 WeakPolarHBondContact CB-OH 3.43Å; V113-Y219 HydrophobicContact CG2-CD2 4.22Å; V113-Y219 HydrophobicContact CG2-CE1 4.23Å; V113-Y219 HydrophobicContact CG2-CE2 3.39Å; V113-Y219 WeakPolarHBondContact CG2-OH 3.28Å; L209-Y219 HydrophobicContact CD1-CE2 3.93Å; Y219-I221 HydrophobicContact CE1-CB 3.93Å; Y219-I221 HydrophobicContact CE1-CG2 3.87Å; Y219-A238 HydrophobicContact CD1-CB 4.12Å; Y219-A238 HydrophobicContact CD2-CB 3.81Å; Y219-A238 HydrophobicContact CE1-CB 3.97Å; Y219-A238 HydrophobicContact CE2-CB 3.62Å; Y219-A238 HydrophobicContact CG-CB 4.06Å; Y219-V241 HydrophobicContact CD2-CG2 3.93Å; Y219-V241 HydrophobicContact CE2-CG2 4.31Å; Y219-R247 PolarHBondContact N-O 3.03Å; Y219-F248 AromaticContact CD1-CD2 3.49Å; Y219-F248 HydrophobicContact CD1-CD2 3.49Å; Y219-F248 VanDerWaalsContact CD1-CD2 3.49Å; Y219-F248 AromaticContact CD1-CE2 3.64Å; Y219-F248 HydrophobicContact CD1-CE2 3.64Å; Y219-F248 HydrophobicContact CE1-CD2 4.01Å; Y219-F248 AromaticContact CE1-CE2 3.68Å; Y219-F248 HydrophobicContact CE1-CE2 3.68Å; Y219-F248 HydrophobicContact CG-CD2 4.16Å; Y219-M249 PolarHBondContact O-N 3.2Å
220	T	98.8	Very high	96.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	142.7	171.1	54.8	0	0	0	0	112.2	L98 M102 L110 L111 D112 V113 I120 V218 M249	L98-T220 HydrophobicContact CD2-CG2 4.22Å; M102-T220 HydrophobicContact CE-CG2 3.34Å; L110-T220 HydrophobicContact CD1-CG2 3.81Å; L111-T220 PolarHBondContact O-N 3.09Å; L111-T220 PolarHBondContact O-OG1 2.92Å; D112-T220 WeakPolarHBondContact CA-O 3.38Å; D112-T220 WeakPolarHBondContact CA-OG1 3.45Å; D112-T220 PolarHBondContact OD1-OG1 2.71Å; V113-T220 PolarHBondContact N-O 3.31Å; I120-T220 HydrophobicContact CG2-CG2 4.34Å; V218-T220 HydrophobicContact CG1-CG2 4.29Å; T220-M249 VanDerWaalsContact CA-O 3.3Å; T220-M249 WeakPolarHBondContact CA-O 3.3Å; T220-M249 HydrophobicContact CG2-CB 4.21Å
221	I	98.4	Very high	96.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	117.4	163.2	-175.7	157.1	0	0	0	108.6	V113 A114 Y219 I225 F248 M249 C250 L251	V113-I221 HydrophobicContact CB-CD1 4.38Å; V113-I221 HydrophobicContact CG1-CD1 4.19Å; V113-I221 WeakPolarHBondContact O-CG1 3.49Å; A114-I221 HydrophobicContact CB-CD1 4.11Å; A114-I221 HydrophobicContact CB-CG1 4.22Å; Y219-I221 HydrophobicContact CE1-CB 3.93Å; Y219-I221 HydrophobicContact CE1-CG2 3.87Å; I221-I225 HydrophobicContact CD1-CB 3.72Å; I221-I225 HydrophobicContact CD1-CD1 4.45Å; I221-I225 HydrophobicContact CD1-CG1 4.3Å; I221-I225 HydrophobicContact CG1-CB 4.04Å; I221-I225 HydrophobicContact CG2-CB 4.23Å; I221-I225 HydrophobicContact CG2-CD1 4.12Å; I221-F248 HydrophobicContact CG2-CE2 4.28Å; I221-F248 HydrophobicContact CG2-CZ 4.31Å; I221-M249 PolarHBondContact N-O 3.09Å; I221-M249 VanDerWaalsContact N-O 3.16Å; I221-C250 HydrophobicContact CG2-CB 3.92Å; I221-C250 WeakPolarHBondContact O-CA 3.29Å; I221-L251 PolarHBondContact O-N 3.45Å
222	A	97.2	Very high	96.7	Very high	12 Å²	12	30.8 Å²	30.8	10%	0.099	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	113.7	-172.4	0	0	0	0	0	111	I120 G224 L251	I120-A222 HydrophobicContact CD1-CB 4.2Å; I120-A222 HydrophobicContact CG1-CB 3.83Å; A222-G224 PolarHBondContact O-N 3.49Å; A222-L251 CarbonylContact C-O 3.58Å; A222-L251 WeakPolarHBondContact CA-O 3.37Å; A222-L251 HydrophobicContact CB-CB 4.23Å
223	F	95.1	Very high	96.7	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.035	15%	0.15	C	C	.	.	S	Bend	trans	56.7	29.6	-177.5	-53.5	-68.2	0	0	0	114	W94 K95 R226 L251 E252 F253 V325	W94-F223 AromaticContact CE3-CZ 3.84Å; W94-F223 HydrophobicContact CE3-CZ 3.84Å; W94-F223 HydrophobicContact CZ3-CZ 4.48Å; K95-F223 HydrophobicContact CG-CE2 4.44Å; F223-R226 PolarHBondContact O-NH1 3Å; F223-R226 PolarHBondContact O-NH2 3.43Å; F223-L251 HydrophobicContact CE1-CG 4.48Å; F223-L251 HydrophobicContact CE2-CD2 3.62Å; F223-L251 HydrophobicContact CE2-CG 4.12Å; F223-L251 HydrophobicContact CZ-CD2 3.78Å; F223-L251 HydrophobicContact CZ-CG 3.88Å; F223-L251 PolarHBondContact N-O 3.41Å; F223-E252 VanDerWaalsContact C-OE2 3.26Å; F223-E252 VanDerWaalsContact CA-OE2 3.29Å; F223-E252 WeakPolarHBondContact CA-OE2 3.44Å; F223-F253 AromaticContact CD1-CD2 3.65Å; F223-F253 HydrophobicContact CD1-CD2 3.65Å; F223-F253 AromaticContact CD1-CE2 3.55Å; F223-F253 HydrophobicContact CD1-CE2 3.55Å; F223-F253 HydrophobicContact CD1-CG 4.43Å; F223-F253 HydrophobicContact CD1-CZ 4.26Å; F223-F253 AromaticContact CE1-CD2 4Å; F223-F253 HydrophobicContact CE1-CD2 4Å; F223-F253 AromaticContact CE1-CE2 3.85Å; F223-F253 HydrophobicContact CE1-CE2 3.85Å; F223-F253 HydrophobicContact CE1-CG 4.4Å; F223-F253 HydrophobicContact CE1-CZ 4.13Å; F223-F253 HydrophobicContact CG-CE2 4.45Å; F223-V325 HydrophobicContact CE1-CG1 4.05Å; F223-V325 HydrophobicContact CE1-CG2 3.82Å; F223-V325 HydrophobicContact CZ-CG1 4.09Å; F223-V325 HydrophobicContact CZ-CG2 4.17Å
224	G	94.9	Very high	96.7	Very high	7 Å²	7	23.8 Å²	23.8	7%	0.072	13%	0.126	C	C	.	.			trans	-116.3	-42.1	-179.1	0	0	0	0	0	113.9	A222 R226 N227 E252	A222-G224 PolarHBondContact O-N 3.49Å; G224-R226 PolarHBondContact O-N 3.34Å; G224-R226 VanDerWaalsContact O-N 3.08Å; G224-N227 WeakPolarHBondContact O-CB 3.19Å; G224-N227 PolarHBondContact O-N 2.8Å; G224-N227 PolarHBondContact O-ND2 3.49Å; G224-E252 PolarHBondContact N-OE2 3.39Å
225	I	96.9	Very high	96.7	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-61.1	-28.3	-165.9	-165.2	151.6	0	0	0	113.6	I221 N227 V228 I231 L235 C250 E252 F297 F303	I221-I225 HydrophobicContact CD1-CB 3.72Å; I221-I225 HydrophobicContact CD1-CD1 4.45Å; I221-I225 HydrophobicContact CD1-CG1 4.3Å; I221-I225 HydrophobicContact CG1-CB 4.04Å; I221-I225 HydrophobicContact CG2-CB 4.23Å; I221-I225 HydrophobicContact CG2-CD1 4.12Å; I225-N227 PolarHBondContact O-N 2.9Å; I225-N227 VanDerWaalsContact O-N 3.13Å; I225-V228 HydrophobicContact CG1-CG2 4.5Å; I225-V228 WeakPolarHBondContact O-CB 3.49Å; I225-V228 PolarHBondContact O-N 2.96Å; I225-V228 VanDerWaalsContact O-N 3.16Å; I225-I231 HydrophobicContact CD1-CG2 4.23Å; I225-I231 HydrophobicContact CG1-CG1 4.5Å; I225-I231 HydrophobicContact CG1-CG2 4.11Å; I225-L235 HydrophobicContact CD1-CD2 4.1Å; I225-L235 HydrophobicContact CD1-CG 4.49Å; I225-C250 VanDerWaalsContact CG2-SG 3.58Å; I225-E252 HydrophobicContact CG2-CB 4.27Å; I225-E252 HydrophobicContact CG2-CG 3.98Å; I225-F297 HydrophobicContact CG2-CE2 3.81Å; I225-F297 HydrophobicContact CG2-CZ 3.86Å; I225-F303 HydrophobicContact CD1-CE2 4.32Å; I225-F303 HydrophobicContact CD1-CZ 3.97Å; I225-F303 HydrophobicContact CG2-CZ 4.19Å
226	R	95.1	Very high	96.8	Very high	17 Å²	17	22.5 Å²	22.5	6%	0.064	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-61.4	-21.1	176.3	70.9	-178.4	-177.9	-75.4	-14.9	114.2	F223 G224 E252 L290 S293 F297	F223-R226 PolarHBondContact O-NH1 3Å; F223-R226 PolarHBondContact O-NH2 3.43Å; G224-R226 PolarHBondContact O-N 3.34Å; G224-R226 VanDerWaalsContact O-N 3.08Å; R226-E252 HydrophobicContact CB-CG 4.35Å; R226-E252 IonicContact CZ-OE1 3.79Å; R226-E252 PolarHBondContact N-OE2 3.34Å; R226-E252 VanDerWaalsContact NH1-CD 3.29Å; R226-E252 IonicContact NH1-OE1 3.3Å; R226-E252 PolarHBondContact NH1-OE1 2.74Å; R226-E252 IonicContact NH1-OE2 3.49Å; R226-E252 PolarHBondContact NH1-OE2 3.29Å; R226-E252 VanDerWaalsContact NH1-OE2 3.12Å; R226-L290 VanDerWaalsContact NH2-CD1 3.3Å; R226-S293 PolarHBondContact NE-OG 3.31Å; R226-F297 HydrophobicContact CB-CB 4.39Å; R226-F297 HydrophobicContact CB-CD2 3.42Å; R226-F297 VanDerWaalsContact CB-CD2 3.42Å; R226-F297 HydrophobicContact CB-CE2 4Å; R226-F297 HydrophobicContact CB-CG 4.1Å
227	N	93.8	Very high	96.8	Very high	15 Å²	15	23.5 Å²	23.5	8%	0.08	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-94.5	-8.6	-177.6	-56.1	-65.1	0	0	0	113	V68 F72 G224 I225 Y289	V68-N227 HydrophobicContact CG1-CB 3.9Å; F72-N227 HydrophobicContact CE2-CB 4.24Å; F72-N227 WeakPolarHBondContact CZ-ND2 2.98Å; G224-N227 WeakPolarHBondContact O-CB 3.19Å; G224-N227 PolarHBondContact O-N 2.8Å; G224-N227 PolarHBondContact O-ND2 3.49Å; I225-N227 PolarHBondContact O-N 2.9Å; I225-N227 VanDerWaalsContact O-N 3.13Å; N227-Y289 VanDerWaalsContact OD1-CE1 3.31Å; N227-Y289 WeakPolarHBondContact OD1-CE1 3.49Å; N227-Y289 PolarHBondContact OD1-OH 3.03Å
228	V	94	Very high	96.8	Very high	15 Å²	15	21.3 Å²	21.3	9%	0.091	11%	0.111	C	C	.	.			trans	-65.3	145.4	175.1	179.5	0	0	0	0	109	K64 A206 E207 I225 H230 A234	K64-V228 PolarHBondContact NZ-O 2.87Å; A206-V228 HydrophobicContact CB-CG2 4.17Å; E207-V228 HydrophobicContact CG-CG1 3.52Å; E207-V228 WeakPolarHBondContact OE1-CG1 3.35Å; I225-V228 HydrophobicContact CG1-CG2 4.5Å; I225-V228 WeakPolarHBondContact O-CB 3.49Å; I225-V228 PolarHBondContact O-N 2.96Å; I225-V228 VanDerWaalsContact O-N 3.16Å; V228-H230 WeakPolarHBondContact CG1-O 3.48Å; V228-A234 HydrophobicContact CG1-CB 3.81Å
229	T	92.1	Very high	96.8	Very high	22 Å²	22	22.1 Å²	22.1	14%	0.135	12%	0.116	C	C	.	.	S	Bend	trans	-72.3	-52.2	-179.5	-56.7	0	0	0	0	109.6	T52 E61 K64 E207	T52-T229 HydrophobicContact CG2-CG2 4.29Å; E61-T229 HydrophobicContact CB-CG2 3.98Å; E61-T229 HydrophobicContact CG-CG2 3.82Å; K64-T229 HydrophobicContact CD-CG2 4.27Å; E207-T229 VanDerWaalsContact OE1-CA 3.29Å; E207-T229 WeakPolarHBondContact OE1-CA 3.49Å; E207-T229 WeakPolarHBondContact OE1-CB 3.1Å; E207-T229 PolarHBondContact OE1-N 3.37Å
230	H	94.8	Very high	96.8	Very high	46 Å²	46	25 Å²	25	21%	0.213	13%	0.127	C	C	.	.			trans	-116.1	93.3	179.1	-61.9	-64.4	0	0	0	110.8	E61 E207 V228 D232 L233 A234	E61-H230 IonicContact OE1-CE1 2.62Å; E61-H230 PolarHBondContact OE1-CE1 3.06Å; E61-H230 IonicContact OE1-NE2 3.89Å; E61-H230 PolarHBondContact OE1-NE2 3.41Å; E61-H230 IonicContact OE2-CE1 3.12Å; E61-H230 PolarHBondContact OE2-CE1 2.81Å; E61-H230 IonicContact OE2-NE2 2.75Å; E61-H230 PolarHBondContact OE2-NE2 2.89Å; E207-H230 PolarHBondContact OE1-N 3.3Å; E207-H230 IonicContact OE2-CD2 2.83Å; E207-H230 PolarHBondContact OE2-CD2 3.32Å; E207-H230 VanDerWaalsContact OE2-CD2 3.3Å; E207-H230 IonicContact OE2-CG 2.71Å; V228-H230 WeakPolarHBondContact CG1-O 3.48Å; H230-D232 PolarHBondContact O-N 3.02Å; H230-L233 HydrophobicContact CB-CB 3.98Å; H230-L233 HydrophobicContact CB-CD1 3.7Å; H230-L233 HydrophobicContact CB-CG 3.75Å; H230-L233 PolarHBondContact O-N 2.81Å; H230-A234 PolarHBondContact O-N 3.31Å
231	I	97.1	Very high	96.8	Very high	26 Å²	26	25 Å²	25	13%	0.133	13%	0.127	C	C	.	.	H	α-helix	trans	-61.1	-36.3	-178.3	-66	173.9	0	0	0	111	I225 A234 L235 F297 F303 M306	I225-I231 HydrophobicContact CD1-CG2 4.23Å; I225-I231 HydrophobicContact CG1-CG1 4.5Å; I225-I231 HydrophobicContact CG1-CG2 4.11Å; I231-A234 PolarHBondContact O-N 2.83Å; I231-L235 HydrophobicContact CG2-CD1 3.97Å; I231-L235 HydrophobicContact CG2-CG 4.24Å; I231-L235 WeakPolarHBondContact O-CB 3.49Å; I231-L235 VanDerWaalsContact O-CG 3.24Å; I231-L235 WeakPolarHBondContact O-CG 3.44Å; I231-L235 PolarHBondContact O-N 3.09Å; I231-F297 HydrophobicContact CD1-CD2 4.29Å; I231-F297 HydrophobicContact CD1-CE2 3.98Å; I231-F303 HydrophobicContact CG2-CE2 3.84Å; I231-M306 HydrophobicContact CB-CE 3.96Å; I231-M306 HydrophobicContact CG2-CE 3.7Å
232	D	97.1	Very high	96.8	Very high	79 Å²	79	25 Å²	25	42%	0.422	13%	0.127	S	C	.	.	H	α-helix	trans	-60.8	-43.8	176.4	58.3	-47.7	0	0	0	112.4	H230 L235 Q236	H230-D232 PolarHBondContact O-N 3.02Å; D232-L235 PolarHBondContact O-N 3.31Å; D232-Q236 VanDerWaalsContact O-CG 3.32Å; D232-Q236 WeakPolarHBondContact O-CG 3.28Å; D232-Q236 PolarHBondContact O-N 3.5Å
233	L	97.8	Very high	96.9	Very high	64 Å²	64	27 Å²	27	34%	0.335	13%	0.134	S	C	.	.	H	α-helix	trans	-63.9	-44.6	175.3	-64	-176.7	0	0	0	111.5	E207 H230 L235 Q236 E237	E207-L233 HydrophobicContact CB-CB 4.24Å; E207-L233 HydrophobicContact CG-CB 4.39Å; H230-L233 HydrophobicContact CB-CB 3.98Å; H230-L233 HydrophobicContact CB-CD1 3.7Å; H230-L233 HydrophobicContact CB-CG 3.75Å; H230-L233 PolarHBondContact O-N 2.81Å; L233-L235 VanDerWaalsContact C-N 3.28Å; L233-L235 PolarHBondContact O-N 2.96Å; L233-Q236 WeakPolarHBondContact O-CB 3.19Å; L233-Q236 PolarHBondContact O-N 3.46Å; L233-Q236 VanDerWaalsContact O-N 3.14Å; L233-E237 PolarHBondContact O-N 2.93Å
234	A	98.4	Very high	97	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-32.8	176.3	0	0	0	0	0	113.3	A206 V228 H230 I231 A238	A206-A234 HydrophobicContact CB-CB 4.18Å; A206-A234 WeakPolarHBondContact O-CA 3.24Å; V228-A234 HydrophobicContact CG1-CB 3.81Å; H230-A234 PolarHBondContact O-N 3.31Å; I231-A234 PolarHBondContact O-N 2.83Å; A234-A238 WeakPolarHBondContact O-CB 3.35Å; A234-A238 PolarHBondContact O-N 3.4Å
235	L	98.8	Very high	97.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-70.1	-38.2	173	-70.4	172.9	0	0	0	111.9	I225 I231 D232 L233 A238 V239 F248 F303 M306 I307 A310	I225-L235 HydrophobicContact CD1-CD2 4.1Å; I225-L235 HydrophobicContact CD1-CG 4.49Å; I231-L235 HydrophobicContact CG2-CD1 3.97Å; I231-L235 HydrophobicContact CG2-CG 4.24Å; I231-L235 WeakPolarHBondContact O-CB 3.49Å; I231-L235 VanDerWaalsContact O-CG 3.24Å; I231-L235 WeakPolarHBondContact O-CG 3.44Å; I231-L235 PolarHBondContact O-N 3.09Å; D232-L235 PolarHBondContact O-N 3.31Å; L233-L235 VanDerWaalsContact C-N 3.28Å; L233-L235 PolarHBondContact O-N 2.96Å; L235-A238 WeakPolarHBondContact O-CB 3.47Å; L235-A238 PolarHBondContact O-N 3.35Å; L235-V239 WeakPolarHBondContact O-CG2 3.45Å; L235-V239 PolarHBondContact O-N 3.18Å; L235-F248 HydrophobicContact CD2-CE1 4.23Å; L235-F248 HydrophobicContact CD2-CE2 4.03Å; L235-F248 HydrophobicContact CD2-CZ 3.6Å; L235-F303 HydrophobicContact CD1-CE2 4.34Å; L235-M306 HydrophobicContact CD1-CB 4.01Å; L235-I307 HydrophobicContact CD1-CG1 4.16Å; L235-I307 HydrophobicContact CD2-CG1 3.9Å; L235-A310 HydrophobicContact CB-CB 3.65Å
236	Q	98.5	Very high	97.2	Very high	99 Å²	99	32.8 Å²	32.8	46%	0.463	18%	0.181	S	C	.	.	H	α-helix	trans	-62.9	-43.6	173.1	-71.2	169.6	23.1	0	0	111.3	D232 L233 A238 V239 R240	D232-Q236 VanDerWaalsContact O-CG 3.32Å; D232-Q236 WeakPolarHBondContact O-CG 3.28Å; D232-Q236 PolarHBondContact O-N 3.5Å; L233-Q236 WeakPolarHBondContact O-CB 3.19Å; L233-Q236 PolarHBondContact O-N 3.46Å; L233-Q236 VanDerWaalsContact O-N 3.14Å; Q236-A238 VanDerWaalsContact C-N 3.33Å; Q236-A238 PolarHBondContact O-N 3.06Å; Q236-V239 WeakPolarHBondContact O-CB 3.4Å; Q236-V239 PolarHBondContact O-N 3.32Å; Q236-R240 WeakPolarHBondContact O-CB 3.25Å; Q236-R240 PolarHBondContact O-N 3.29Å
237	E	98.7	Very high	97.4	Very high	28 Å²	28	34.5 Å²	34.5	13%	0.131	19%	0.187	C	C	.	.	H	α-helix	trans	-61.9	-40.9	174.1	-79	-62.9	96	0	0	112.1	E207 L209 L233 V239 R240 V241	E207-E237 VanDerWaalsContact O-CG 3.31Å; E207-E237 WeakPolarHBondContact O-CG 3.3Å; L209-E237 WeakPolarHBondContact CB-OE2 3.17Å; L209-E237 HydrophobicContact CD1-CB 3.89Å; L209-E237 HydrophobicContact CG-CB 4.18Å; L209-E237 PolarHBondContact N-OE2 3.34Å; L233-E237 PolarHBondContact O-N 2.93Å; E237-V239 VanDerWaalsContact C-N 3.3Å; E237-V239 PolarHBondContact O-N 2.83Å; E237-R240 PolarHBondContact O-N 3.46Å; E237-R240 IonicContact OE1-CZ 3.09Å; E237-R240 IonicContact OE1-NE 3.71Å; E237-R240 PolarHBondContact OE1-NE 2.74Å; E237-R240 IonicContact OE1-NH2 2.85Å; E237-R240 IonicContact OE2-CZ 2.71Å; E237-R240 IonicContact OE2-NE 3.75Å; E237-R240 PolarHBondContact OE2-NE 2.62Å; E237-R240 IonicContact OE2-NH2 3.32Å; E237-R240 PolarHBondContact OE2-NH2 3.03Å; E237-V241 WeakPolarHBondContact O-CG1 3.45Å; E237-V241 WeakPolarHBondContact O-CG2 3.49Å; E237-V241 PolarHBondContact O-N 3.08Å
238	A	98.7	Very high	97.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-41.2	174.3	0	0	0	0	0	112	Y219 A234 L235 Q236 L242 F248	Y219-A238 HydrophobicContact CD1-CB 4.12Å; Y219-A238 HydrophobicContact CD2-CB 3.81Å; Y219-A238 HydrophobicContact CE1-CB 3.97Å; Y219-A238 HydrophobicContact CE2-CB 3.62Å; Y219-A238 HydrophobicContact CG-CB 4.06Å; A234-A238 WeakPolarHBondContact O-CB 3.35Å; A234-A238 PolarHBondContact O-N 3.4Å; L235-A238 WeakPolarHBondContact O-CB 3.47Å; L235-A238 PolarHBondContact O-N 3.35Å; Q236-A238 VanDerWaalsContact C-N 3.33Å; Q236-A238 PolarHBondContact O-N 3.06Å; A238-L242 WeakPolarHBondContact O-CB 3.44Å; A238-L242 WeakPolarHBondContact O-CD1 3.44Å; A238-L242 WeakPolarHBondContact O-CG 3.38Å; A238-L242 PolarHBondContact O-N 3.43Å; A238-F248 HydrophobicContact CB-CD2 3.86Å; A238-F248 HydrophobicContact CB-CE2 3.98Å
239	V	98.7	Very high	97.8	Very high	25 Å²	25	33.1 Å²	33.1	15%	0.152	18%	0.179	C	C	.	.	H	α-helix	trans	-65.3	-44.2	174.5	174.1	0	0	0	0	110.9	L235 Q236 E237 A310 L312 K332	L235-V239 WeakPolarHBondContact O-CG2 3.45Å; L235-V239 PolarHBondContact O-N 3.18Å; Q236-V239 WeakPolarHBondContact O-CB 3.4Å; Q236-V239 PolarHBondContact O-N 3.32Å; E237-V239 VanDerWaalsContact C-N 3.3Å; E237-V239 PolarHBondContact O-N 2.83Å; V239-A310 HydrophobicContact CG2-CB 4.38Å; V239-A310 WeakPolarHBondContact CG2-O 3.45Å; V239-L312 HydrophobicContact CG2-CD1 4.2Å; V239-L312 HydrophobicContact CG2-CD2 4.14Å; V239-L312 HydrophobicContact CG2-CG 3.71Å; V239-K332 VanDerWaalsContact O-CD 3.27Å; V239-K332 WeakPolarHBondContact O-CD 3.28Å; V239-K332 VanDerWaalsContact O-CE 3.28Å; V239-K332 WeakPolarHBondContact O-CE 3.34Å; V239-K332 PolarHBondContact O-NZ 2.87Å
240	R	98.6	Very high	98.1	Very high	60 Å²	60	32.1 Å²	32.1	23%	0.226	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-50	-177.7	-172.9	-178.2	65.1	75.6	-1.2	111.9	L209 F211 D213 D214 Q236 E237 K332	L209-R240 PolarHBondContact O-NH2 3.18Å; F211-R240 PolarHBondContact O-NH1 3.34Å; F211-R240 PolarHBondContact O-NH2 3.44Å; D213-R240 WeakPolarHBondContact CA-O 3.37Å; D213-R240 HydrophobicContact CB-CG 4.32Å; D213-R240 VanDerWaalsContact OD1-CD 3.24Å; D213-R240 WeakPolarHBondContact OD1-CD 3.36Å; D213-R240 WeakPolarHBondContact OD1-CG 3.33Å; D213-R240 IonicContact OD1-CZ 2.79Å; D213-R240 IonicContact OD1-NE 2.75Å; D213-R240 IonicContact OD1-NH1 3.83Å; D213-R240 PolarHBondContact OD1-NH1 3.35Å; D214-R240 PolarHBondContact N-O 3.36Å; Q236-R240 WeakPolarHBondContact O-CB 3.25Å; Q236-R240 PolarHBondContact O-N 3.29Å; E237-R240 PolarHBondContact O-N 3.46Å; E237-R240 IonicContact OE1-CZ 3.09Å; E237-R240 IonicContact OE1-NE 3.71Å; E237-R240 PolarHBondContact OE1-NE 2.74Å; E237-R240 IonicContact OE1-NH2 2.85Å; E237-R240 IonicContact OE2-CZ 2.71Å; E237-R240 IonicContact OE2-NE 3.75Å; E237-R240 PolarHBondContact OE2-NE 2.62Å; E237-R240 IonicContact OE2-NH2 3.32Å; E237-R240 PolarHBondContact OE2-NH2 3.03Å; R240-K332 PolarHBondContact O-NZ 2.89Å
241	V	98.8	Very high	98.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-79	-19.9	-174.5	-55.9	0	0	0	0	114.1	L111 L209 F211 Q215 F216 Y219 E237	L111-V241 HydrophobicContact CD2-CG2 3.79Å; L209-V241 HydrophobicContact CB-CG1 4.23Å; L209-V241 HydrophobicContact CD1-CG1 3.97Å; L209-V241 HydrophobicContact CD1-CG2 4.07Å; F211-V241 HydrophobicContact CB-CG1 4.12Å; Q215-V241 PolarHBondContact N-O 3.12Å; F216-V241 HydrophobicContact CD2-CB 4.03Å; F216-V241 HydrophobicContact CD2-CG2 4.22Å; F216-V241 HydrophobicContact CE2-CB 4.43Å; F216-V241 PolarHBondContact N-O 3.25Å; Y219-V241 HydrophobicContact CD2-CG2 3.93Å; Y219-V241 HydrophobicContact CE2-CG2 4.31Å; E237-V241 WeakPolarHBondContact O-CG1 3.45Å; E237-V241 WeakPolarHBondContact O-CG2 3.49Å; E237-V241 PolarHBondContact O-N 3.08Å
242	L	98.8	Very high	98.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	139.7	173.3	-82.6	172.9	0	0	0	110.5	A238 F248 L312 K332	A238-L242 WeakPolarHBondContact O-CB 3.44Å; A238-L242 WeakPolarHBondContact O-CD1 3.44Å; A238-L242 WeakPolarHBondContact O-CG 3.38Å; A238-L242 PolarHBondContact O-N 3.43Å; L242-F248 HydrophobicContact CD1-CB 3.95Å; L242-L312 HydrophobicContact CD1-CD2 4.24Å; L242-K332 HydrophobicContact CB-CB 4.31Å; L242-K332 HydrophobicContact CB-CD 4.1Å; L242-K332 WeakPolarHBondContact O-CD 3.43Å; L242-K332 WeakPolarHBondContact O-CE 3.22Å; L242-K332 PolarHBondContact O-NZ 3.36Å
243	K	98.4	Very high	98.1	Very high	55 Å²	55	26 Å²	26	24%	0.239	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	159.9	167.7	-70.6	171.4	-163.6	167.1	0	111.7	D214 Q215 F216 D217 G245 G246 K332	D214-K243 VanDerWaalsContact C-CG 3.5Å; D214-K243 HydrophobicContact CB-CG 4.29Å; D214-K243 WeakPolarHBondContact O-CG 3.28Å; Q215-K243 WeakPolarHBondContact O-CE 3.49Å; F216-K243 PolarHBondContact O-N 3.32Å; D217-K243 VanDerWaalsContact CG-NZ 3.33Å; D217-K243 VanDerWaalsContact OD1-CD 3.31Å; D217-K243 WeakPolarHBondContact OD1-CD 3.24Å; D217-K243 IonicContact OD1-NZ 3.98Å; D217-K243 PolarHBondContact OD1-NZ 3.08Å; D217-K243 IonicContact OD2-NZ 2.78Å; D217-K243 PolarHBondContact OD2-NZ 3.16Å; K243-G245 PolarHBondContact O-N 3.13Å; K243-G246 VanDerWaalsContact O-CA 3.27Å; K243-G246 WeakPolarHBondContact O-CA 3.44Å; K243-G246 PolarHBondContact O-N 2.96Å; K243-K332 WeakPolarHBondContact O-CD 3.28Å
244	P	98.2	Very high	97.9	Very high	80 Å²	80	23.3 Å²	23.3	52%	0.519	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	132.2	162.3	-23.3	35	0	0	0	110.7	D214 G246	D214-P244 WeakPolarHBondContact OD1-CD 3.32Å; P244-G246 PolarHBondContact O-N 3.03Å
245	G	97	Very high	97.6	Very high	54 Å²	54	28.1 Å²	28.1	56%	0.557	15%	0.149	S	C	*	.	E	Extended strand (participates in β ladder)	trans	77.6	-4.3	-169.9	0	0	0	0	0	114.9	K243 K332	K243-G245 PolarHBondContact O-N 3.13Å; G245-K332 VanDerWaalsContact CA-O 3.26Å; G245-K332 WeakPolarHBondContact CA-O 3.41Å; G245-K332 PolarHBondContact N-O 3.09Å
246	G	97.9	Very high	97.2	Very high	3 Å²	3	29.3 Å²	29.3	3%	0.031	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	150.7	177.1	0	0	0	0	0	112	D217 K243 P244 F331 K332	D217-G246 CarbonylContact O-C 3.54Å; D217-G246 VanDerWaalsContact O-CA 3.24Å; D217-G246 WeakPolarHBondContact O-CA 3.46Å; K243-G246 VanDerWaalsContact O-CA 3.27Å; K243-G246 WeakPolarHBondContact O-CA 3.44Å; K243-G246 PolarHBondContact O-N 2.96Å; P244-G246 PolarHBondContact O-N 3.03Å; G246-F331 CarbonylContact O-C 3.55Å; G246-F331 WeakPolarHBondContact O-CA 3.48Å; G246-K332 PolarHBondContact O-N 3.19Å
247	R	98.4	Very high	96.5	Very high	53 Å²	53	28.8 Å²	28.8	20%	0.2	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124	-171	-168.2	177.6	-176.8	-174	-3.1	112.2	V101 D217 V218 Y219 M249 S329 F331	V101-R247 PolarHBondContact O-NH1 2.97Å; D217-R247 PolarHBondContact O-N 3.19Å; V218-R247 WeakPolarHBondContact CA-O 3.49Å; Y219-R247 PolarHBondContact N-O 3.03Å; R247-M249 HydrophobicContact CG-CG 4.08Å; R247-S329 PolarHBondContact NE-OG 3.4Å; R247-S329 PolarHBondContact NH2-OG 3.16Å; R247-F331 HydrophobicContact CB-CD1 4Å; R247-F331 HydrophobicContact CB-CE1 3.89Å; R247-F331 HydrophobicContact CG-CD1 4.02Å; R247-F331 HydrophobicContact CG-CE1 3.67Å; R247-F331 HydrophobicContact CG-CZ 4.05Å
248	F	98.8	Very high	96	Very high	1 Å²	1	31.2 Å²	31.2	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	137.9	167.1	176	-98.9	0	0	0	110.6	Y219 I221 L235 A238 L242 C250 I307 L312 S329 G330	Y219-F248 AromaticContact CD1-CD2 3.49Å; Y219-F248 HydrophobicContact CD1-CD2 3.49Å; Y219-F248 VanDerWaalsContact CD1-CD2 3.49Å; Y219-F248 AromaticContact CD1-CE2 3.64Å; Y219-F248 HydrophobicContact CD1-CE2 3.64Å; Y219-F248 HydrophobicContact CE1-CD2 4.01Å; Y219-F248 AromaticContact CE1-CE2 3.68Å; Y219-F248 HydrophobicContact CE1-CE2 3.68Å; Y219-F248 HydrophobicContact CG-CD2 4.16Å; I221-F248 HydrophobicContact CG2-CE2 4.28Å; I221-F248 HydrophobicContact CG2-CZ 4.31Å; L235-F248 HydrophobicContact CD2-CE1 4.23Å; L235-F248 HydrophobicContact CD2-CE2 4.03Å; L235-F248 HydrophobicContact CD2-CZ 3.6Å; A238-F248 HydrophobicContact CB-CD2 3.86Å; A238-F248 HydrophobicContact CB-CE2 3.98Å; L242-F248 HydrophobicContact CD1-CB 3.95Å; F248-C250 HydrophobicContact CE1-CB 3.61Å; F248-C250 HydrophobicContact CZ-CB 3.59Å; F248-I307 HydrophobicContact CD1-CG2 4.18Å; F248-I307 HydrophobicContact CE1-CD1 3.84Å; F248-I307 HydrophobicContact CE1-CG1 4.07Å; F248-I307 HydrophobicContact CE1-CG2 4.3Å; F248-L312 HydrophobicContact CB-CD1 3.47Å; F248-L312 VanDerWaalsContact CB-CD1 3.47Å; F248-L312 HydrophobicContact CB-CD2 4.05Å; F248-L312 HydrophobicContact CB-CG 4.41Å; F248-L312 HydrophobicContact CD1-CD1 3.82Å; F248-L312 HydrophobicContact CD2-CD1 4.16Å; F248-L312 HydrophobicContact CG-CD1 3.56Å; F248-S329 WeakPolarHBondContact O-CA 3.02Å; F248-S329 WeakPolarHBondContact O-CB 3.41Å; F248-S329 PolarHBondContact O-OG 2.8Å; F248-G330 PolarHBondContact N-O 2.63Å; F248-G330 PolarHBondContact O-N 3.35Å; F248-G330 VanDerWaalsContact O-N 3.11Å
249	M	98.7	Very high	95.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	119.4	175.4	-61.4	-169.1	68.3	0	0	111	L98 V101 M102 Y219 T220 I221 R247 L327 H328	L98-M249 HydrophobicContact CG-CE 4.37Å; V101-M249 HydrophobicContact CB-CE 4.14Å; V101-M249 HydrophobicContact CG1-CE 3.8Å; M102-M249 HydrophobicContact CB-CE 4.03Å; M102-M249 HydrophobicContact CB-SD 3.57Å; M102-M249 VanDerWaalsContact CB-SD 3.57Å; M102-M249 HydrophobicContact CE-SD 4.31Å; M102-M249 HydrophobicContact CG-SD 3.87Å; Y219-M249 PolarHBondContact O-N 3.2Å; T220-M249 VanDerWaalsContact CA-O 3.3Å; T220-M249 WeakPolarHBondContact CA-O 3.3Å; T220-M249 HydrophobicContact CG2-CB 4.21Å; I221-M249 PolarHBondContact N-O 3.09Å; I221-M249 VanDerWaalsContact N-O 3.16Å; R247-M249 HydrophobicContact CG-CG 4.08Å; M249-L327 HydrophobicContact CE-CD1 4.1Å; M249-L327 HydrophobicContact CE-CD2 3.86Å; M249-L327 HydrophobicContact CE-CG 4.46Å; M249-H328 CarbonylContact C-O 3.5Å; M249-H328 WeakPolarHBondContact CA-O 3.3Å
250	C	98.6	Very high	94.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124.4	178	177.2	0	0	0	0	110.6	I221 I225 F248 F303 L327 H328	I221-C250 HydrophobicContact CG2-CB 3.92Å; I221-C250 WeakPolarHBondContact O-CA 3.29Å; I225-C250 VanDerWaalsContact CG2-SG 3.58Å; F248-C250 HydrophobicContact CE1-CB 3.61Å; F248-C250 HydrophobicContact CZ-CB 3.59Å; C250-F303 HydrophobicContact CB-CE1 4.16Å; C250-F303 HydrophobicContact CB-CZ 4.49Å; C250-L327 CarbonylContact O-C 3.53Å; C250-L327 WeakPolarHBondContact O-CA 3.43Å; C250-H328 HydrophobicContact CB-CB 4.44Å; C250-H328 PolarHBondContact N-O 3.16Å; C250-H328 PolarHBondContact O-N 3.18Å
251	L	98.3	Very high	94.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	112.2	173.4	-176.9	73.4	0	0	0	108.5	W94 K95 L98 I221 A222 F223 L320 V325 L327	W94-L251 HydrophobicContact CB-CD1 4.43Å; W94-L251 HydrophobicContact CB-CD2 4.12Å; K95-L251 HydrophobicContact CG-CD2 4.12Å; L98-L251 HydrophobicContact CB-CD2 4.46Å; L98-L251 HydrophobicContact CD1-CB 3.69Å; L98-L251 HydrophobicContact CD1-CD2 4.41Å; I221-L251 PolarHBondContact O-N 3.45Å; A222-L251 CarbonylContact C-O 3.58Å; A222-L251 WeakPolarHBondContact CA-O 3.37Å; A222-L251 HydrophobicContact CB-CB 4.23Å; F223-L251 HydrophobicContact CE1-CG 4.48Å; F223-L251 HydrophobicContact CE2-CD2 3.62Å; F223-L251 HydrophobicContact CE2-CG 4.12Å; F223-L251 HydrophobicContact CZ-CD2 3.78Å; F223-L251 HydrophobicContact CZ-CG 3.88Å; F223-L251 PolarHBondContact N-O 3.41Å; L251-L320 HydrophobicContact CD1-CD1 3.76Å; L251-V325 HydrophobicContact CD1-CG1 3.45Å; L251-V325 VanDerWaalsContact CD1-CG1 3.45Å; L251-V325 HydrophobicContact CG-CG1 3.91Å; L251-L327 HydrophobicContact CB-CD1 4.29Å; L251-L327 HydrophobicContact CD1-CB 4.11Å; L251-L327 HydrophobicContact CD1-CD1 4.37Å
252	E	97.3	Very high	93.7	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	155.1	-175.1	-168.7	52.3	-84.3	0	0	111.8	F223 G224 I225 R226 F297 V325 A326	F223-E252 VanDerWaalsContact C-OE2 3.26Å; F223-E252 VanDerWaalsContact CA-OE2 3.29Å; F223-E252 WeakPolarHBondContact CA-OE2 3.44Å; G224-E252 PolarHBondContact N-OE2 3.39Å; I225-E252 HydrophobicContact CG2-CB 4.27Å; I225-E252 HydrophobicContact CG2-CG 3.98Å; R226-E252 HydrophobicContact CB-CG 4.35Å; R226-E252 IonicContact CZ-OE1 3.79Å; R226-E252 PolarHBondContact N-OE2 3.34Å; R226-E252 VanDerWaalsContact NH1-CD 3.29Å; R226-E252 IonicContact NH1-OE1 3.3Å; R226-E252 PolarHBondContact NH1-OE1 2.74Å; R226-E252 IonicContact NH1-OE2 3.49Å; R226-E252 PolarHBondContact NH1-OE2 3.29Å; R226-E252 VanDerWaalsContact NH1-OE2 3.12Å; E252-F297 HydrophobicContact CB-CE1 4.19Å; E252-F297 HydrophobicContact CB-CZ 4.27Å; E252-F297 HydrophobicContact CG-CD1 4.09Å; E252-F297 HydrophobicContact CG-CD2 4.41Å; E252-F297 HydrophobicContact CG-CE1 3.73Å; E252-F297 HydrophobicContact CG-CE2 4.09Å; E252-F297 HydrophobicContact CG-CG 4.42Å; E252-F297 HydrophobicContact CG-CZ 3.74Å; E252-V325 CarbonylContact O-C 3.55Å; E252-V325 WeakPolarHBondContact O-CA 3.27Å; E252-V325 WeakPolarHBondContact O-CG1 3.41Å; E252-A326 PolarHBondContact N-O 3.47Å; E252-A326 PolarHBondContact O-N 3.41Å
253	F	93.8	Very high	93.1	Very high	21 Å²	21	50.5 Å²	50.5	9%	0.092	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	144.3	169.3	-69.9	-77	0	0	0	110.6	W94 F223 I294 F297 V324 V325	W94-F253 HydrophobicContact CZ3-CE1 4.19Å; F223-F253 AromaticContact CD1-CD2 3.65Å; F223-F253 HydrophobicContact CD1-CD2 3.65Å; F223-F253 AromaticContact CD1-CE2 3.55Å; F223-F253 HydrophobicContact CD1-CE2 3.55Å; F223-F253 HydrophobicContact CD1-CG 4.43Å; F223-F253 HydrophobicContact CD1-CZ 4.26Å; F223-F253 AromaticContact CE1-CD2 4Å; F223-F253 HydrophobicContact CE1-CD2 4Å; F223-F253 AromaticContact CE1-CE2 3.85Å; F223-F253 HydrophobicContact CE1-CE2 3.85Å; F223-F253 HydrophobicContact CE1-CG 4.4Å; F223-F253 HydrophobicContact CE1-CZ 4.13Å; F223-F253 HydrophobicContact CG-CE2 4.45Å; F253-I294 HydrophobicContact CB-CB 4.35Å; F253-I294 HydrophobicContact CB-CD1 4.16Å; F253-I294 HydrophobicContact CB-CG1 3.78Å; F253-I294 HydrophobicContact CB-CG2 3.82Å; F253-I294 HydrophobicContact CD1-CD1 4.09Å; F253-I294 HydrophobicContact CD2-CD1 3.72Å; F253-I294 HydrophobicContact CD2-CG1 3.87Å; F253-I294 HydrophobicContact CE1-CD1 4.44Å; F253-I294 HydrophobicContact CE2-CD1 4.09Å; F253-I294 HydrophobicContact CG-CD1 3.72Å; F253-I294 HydrophobicContact CG-CG1 3.86Å; F253-I294 HydrophobicContact CG-CG2 4.46Å; F253-I294 HydrophobicContact CZ-CD1 4.43Å; F253-F297 VanDerWaalsContact O-CD1 3.28Å; F253-F297 WeakPolarHBondContact O-CD1 3.37Å; F253-V324 VanDerWaalsContact CA-O 3.31Å; F253-V324 WeakPolarHBondContact CA-O 3.18Å; F253-V324 HydrophobicContact CD1-CG1 4.13Å; F253-V324 WeakPolarHBondContact CD1-O 3.29Å; F253-V324 HydrophobicContact CE1-CG1 4.26Å; F253-V325 HydrophobicContact CD1-CG2 3.74Å; F253-V325 HydrophobicContact CE1-CG2 3.93Å; F253-V325 HydrophobicContact CG-CG2 4.39Å
254	S	93.2	Very high	92.5	Very high	7 Å²	7	53.7 Å²	53.7	5%	0.049	29%	0.292	C	S	.	.			trans	-146.7	-167.8	-179.5	-157.9	0	0	0	0	110.9	Q300 G323 V324	S254-Q300 WeakPolarHBondContact OG-CG 3.31Å; S254-Q300 PolarHBondContact OG-OE1 3.1Å; S254-G323 CarbonylContact C-O 3.5Å; S254-G323 VanDerWaalsContact C-O 3.3Å; S254-V324 PolarHBondContact N-O 3.42Å
255	K	90.8	Very high	91.9	Very high	103 Å²	103	51.9 Å²	51.9	45%	0.448	28%	0.275	S	S	.	.			trans	-85.6	127.4	-176.9	-60.3	-164.7	-163.3	153.2	0	111.1	T257 D299 Q300 G323	K255-T257 PolarHBondContact O-N 3.28Å; K255-D299 HydrophobicContact CB-CB 4.32Å; K255-D299 HydrophobicContact CD-CB 3.7Å; K255-D299 HydrophobicContact CG-CB 3.9Å; K255-D299 IonicContact NZ-OD2 3.05Å; K255-D299 PolarHBondContact NZ-OD2 3.01Å; K255-Q300 PolarHBondContact O-NE2 3.43Å; K255-G323 CarbonylContact C-O 3.11Å; K255-G323 VanDerWaalsContact C-O 3.27Å; K255-G323 VanDerWaalsContact O-O 3.12Å
256	V	90.4	Very high	91.4	Very high	24 Å²	24	52 Å²	52	15%	0.145	26%	0.264	C	S	.	.			trans	-63.4	125.3	174.4	-178.1	0	0	0	0	109.5	L261 A262 Y265 V324	V256-L261 HydrophobicContact CG1-CB 3.74Å; V256-L261 HydrophobicContact CG1-CD2 3.8Å; V256-L261 HydrophobicContact CG1-CG 3.68Å; V256-A262 HydrophobicContact CB-CB 3.97Å; V256-A262 HydrophobicContact CG1-CB 4.06Å; V256-Y265 HydrophobicContact CG2-CD1 4.06Å; V256-Y265 HydrophobicContact CG2-CG 4.18Å; V256-V324 HydrophobicContact CG2-CG2 3.73Å
257	T	85.8	Confident	90.7	Very high	89 Å²	89	54 Å²	54	55%	0.546	28%	0.279	S	S	.	.	S	Bend	trans	-82.5	-26.2	-173.3	57.8	0	0	0	0	113	K255 G322	K255-T257 PolarHBondContact O-N 3.28Å; T257-G322 PolarHBondContact N-O 2.75Å; T257-G322 PolarHBondContact OG1-O 2.96Å
258	N	86.8	Confident	90.1	Very high	78 Å²	78	54.5 Å²	54.5	42%	0.417	28%	0.282	S	S	.	.	S	Bend	trans	-89.4	121.1	178.7	-176.8	-53.9	0	0	0	110.7	L260 L261 A262	N258-L260 VanDerWaalsContact C-N 3.32Å; N258-L260 PolarHBondContact O-N 2.93Å; N258-L260 WeakPolarHBondContact OD1-CB 3.48Å; N258-L260 PolarHBondContact OD1-N 3.45Å; N258-L261 HydrophobicContact CB-CB 3.99Å; N258-L261 PolarHBondContact O-N 3.2Å; N258-L261 PolarHBondContact OD1-N 2.95Å; N258-A262 WeakPolarHBondContact O-CB 3.34Å; N258-A262 PolarHBondContact O-N 2.83Å
259	P	86.6	Confident	89.3	Confident	95 Å²	95	54.6 Å²	54.6	62%	0.617	28%	0.283	S	S	*	.	H	α-helix	trans	-59.9	-33.4	-176.6	-26.3	34.7	0	0	0	115.4	R263	P259-R263 WeakPolarHBondContact O-CG 3.39Å; P259-R263 PolarHBondContact O-N 3.11Å
260	L	86.7	Confident	88.4	Confident	123 Å²	123	58.5 Å²	58.5	64%	0.644	30%	0.3	S	S	*	.	H	α-helix	trans	-71.9	-44.3	177.7	-67.2	173.9	0	0	0	110.7	N258 A262 R263 L264	N258-L260 VanDerWaalsContact C-N 3.32Å; N258-L260 PolarHBondContact O-N 2.93Å; N258-L260 WeakPolarHBondContact OD1-CB 3.48Å; N258-L260 PolarHBondContact OD1-N 3.45Å; L260-A262 VanDerWaalsContact C-N 3.3Å; L260-A262 PolarHBondContact O-N 2.86Å; L260-R263 PolarHBondContact O-N 3.5Å; L260-L264 WeakPolarHBondContact O-CG 3.2Å; L260-L264 PolarHBondContact O-N 3.4Å; L260-L264 VanDerWaalsContact O-N 3.15Å
261	L	86.1	Confident	87.6	Confident	64 Å²	64	65.1 Å²	65.1	34%	0.335	33%	0.33	S	S	.	.	H	α-helix	trans	-65	-37.1	176.1	-174.5	61.1	0	0	0	111.2	V256 N258 L264 Y265	V256-L261 HydrophobicContact CG1-CB 3.74Å; V256-L261 HydrophobicContact CG1-CD2 3.8Å; V256-L261 HydrophobicContact CG1-CG 3.68Å; N258-L261 HydrophobicContact CB-CB 3.99Å; N258-L261 PolarHBondContact O-N 3.2Å; N258-L261 PolarHBondContact OD1-N 2.95Å; L261-L264 PolarHBondContact O-N 2.97Å; L261-Y265 VanDerWaalsContact O-CB 3.23Å; L261-Y265 WeakPolarHBondContact O-CB 3.46Å; L261-Y265 PolarHBondContact O-N 3.33Å
262	A	87.4	Confident	86.7	Confident	22 Å²	22	69.6 Å²	69.6	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-60.2	-47.8	176.8	0	0	0	0	0	111.1	V256 N258 L260 L264 Y265 D266	V256-A262 HydrophobicContact CB-CB 3.97Å; V256-A262 HydrophobicContact CG1-CB 4.06Å; N258-A262 WeakPolarHBondContact O-CB 3.34Å; N258-A262 PolarHBondContact O-N 2.83Å; L260-A262 VanDerWaalsContact C-N 3.3Å; L260-A262 PolarHBondContact O-N 2.86Å; A262-L264 PolarHBondContact O-N 3.28Å; A262-Y265 PolarHBondContact O-N 3.49Å; A262-D266 WeakPolarHBondContact O-CB 3.49Å; A262-D266 VanDerWaalsContact O-CG 3.28Å; A262-D266 PolarHBondContact O-N 3.15Å
263	R	87.1	Confident	85.9	Confident	186 Å²	186	70 Å²	70	70%	0.702	36%	0.355	S	S	*	.	H	α-helix	trans	-60.8	-42.7	176.7	-72.1	178.2	-176.5	178.4	1.5	112.9	P259 L260 A267	P259-R263 WeakPolarHBondContact O-CG 3.39Å; P259-R263 PolarHBondContact O-N 3.11Å; L260-R263 PolarHBondContact O-N 3.5Å; R263-A267 WeakPolarHBondContact O-CB 3.43Å; R263-A267 PolarHBondContact O-N 2.82Å
264	L	85.8	Confident	85.2	Confident	122 Å²	122	69.3 Å²	69.3	64%	0.639	35%	0.352	S	S	*	.	H	α-helix	trans	-66.2	-43.2	177.3	-70.6	173.5	0	0	0	111.5	L260 L261 A262 A267 Y268	L260-L264 WeakPolarHBondContact O-CG 3.2Å; L260-L264 PolarHBondContact O-N 3.4Å; L260-L264 VanDerWaalsContact O-N 3.15Å; L261-L264 PolarHBondContact O-N 2.97Å; A262-L264 PolarHBondContact O-N 3.28Å; L264-A267 PolarHBondContact O-N 3.43Å; L264-Y268 WeakPolarHBondContact O-CB 3.04Å; L264-Y268 PolarHBondContact O-N 2.87Å
265	Y	85.5	Confident	84.5	Confident	42 Å²	42	72 Å²	72	17%	0.165	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-44.1	177.1	177.3	-101.7	0	0	0	111.4	V256 L261 A262 Y268 S269 V324	V256-Y265 HydrophobicContact CG2-CD1 4.06Å; V256-Y265 HydrophobicContact CG2-CG 4.18Å; L261-Y265 VanDerWaalsContact O-CB 3.23Å; L261-Y265 WeakPolarHBondContact O-CB 3.46Å; L261-Y265 PolarHBondContact O-N 3.33Å; A262-Y265 PolarHBondContact O-N 3.49Å; Y265-Y268 PolarHBondContact O-N 2.82Å; Y265-S269 VanDerWaalsContact O-CB 3.29Å; Y265-S269 WeakPolarHBondContact O-CB 3.46Å; Y265-S269 PolarHBondContact O-N 3.34Å; Y265-S269 PolarHBondContact O-OG 2.76Å; Y265-V324 HydrophobicContact CD2-CG1 4.41Å; Y265-V324 HydrophobicContact CD2-CG2 4.21Å; Y265-V324 HydrophobicContact CE2-CG1 3.84Å; Y265-V324 HydrophobicContact CE2-CG2 4.44Å
266	D	85	Confident	83.9	Confident	58 Å²	58	69.7 Å²	69.7	31%	0.31	36%	0.361	S	S	.	.	H	α-helix	trans	-61	-46.6	176	-77.1	-35.7	0	0	0	111.5	A262 Y268 S269 F270 R295	A262-D266 WeakPolarHBondContact O-CB 3.49Å; A262-D266 VanDerWaalsContact O-CG 3.28Å; A262-D266 PolarHBondContact O-N 3.15Å; D266-Y268 VanDerWaalsContact C-N 3.35Å; D266-Y268 PolarHBondContact O-N 3.29Å; D266-S269 PolarHBondContact O-N 3.09Å; D266-S269 PolarHBondContact O-OG 3.4Å; D266-S269 VanDerWaalsContact O-OG 3.12Å; D266-F270 VanDerWaalsContact O-CD2 3.32Å; D266-F270 WeakPolarHBondContact O-CD2 3.46Å; D266-F270 PolarHBondContact O-N 2.87Å; D266-R295 IonicContact OD1-CZ 2.76Å; D266-R295 IonicContact OD1-NE 3.1Å; D266-R295 IonicContact OD1-NH2 3.85Å; D266-R295 PolarHBondContact OD1-NH2 2.78Å; D266-R295 IonicContact OD2-NH2 3.62Å
267	A	84.7	Confident	83	Confident	44 Å²	44	68.5 Å²	68.5	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-60.2	-46.7	177.1	0	0	0	0	0	111.2	R263 L264 Q271	R263-A267 WeakPolarHBondContact O-CB 3.43Å; R263-A267 PolarHBondContact O-N 2.82Å; L264-A267 PolarHBondContact O-N 3.43Å; A267-Q271 VanDerWaalsContact O-CB 3.29Å; A267-Q271 WeakPolarHBondContact O-CB 3.44Å; A267-Q271 WeakPolarHBondContact O-CG 3.4Å; A267-Q271 PolarHBondContact O-N 3.13Å; A267-Q271 VanDerWaalsContact O-N 3.11Å
268	Y	84.6	Confident	82.8	Confident	64 Å²	64	69.1 Å²	69.1	25%	0.251	35%	0.35	S	S	.	.	H	α-helix	trans	-61.3	-45.4	175.9	175.7	-102.3	0	0	0	112.2	M86 L264 Y265 D266 F270 M272 I273	M86-Y268 PolarHBondContact O-OH 2.99Å; L264-Y268 WeakPolarHBondContact O-CB 3.04Å; L264-Y268 PolarHBondContact O-N 2.87Å; Y265-Y268 PolarHBondContact O-N 2.82Å; D266-Y268 VanDerWaalsContact C-N 3.35Å; D266-Y268 PolarHBondContact O-N 3.29Å; Y268-F270 PolarHBondContact O-N 3.39Å; Y268-M272 HydrophobicContact CD2-CB 3.73Å; Y268-M272 HydrophobicContact CD2-CG 3.91Å; Y268-M272 HydrophobicContact CE2-CB 3.86Å; Y268-M272 HydrophobicContact CE2-CG 4.37Å; Y268-M272 HydrophobicContact CG-CB 4.44Å; Y268-M272 WeakPolarHBondContact O-CA 3.37Å; Y268-M272 VanDerWaalsContact O-CB 3.25Å; Y268-M272 WeakPolarHBondContact O-CB 3.38Å; Y268-M272 PolarHBondContact O-N 3.2Å; Y268-I273 HydrophobicContact CD1-CD1 3.97Å; Y268-I273 HydrophobicContact CD1-CG1 3.99Å; Y268-I273 HydrophobicContact CE1-CD1 3.68Å; Y268-I273 HydrophobicContact CE1-CG1 3.57Å; Y268-I273 PolarHBondContact O-N 2.82Å
269	S	82.1	Confident	82.5	Confident	3 Å²	3	71 Å²	71	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-68	-37.6	-175.1	72	0	0	0	0	112.7	Y265 D266 P274	Y265-S269 VanDerWaalsContact O-CB 3.29Å; Y265-S269 WeakPolarHBondContact O-CB 3.46Å; Y265-S269 PolarHBondContact O-N 3.34Å; Y265-S269 PolarHBondContact O-OG 2.76Å; D266-S269 PolarHBondContact O-N 3.09Å; D266-S269 PolarHBondContact O-OG 3.4Å; D266-S269 VanDerWaalsContact O-OG 3.12Å; S269-P274 WeakPolarHBondContact O-CD 3.26Å
270	F	79.7	Confident	81.8	Confident	81 Å²	81	70.2 Å²	70.2	36%	0.355	35%	0.354	S	S	.	.	H	α-helix	trans	-82.2	-35	-179.8	-82.2	-87	0	0	0	113.7	D266 Y268 V291 R295	D266-F270 VanDerWaalsContact O-CD2 3.32Å; D266-F270 WeakPolarHBondContact O-CD2 3.46Å; D266-F270 PolarHBondContact O-N 2.87Å; Y268-F270 PolarHBondContact O-N 3.39Å; F270-V291 HydrophobicContact CD2-CG1 4.33Å; F270-V291 HydrophobicContact CE1-CG1 4.24Å; F270-V291 HydrophobicContact CE2-CG1 3.71Å; F270-V291 HydrophobicContact CZ-CG1 3.7Å; F270-R295 VanDerWaalsContact CZ-NH1 3.26Å
271	Q	81.3	Confident	81.1	Confident	139 Å²	139	64.8 Å²	64.8	65%	0.65	33%	0.327	S	S	*	.	H	α-helix	trans	-99.5	-29.9	-169.6	-59.3	-179.9	-12.3	0	0	112.6	A267 V275	A267-Q271 VanDerWaalsContact O-CB 3.29Å; A267-Q271 WeakPolarHBondContact O-CB 3.44Å; A267-Q271 WeakPolarHBondContact O-CG 3.4Å; A267-Q271 PolarHBondContact O-N 3.13Å; A267-Q271 VanDerWaalsContact O-N 3.11Å; Q271-V275 WeakPolarHBondContact O-CG2 3.4Å
272	M	80.1	Confident	80.7	Confident	94 Å²	94	64.3 Å²	64.3	46%	0.463	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-45	-173.1	-59.6	-63	-61.8	0	0	112.6	Y268 V275 L276	Y268-M272 HydrophobicContact CD2-CB 3.73Å; Y268-M272 HydrophobicContact CD2-CG 3.91Å; Y268-M272 HydrophobicContact CE2-CB 3.86Å; Y268-M272 HydrophobicContact CE2-CG 4.37Å; Y268-M272 HydrophobicContact CG-CB 4.44Å; Y268-M272 WeakPolarHBondContact O-CA 3.37Å; Y268-M272 VanDerWaalsContact O-CB 3.25Å; Y268-M272 WeakPolarHBondContact O-CB 3.38Å; Y268-M272 PolarHBondContact O-N 3.2Å; M272-V275 PolarHBondContact O-N 3.02Å; M272-L276 HydrophobicContact CB-CD1 4.45Å; M272-L276 WeakPolarHBondContact O-CB 3.19Å; M272-L276 VanDerWaalsContact O-CG 3.28Å; M272-L276 WeakPolarHBondContact O-CG 3.31Å; M272-L276 PolarHBondContact O-N 3.34Å
273	I	80.2	Confident	80.2	Confident	10 Å²	10	64.8 Å²	64.8	5%	0.051	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-50.5	-172.1	-68.5	-178.7	0	0	0	112.6	M86 Y268 V275 L276 G277 Y287 V291	M86-I273 HydrophobicContact CG-CG2 4.05Å; M86-I273 HydrophobicContact SD-CG2 4.14Å; Y268-I273 HydrophobicContact CD1-CD1 3.97Å; Y268-I273 HydrophobicContact CD1-CG1 3.99Å; Y268-I273 HydrophobicContact CE1-CD1 3.68Å; Y268-I273 HydrophobicContact CE1-CG1 3.57Å; Y268-I273 PolarHBondContact O-N 2.82Å; I273-V275 PolarHBondContact O-N 3.22Å; I273-L276 PolarHBondContact O-N 3.28Å; I273-G277 PolarHBondContact O-N 2.99Å; I273-Y287 HydrophobicContact CG2-CD1 3.75Å; I273-Y287 WeakPolarHBondContact O-CD1 3.45Å; I273-V291 HydrophobicContact CB-CG2 4.43Å; I273-V291 HydrophobicContact CG2-CG2 4.1Å
274	P	79.3	Confident	79.9	Confident	7 Å²	7	60.5 Å²	60.5	5%	0.045	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-38.9	178.1	-26	36.5	0	0	0	113.1	S269 G277 E278 W284	S269-P274 WeakPolarHBondContact O-CD 3.26Å; P274-G277 WeakPolarHBondContact O-CA 3.42Å; P274-G277 PolarHBondContact O-N 3.14Å; P274-G277 VanDerWaalsContact O-N 3.11Å; P274-E278 PolarHBondContact O-N 3.25Å; P274-W284 HydrophobicContact CB-CD2 3.66Å; P274-W284 HydrophobicContact CB-CE3 3.63Å; P274-W284 HydrophobicContact CB-CH2 3.47Å; P274-W284 VanDerWaalsContact CB-CH2 3.47Å; P274-W284 HydrophobicContact CB-CZ2 3.45Å; P274-W284 VanDerWaalsContact CB-CZ2 3.45Å; P274-W284 HydrophobicContact CB-CZ3 3.56Å; P274-W284 HydrophobicContact CG-CH2 4.47Å; P274-W284 HydrophobicContact CG-CZ2 4.32Å
275	V	79.3	Confident	79.8	Confident	65 Å²	65	62.8 Å²	62.8	39%	0.394	33%	0.326	S	S	.	.	H	α-helix	trans	-63	-44.5	176.9	178.9	0	0	0	0	110.7	Q271 M272 I273 G277 E278 V279 W284	Q271-V275 WeakPolarHBondContact O-CG2 3.4Å; M272-V275 PolarHBondContact O-N 3.02Å; I273-V275 PolarHBondContact O-N 3.22Å; V275-G277 VanDerWaalsContact C-N 3.27Å; V275-G277 PolarHBondContact O-N 3.33Å; V275-E278 PolarHBondContact O-N 3.3Å; V275-V279 HydrophobicContact CG1-CG2 4.44Å; V275-V279 VanDerWaalsContact O-CG2 3.31Å; V275-V279 WeakPolarHBondContact O-CG2 3.36Å; V275-V279 PolarHBondContact O-N 3.29Å; V275-W284 HydrophobicContact CB-CZ3 4.11Å; V275-W284 HydrophobicContact CG2-CH2 3.93Å; V275-W284 HydrophobicContact CG2-CZ3 3.54Å
276	L	76.6	Confident	79.6	Confident	53 Å²	53	61.1 Å²	61.1	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-37.7	174	-73.8	169.2	0	0	0	111.3	M272 I273 V279 I280	M272-L276 HydrophobicContact CB-CD1 4.45Å; M272-L276 WeakPolarHBondContact O-CB 3.19Å; M272-L276 VanDerWaalsContact O-CG 3.28Å; M272-L276 WeakPolarHBondContact O-CG 3.31Å; M272-L276 PolarHBondContact O-N 3.34Å; I273-L276 PolarHBondContact O-N 3.28Å; L276-V279 PolarHBondContact O-N 2.93Å; L276-I280 HydrophobicContact CB-CD1 4.31Å; L276-I280 HydrophobicContact CD2-CD1 4.32Å; L276-I280 VanDerWaalsContact O-CB 3.23Å; L276-I280 WeakPolarHBondContact O-CB 3.31Å; L276-I280 VanDerWaalsContact O-CG1 3.24Å; L276-I280 WeakPolarHBondContact O-CG1 3.35Å; L276-I280 PolarHBondContact O-N 2.94Å
277	G	73.3	Confident	79.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-43.4	174.4	0	0	0	0	0	113.5	I273 P274 V275 A281 G282 D283 Y287	I273-G277 PolarHBondContact O-N 2.99Å; P274-G277 WeakPolarHBondContact O-CA 3.42Å; P274-G277 PolarHBondContact O-N 3.14Å; P274-G277 VanDerWaalsContact O-N 3.11Å; V275-G277 VanDerWaalsContact C-N 3.27Å; V275-G277 PolarHBondContact O-N 3.33Å; G277-A281 CarbonylContact O-C 3.27Å; G277-A281 WeakPolarHBondContact O-CA 3.23Å; G277-A281 WeakPolarHBondContact O-CB 3.31Å; G277-A281 PolarHBondContact O-N 3.37Å; G277-G282 PolarHBondContact O-N 3.14Å; G277-G282 VanDerWaalsContact O-N 3.09Å; G277-D283 PolarHBondContact O-N 3.02Å; G277-Y287 VanDerWaalsContact CA-CE2 3.41Å
278	E	81.2	Confident	79.5	Confident	101 Å²	101	60.3 Å²	60.3	47%	0.472	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-45.6	175	-172.2	63.9	-168.9	0	0	111.8	P274 V275 G282 W284	P274-E278 PolarHBondContact O-N 3.25Å; V275-E278 PolarHBondContact O-N 3.3Å; E278-G282 WeakPolarHBondContact O-CA 3.17Å; E278-G282 PolarHBondContact O-N 3.39Å; E278-W284 HydrophobicContact CB-CB 4.33Å; E278-W284 HydrophobicContact CB-CE3 4.09Å; E278-W284 WeakPolarHBondContact OE2-CB 3.42Å; E278-W284 PolarHBondContact OE2-N 2.83Å; E278-W284 VanDerWaalsContact OE2-N 3.1Å
279	V	79.2	Confident	79.6	Confident	117 Å²	117	57.8 Å²	57.8	71%	0.709	30%	0.297	S	S	*	.	H	α-helix	trans	-69.2	-38.3	-177.3	173.6	0	0	0	0	112.4	V275 L276	V275-V279 HydrophobicContact CG1-CG2 4.44Å; V275-V279 VanDerWaalsContact O-CG2 3.31Å; V275-V279 WeakPolarHBondContact O-CG2 3.36Å; V275-V279 PolarHBondContact O-N 3.29Å; L276-V279 PolarHBondContact O-N 2.93Å
280	I	73.6	Confident	79.7	Confident	80 Å²	80	58.3 Å²	58.3	41%	0.41	30%	0.299	S	S	.	.	H	α-helix	trans	-90.7	-45.6	-174.3	-62.9	170.7	0	0	0	111.4	V81 A85 L276	V81-I280 HydrophobicContact CG1-CG2 3.76Å; A85-I280 HydrophobicContact CB-CD1 3.62Å; L276-I280 HydrophobicContact CB-CD1 4.31Å; L276-I280 HydrophobicContact CD2-CD1 4.32Å; L276-I280 VanDerWaalsContact O-CB 3.23Å; L276-I280 WeakPolarHBondContact O-CB 3.31Å; L276-I280 VanDerWaalsContact O-CG1 3.24Å; L276-I280 WeakPolarHBondContact O-CG1 3.35Å; L276-I280 PolarHBondContact O-N 2.94Å
281	A	70.5	Confident	80	Confident	9 Å²	9	54.8 Å²	54.8	7%	0.074	29%	0.285	C	S	.	.	H	α-helix	trans	-110.3	-13	-170.3	0	0	0	0	0	113.3	K78 G277 D283 Y287	K78-A281 HydrophobicContact CD-CB 3.99Å; K78-A281 PolarHBondContact NZ-O 2.96Å; G277-A281 CarbonylContact O-C 3.27Å; G277-A281 WeakPolarHBondContact O-CA 3.23Å; G277-A281 WeakPolarHBondContact O-CB 3.31Å; G277-A281 PolarHBondContact O-N 3.37Å; A281-D283 HydrophobicContact CB-CB 4.35Å; A281-D283 PolarHBondContact O-N 3.18Å; A281-Y287 HydrophobicContact CB-CE2 4.04Å
282	G	78.3	Confident	80.3	Confident	54 Å²	54	49.2 Å²	49.2	56%	0.557	26%	0.259	S	S	*	.	S	Bend	trans	62.5	31.1	-171.3	0	0	0	0	0	112.1	G277 E278	G277-G282 PolarHBondContact O-N 3.14Å; G277-G282 VanDerWaalsContact O-N 3.09Å; E278-G282 WeakPolarHBondContact O-CA 3.17Å; E278-G282 PolarHBondContact O-N 3.39Å
283	D	76.9	Confident	80.7	Confident	32 Å²	32	45.1 Å²	45.1	17%	0.171	24%	0.239	C	C	.	.			trans	-138.8	66.1	-172.5	-166.7	-4.6	0	0	0	112.2	V75 G277 A281 K285 S286 Y287	V75-D283 WeakPolarHBondContact CG1-OD2 3.33Å; G277-D283 PolarHBondContact O-N 3.02Å; A281-D283 HydrophobicContact CB-CB 4.35Å; A281-D283 PolarHBondContact O-N 3.18Å; D283-K285 VanDerWaalsContact C-N 3.28Å; D283-K285 PolarHBondContact O-N 3.39Å; D283-S286 VanDerWaalsContact CG-CB 3.48Å; D283-S286 WeakPolarHBondContact OD1-CB 3.42Å; D283-S286 PolarHBondContact OD1-N 2.74Å; D283-S286 PolarHBondContact OD1-OG 2.88Å; D283-S286 VanDerWaalsContact OD2-CB 3.27Å; D283-S286 WeakPolarHBondContact OD2-CB 3.47Å; D283-S286 PolarHBondContact OD2-OG 2.77Å; D283-Y287 WeakPolarHBondContact O-CD2 3.18Å
284	W	81.6	Confident	81.1	Confident	95 Å²	95	45.4 Å²	45.4	36%	0.36	24%	0.241	S	C	.	.	H	α-helix	trans	-51.7	-43.8	175.4	178.6	-83.7	0	0	0	113.9	P274 V275 E278 S286 Y287 Q288	P274-W284 HydrophobicContact CB-CD2 3.66Å; P274-W284 HydrophobicContact CB-CE3 3.63Å; P274-W284 HydrophobicContact CB-CH2 3.47Å; P274-W284 VanDerWaalsContact CB-CH2 3.47Å; P274-W284 HydrophobicContact CB-CZ2 3.45Å; P274-W284 VanDerWaalsContact CB-CZ2 3.45Å; P274-W284 HydrophobicContact CB-CZ3 3.56Å; P274-W284 HydrophobicContact CG-CH2 4.47Å; P274-W284 HydrophobicContact CG-CZ2 4.32Å; V275-W284 HydrophobicContact CB-CZ3 4.11Å; V275-W284 HydrophobicContact CG2-CH2 3.93Å; V275-W284 HydrophobicContact CG2-CZ3 3.54Å; E278-W284 HydrophobicContact CB-CB 4.33Å; E278-W284 HydrophobicContact CB-CE3 4.09Å; E278-W284 WeakPolarHBondContact OE2-CB 3.42Å; E278-W284 PolarHBondContact OE2-N 2.83Å; E278-W284 VanDerWaalsContact OE2-N 3.1Å; W284-S286 PolarHBondContact O-N 2.71Å; W284-Y287 PolarHBondContact O-N 2.76Å; W284-Q288 PolarHBondContact O-N 2.93Å
285	K	82.3	Confident	81.5	Confident	171 Å²	171	50.5 Å²	50.5	74%	0.743	26%	0.259	S	S	*	.	H	α-helix	trans	-65.2	-41.7	-170.5	-71.3	-175.6	178.4	-178.5	0	112.1	D283 Y287 Q288 Y289	D283-K285 VanDerWaalsContact C-N 3.28Å; D283-K285 PolarHBondContact O-N 3.39Å; K285-Y287 VanDerWaalsContact C-N 3.3Å; K285-Y287 PolarHBondContact O-N 2.75Å; K285-Q288 PolarHBondContact O-N 3.27Å; K285-Y289 PolarHBondContact O-N 2.81Å
286	S	81.9	Confident	82	Confident	7 Å²	7	52.3 Å²	52.3	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-38	177	-63.6	0	0	0	0	112.2	D283 W284 L290	D283-S286 VanDerWaalsContact CG-CB 3.48Å; D283-S286 WeakPolarHBondContact OD1-CB 3.42Å; D283-S286 PolarHBondContact OD1-N 2.74Å; D283-S286 PolarHBondContact OD1-OG 2.88Å; D283-S286 VanDerWaalsContact OD2-CB 3.27Å; D283-S286 WeakPolarHBondContact OD2-CB 3.47Å; D283-S286 PolarHBondContact OD2-OG 2.77Å; W284-S286 PolarHBondContact O-N 2.71Å; S286-L290 PolarHBondContact O-N 3.39Å
287	Y	81.8	Confident	82.9	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-74.4	-35.2	178.1	-77.3	-111.7	0	0	0	112.4	M82 M86 I273 G277 A281 D283 W284 K285 L290 V291	M82-Y287 VanDerWaalsContact CA-OH 3.25Å; M82-Y287 WeakPolarHBondContact CA-OH 3.39Å; M82-Y287 HydrophobicContact CB-CE1 4.47Å; M82-Y287 HydrophobicContact CB-CE2 4.37Å; M82-Y287 WeakPolarHBondContact CB-OH 3.34Å; M82-Y287 HydrophobicContact CG-CE1 3.71Å; M82-Y287 HydrophobicContact CG-CE2 3.86Å; M82-Y287 VanDerWaalsContact CG-OH 3.31Å; M82-Y287 WeakPolarHBondContact CG-OH 3.43Å; M82-Y287 HydrophobicContact SD-CD2 4.1Å; M82-Y287 HydrophobicContact SD-CE1 4.34Å; M82-Y287 HydrophobicContact SD-CE2 3.66Å; M86-Y287 HydrophobicContact CG-CD1 3.91Å; M86-Y287 HydrophobicContact CG-CE1 3.54Å; M86-Y287 HydrophobicContact SD-CD1 3.49Å; M86-Y287 WeakPolarHBondContact SD-CD1 3.34Å; M86-Y287 HydrophobicContact SD-CE1 3.45Å; M86-Y287 WeakPolarHBondContact SD-CE1 3.42Å; M86-Y287 HydrophobicContact SD-CG 4.45Å; I273-Y287 HydrophobicContact CG2-CD1 3.75Å; I273-Y287 WeakPolarHBondContact O-CD1 3.45Å; G277-Y287 VanDerWaalsContact CA-CE2 3.41Å; A281-Y287 HydrophobicContact CB-CE2 4.04Å; D283-Y287 WeakPolarHBondContact O-CD2 3.18Å; W284-Y287 PolarHBondContact O-N 2.76Å; K285-Y287 VanDerWaalsContact C-N 3.3Å; K285-Y287 PolarHBondContact O-N 2.75Å; Y287-L290 WeakPolarHBondContact O-CB 3.43Å; Y287-L290 PolarHBondContact O-N 2.83Å; Y287-V291 WeakPolarHBondContact O-CG2 3.47Å; Y287-V291 PolarHBondContact O-N 3.37Å
288	Q	85.5	Confident	83.9	Confident	83 Å²	83	51.5 Å²	51.5	39%	0.388	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-50.5	171.5	-178.2	178.7	-28.1	0	0	110.6	W284 K285 L290 V291 E292	W284-Q288 PolarHBondContact O-N 2.93Å; K285-Q288 PolarHBondContact O-N 3.27Å; Q288-L290 PolarHBondContact O-N 3.01Å; Q288-V291 PolarHBondContact O-N 3.32Å; Q288-V291 VanDerWaalsContact O-N 3.09Å; Q288-E292 HydrophobicContact CG-CG 4.47Å; Q288-E292 VanDerWaalsContact CG-OE1 3.3Å; Q288-E292 WeakPolarHBondContact CG-OE1 3.35Å; Q288-E292 PolarHBondContact NE2-OE1 3.43Å; Q288-E292 WeakPolarHBondContact O-CG 3.29Å; Q288-E292 PolarHBondContact O-N 2.84Å
289	Y	86.4	Confident	84.7	Confident	12 Å²	12	48.7 Å²	48.7	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-55	-41.3	175.8	168.5	-102.7	0	0	0	111.8	F54 V68 V71 N227 K285 V291 E292 S293	F54-Y289 HydrophobicContact CD1-CD2 4.1Å; F54-Y289 AromaticContact CD2-CD2 3.84Å; F54-Y289 HydrophobicContact CD2-CD2 3.84Å; F54-Y289 AromaticContact CD2-CE2 3.53Å; F54-Y289 HydrophobicContact CD2-CE2 3.53Å; F54-Y289 AromaticContact CE1-CD2 3.74Å; F54-Y289 HydrophobicContact CE1-CD2 3.74Å; F54-Y289 HydrophobicContact CE1-CE2 4.43Å; F54-Y289 HydrophobicContact CE1-CG 4.37Å; F54-Y289 AromaticContact CE2-CD2 3.45Å; F54-Y289 HydrophobicContact CE2-CD2 3.45Å; F54-Y289 VanDerWaalsContact CE2-CD2 3.45Å; F54-Y289 AromaticContact CE2-CE2 3.43Å; F54-Y289 HydrophobicContact CE2-CE2 3.43Å; F54-Y289 VanDerWaalsContact CE2-CE2 3.43Å; F54-Y289 HydrophobicContact CE2-CG 4.09Å; F54-Y289 HydrophobicContact CG-CD2 4.15Å; F54-Y289 HydrophobicContact CG-CE2 4.08Å; F54-Y289 AromaticContact CZ-CD2 3.4Å; F54-Y289 HydrophobicContact CZ-CD2 3.4Å; F54-Y289 VanDerWaalsContact CZ-CD2 3.4Å; F54-Y289 AromaticContact CZ-CE2 3.92Å; F54-Y289 HydrophobicContact CZ-CE2 3.92Å; F54-Y289 AromaticContact CZ-CG 3.81Å; F54-Y289 HydrophobicContact CZ-CG 3.81Å; V68-Y289 HydrophobicContact CG2-CE2 4.43Å; V68-Y289 WeakPolarHBondContact CG2-OH 3.45Å; V71-Y289 HydrophobicContact CG1-CD1 4.29Å; N227-Y289 VanDerWaalsContact OD1-CE1 3.31Å; N227-Y289 WeakPolarHBondContact OD1-CE1 3.49Å; N227-Y289 PolarHBondContact OD1-OH 3.03Å; K285-Y289 PolarHBondContact O-N 2.81Å; Y289-V291 PolarHBondContact O-N 3Å; Y289-E292 PolarHBondContact O-N 3.34Å; Y289-S293 WeakPolarHBondContact O-CB 3.32Å; Y289-S293 PolarHBondContact O-N 3.45Å; Y289-S293 PolarHBondContact O-OG 3.11Å
290	L	85.1	Confident	85.5	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.068	22%	0.216	C	C	.	.	H	α-helix	trans	-55.5	-52.8	175.3	175.8	71.2	0	0	0	111.8	M86 R226 S286 Y287 Q288 E292 S293 I294	M86-L290 HydrophobicContact CE-CD2 3.3Å; M86-L290 HydrophobicContact SD-CD2 3.04Å; M86-L290 WeakPolarHBondContact SD-CD2 3.47Å; R226-L290 VanDerWaalsContact NH2-CD1 3.3Å; S286-L290 PolarHBondContact O-N 3.39Å; Y287-L290 WeakPolarHBondContact O-CB 3.43Å; Y287-L290 PolarHBondContact O-N 2.83Å; Q288-L290 PolarHBondContact O-N 3.01Å; L290-E292 VanDerWaalsContact C-N 3.28Å; L290-E292 PolarHBondContact O-N 2.91Å; L290-S293 PolarHBondContact O-N 3.21Å; L290-S293 PolarHBondContact O-OG 2.88Å; L290-I294 HydrophobicContact CD1-CD1 4.11Å; L290-I294 HydrophobicContact CD1-CG1 4.45Å; L290-I294 HydrophobicContact CG-CD1 3.99Å; L290-I294 VanDerWaalsContact O-CG1 3.3Å; L290-I294 WeakPolarHBondContact O-CG1 3.44Å; L290-I294 PolarHBondContact O-N 3.15Å; L290-I294 VanDerWaalsContact O-N 3.08Å
291	V	85.8	Confident	86.7	Confident	8 Å²	8	44.1 Å²	44.1	5%	0.048	22%	0.216	C	C	.	.	H	α-helix	trans	-61.1	-40.7	-178.6	175.7	0	0	0	0	111	F270 I273 Y287 Q288 Y289 R295	F270-V291 HydrophobicContact CD2-CG1 4.33Å; F270-V291 HydrophobicContact CE1-CG1 4.24Å; F270-V291 HydrophobicContact CE2-CG1 3.71Å; F270-V291 HydrophobicContact CZ-CG1 3.7Å; I273-V291 HydrophobicContact CB-CG2 4.43Å; I273-V291 HydrophobicContact CG2-CG2 4.1Å; Y287-V291 WeakPolarHBondContact O-CG2 3.47Å; Y287-V291 PolarHBondContact O-N 3.37Å; Q288-V291 PolarHBondContact O-N 3.32Å; Q288-V291 VanDerWaalsContact O-N 3.09Å; Y289-V291 PolarHBondContact O-N 3Å; V291-R295 PolarHBondContact O-N 3.07Å
292	E	87.6	Confident	88	Confident	22 Å²	22	47 Å²	47	10%	0.103	23%	0.233	C	C	.	.	H	α-helix	trans	-66.9	-42.6	178.5	-64.2	179	-172	0	0	112.1	G55 F56 Q288 Y289 L290 I294 R295 K296	G55-E292 VanDerWaalsContact CA-CB 3.42Å; G55-E292 WeakPolarHBondContact CA-OE2 3.48Å; F56-E292 HydrophobicContact CD1-CB 4.17Å; F56-E292 HydrophobicContact CD1-CG 4.22Å; F56-E292 HydrophobicContact CD2-CG 3.79Å; F56-E292 HydrophobicContact CE1-CB 4.13Å; F56-E292 HydrophobicContact CE1-CG 4.19Å; F56-E292 HydrophobicContact CE2-CG 3.76Å; F56-E292 HydrophobicContact CG-CB 4.41Å; F56-E292 HydrophobicContact CG-CG 4.03Å; F56-E292 HydrophobicContact CZ-CB 4.33Å; F56-E292 HydrophobicContact CZ-CG 3.96Å; F56-E292 PolarHBondContact N-OE2 3.22Å; Q288-E292 HydrophobicContact CG-CG 4.47Å; Q288-E292 VanDerWaalsContact CG-OE1 3.3Å; Q288-E292 WeakPolarHBondContact CG-OE1 3.35Å; Q288-E292 PolarHBondContact NE2-OE1 3.43Å; Q288-E292 WeakPolarHBondContact O-CG 3.29Å; Q288-E292 PolarHBondContact O-N 2.84Å; Y289-E292 PolarHBondContact O-N 3.34Å; L290-E292 VanDerWaalsContact C-N 3.28Å; L290-E292 PolarHBondContact O-N 2.91Å; E292-I294 VanDerWaalsContact C-N 3.34Å; E292-I294 PolarHBondContact O-N 3.1Å; E292-R295 PolarHBondContact O-N 3.01Å; E292-K296 PolarHBondContact O-N 2.64Å; E292-K296 VanDerWaalsContact O-N 3.14Å
293	S	89	Confident	89	Confident	8 Å²	8	44.4 Å²	44.4	6%	0.056	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-40.8	177.3	73.1	0	0	0	0	112.2	R226 Y289 L290 R295 K296 F297	R226-S293 PolarHBondContact NE-OG 3.31Å; Y289-S293 WeakPolarHBondContact O-CB 3.32Å; Y289-S293 PolarHBondContact O-N 3.45Å; Y289-S293 PolarHBondContact O-OG 3.11Å; L290-S293 PolarHBondContact O-N 3.21Å; L290-S293 PolarHBondContact O-OG 2.88Å; S293-R295 VanDerWaalsContact C-N 3.27Å; S293-R295 PolarHBondContact O-N 3.49Å; S293-K296 PolarHBondContact O-N 3.46Å; S293-F297 PolarHBondContact O-N 3.14Å
294	I	88.5	Confident	90	Very high	16 Å²	16	44.8 Å²	44.8	8%	0.082	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-39.3	177.1	-69	168.3	0	0	0	110.7	F253 L290 E292 F297	F253-I294 HydrophobicContact CB-CB 4.35Å; F253-I294 HydrophobicContact CB-CD1 4.16Å; F253-I294 HydrophobicContact CB-CG1 3.78Å; F253-I294 HydrophobicContact CB-CG2 3.82Å; F253-I294 HydrophobicContact CD1-CD1 4.09Å; F253-I294 HydrophobicContact CD2-CD1 3.72Å; F253-I294 HydrophobicContact CD2-CG1 3.87Å; F253-I294 HydrophobicContact CE1-CD1 4.44Å; F253-I294 HydrophobicContact CE2-CD1 4.09Å; F253-I294 HydrophobicContact CG-CD1 3.72Å; F253-I294 HydrophobicContact CG-CG1 3.86Å; F253-I294 HydrophobicContact CG-CG2 4.46Å; F253-I294 HydrophobicContact CZ-CD1 4.43Å; L290-I294 HydrophobicContact CD1-CD1 4.11Å; L290-I294 HydrophobicContact CD1-CG1 4.45Å; L290-I294 HydrophobicContact CG-CD1 3.99Å; L290-I294 VanDerWaalsContact O-CG1 3.3Å; L290-I294 WeakPolarHBondContact O-CG1 3.44Å; L290-I294 PolarHBondContact O-N 3.15Å; L290-I294 VanDerWaalsContact O-N 3.08Å; E292-I294 VanDerWaalsContact C-N 3.34Å; E292-I294 PolarHBondContact O-N 3.1Å; I294-F297 PolarHBondContact O-N 3.4Å
295	R	87.2	Confident	90.8	Very high	114 Å²	114	44.6 Å²	44.6	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-73.9	-29.2	-179.6	-76.6	-173.2	159.2	-160.7	-1.6	114	F56 D266 F270 V291 E292 S293	F56-R295 HydrophobicContact CE1-CB 4.37Å; D266-R295 IonicContact OD1-CZ 2.76Å; D266-R295 IonicContact OD1-NE 3.1Å; D266-R295 IonicContact OD1-NH2 3.85Å; D266-R295 PolarHBondContact OD1-NH2 2.78Å; D266-R295 IonicContact OD2-NH2 3.62Å; F270-R295 VanDerWaalsContact CZ-NH1 3.26Å; V291-R295 PolarHBondContact O-N 3.07Å; E292-R295 PolarHBondContact O-N 3.01Å; S293-R295 VanDerWaalsContact C-N 3.27Å; S293-R295 PolarHBondContact O-N 3.49Å
296	K	89.9	Confident	91.6	Very high	103 Å²	103	39 Å²	39	45%	0.448	19%	0.187	S	C	.	.	H	α-helix	trans	-79.4	-22.1	176.2	-72.4	-70.7	-172.3	166	0	112.4	G55 E292 S293	G55-K296 VanDerWaalsContact O-CE 3.32Å; G55-K296 WeakPolarHBondContact O-CE 3.37Å; G55-K296 WeakPolarHBondContact O-CG 3.38Å; E292-K296 PolarHBondContact O-N 2.64Å; E292-K296 VanDerWaalsContact O-N 3.14Å; S293-K296 PolarHBondContact O-N 3.46Å
297	F	94.8	Very high	92.4	Very high	10 Å²	10	38.7 Å²	38.7	4%	0.044	18%	0.184	C	C	.	.	S	Bend	trans	-63	138.6	178.9	-164.6	-104.8	0	0	0	111.5	I225 R226 I231 E252 F253 S293 I294 F303	I225-F297 HydrophobicContact CG2-CE2 3.81Å; I225-F297 HydrophobicContact CG2-CZ 3.86Å; R226-F297 HydrophobicContact CB-CB 4.39Å; R226-F297 HydrophobicContact CB-CD2 3.42Å; R226-F297 VanDerWaalsContact CB-CD2 3.42Å; R226-F297 HydrophobicContact CB-CE2 4Å; R226-F297 HydrophobicContact CB-CG 4.1Å; I231-F297 HydrophobicContact CD1-CD2 4.29Å; I231-F297 HydrophobicContact CD1-CE2 3.98Å; E252-F297 HydrophobicContact CB-CE1 4.19Å; E252-F297 HydrophobicContact CB-CZ 4.27Å; E252-F297 HydrophobicContact CG-CD1 4.09Å; E252-F297 HydrophobicContact CG-CD2 4.41Å; E252-F297 HydrophobicContact CG-CE1 3.73Å; E252-F297 HydrophobicContact CG-CE2 4.09Å; E252-F297 HydrophobicContact CG-CG 4.42Å; E252-F297 HydrophobicContact CG-CZ 3.74Å; F253-F297 VanDerWaalsContact O-CD1 3.28Å; F253-F297 WeakPolarHBondContact O-CD1 3.37Å; S293-F297 PolarHBondContact O-N 3.14Å; I294-F297 PolarHBondContact O-N 3.4Å; F297-F303 HydrophobicContact CE1-CD1 4.1Å; F297-F303 HydrophobicContact CE1-CD2 4.45Å; F297-F303 HydrophobicContact CE1-CE1 4.45Å; F297-F303 HydrophobicContact CE1-CG 4.11Å; F297-F303 HydrophobicContact CE2-CE2 4.41Å; F297-F303 AromaticContact CZ-CD1 3.94Å; F297-F303 HydrophobicContact CZ-CD1 3.94Å; F297-F303 AromaticContact CZ-CD2 3.83Å; F297-F303 HydrophobicContact CZ-CD2 3.83Å; F297-F303 AromaticContact CZ-CE1 3.93Å; F297-F303 HydrophobicContact CZ-CE1 3.93Å; F297-F303 AromaticContact CZ-CE2 3.84Å; F297-F303 HydrophobicContact CZ-CE2 3.84Å; F297-F303 AromaticContact CZ-CG 3.9Å; F297-F303 HydrophobicContact CZ-CG 3.9Å; F297-F303 AromaticContact CZ-CZ 3.9Å; F297-F303 HydrophobicContact CZ-CZ 3.9Å
298	P	96	Very high	93.2	Very high	25 Å²	25	41.7 Å²	41.7	16%	0.162	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-55.4	151.3	175.8	21.1	-33.9	0	0	0	112.5	T302 F303 M306	P298-T302 HydrophobicContact CB-CG2 3.85Å; P298-F303 HydrophobicContact CB-CB 4.09Å; P298-F303 HydrophobicContact CG-CB 3.88Å; P298-F303 HydrophobicContact CG-CD2 3.92Å; P298-F303 HydrophobicContact CG-CG 4.22Å; P298-M306 HydrophobicContact CB-SD 4.33Å; P298-M306 HydrophobicContact CG-SD 3.98Å
299	D	96.5	Very high	93.8	Very high	42 Å²	42	43.4 Å²	43.4	23%	0.225	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-71	173.9	168.8	50.9	55.3	0	0	0	112.1	K255 E301 T302 F303	K255-D299 HydrophobicContact CB-CB 4.32Å; K255-D299 HydrophobicContact CD-CB 3.7Å; K255-D299 HydrophobicContact CG-CB 3.9Å; K255-D299 IonicContact NZ-OD2 3.05Å; K255-D299 PolarHBondContact NZ-OD2 3.01Å; D299-E301 VanDerWaalsContact C-N 3.34Å; D299-E301 PolarHBondContact O-N 3Å; D299-T302 PolarHBondContact O-N 3.13Å; D299-T302 VanDerWaalsContact OD1-CB 3.25Å; D299-T302 WeakPolarHBondContact OD1-CB 3.12Å; D299-T302 PolarHBondContact OD1-N 2.93Å; D299-T302 PolarHBondContact OD1-OG1 3.39Å; D299-F303 VanDerWaalsContact O-CB 3.3Å; D299-F303 WeakPolarHBondContact O-CB 3.44Å; D299-F303 PolarHBondContact O-N 2.93Å
300	Q	97.4	Very high	94.4	Very high	14 Å²	14	43.9 Å²	43.9	7%	0.065	22%	0.217	C	C	.	.	H	α-helix	trans	-56.4	-44.7	-172.6	-63.6	88.7	-27	0	0	113.1	S254 K255 K304 Y317 N319 A326 H328	S254-Q300 WeakPolarHBondContact OG-CG 3.31Å; S254-Q300 PolarHBondContact OG-OE1 3.1Å; K255-Q300 PolarHBondContact O-NE2 3.43Å; Q300-K304 WeakPolarHBondContact O-CB 3.3Å; Q300-K304 PolarHBondContact O-N 3.1Å; Q300-Y317 HydrophobicContact CB-CD1 4.08Å; Q300-Y317 HydrophobicContact CB-CD2 3.72Å; Q300-Y317 HydrophobicContact CB-CE1 3.95Å; Q300-Y317 HydrophobicContact CB-CE2 3.59Å; Q300-Y317 HydrophobicContact CB-CG 3.97Å; Q300-Y317 HydrophobicContact CG-CD2 3.98Å; Q300-Y317 HydrophobicContact CG-CE2 4.06Å; Q300-N319 WeakPolarHBondContact CG-OD1 3.35Å; Q300-N319 PolarHBondContact NE2-OD1 2.89Å; Q300-A326 HydrophobicContact CG-CB 3.92Å; Q300-H328 PolarHBondContact O-NE2 3.47Å
301	E	97.8	Very high	94.9	Very high	88 Å²	88	44.7 Å²	44.7	41%	0.411	23%	0.228	S	C	.	.	H	α-helix	trans	-75.5	-41.8	-177.1	-159.1	64.3	-144	0	0	111	D299 F303 K304 Q305 Y317	D299-E301 VanDerWaalsContact C-N 3.34Å; D299-E301 PolarHBondContact O-N 3Å; E301-F303 PolarHBondContact O-N 3.39Å; E301-K304 WeakPolarHBondContact O-CB 3.31Å; E301-K304 PolarHBondContact O-N 2.86Å; E301-K304 IonicContact OE1-NZ 3.46Å; E301-K304 PolarHBondContact OE1-NZ 2.91Å; E301-Q305 PolarHBondContact O-N 2.81Å; E301-Y317 VanDerWaalsContact OE2-CE1 3.23Å; E301-Y317 WeakPolarHBondContact OE2-CE1 3.24Å; E301-Y317 PolarHBondContact OE2-OH 3.24Å
302	T	98.1	Very high	95.5	Very high	69 Å²	69	44.5 Å²	44.5	42%	0.423	23%	0.227	S	C	.	.	H	α-helix	trans	-60.7	-47.3	175.8	-53.8	0	0	0	0	110.8	P298 D299 K304 Q305 M306	P298-T302 HydrophobicContact CB-CG2 3.85Å; D299-T302 PolarHBondContact O-N 3.13Å; D299-T302 VanDerWaalsContact OD1-CB 3.25Å; D299-T302 WeakPolarHBondContact OD1-CB 3.12Å; D299-T302 PolarHBondContact OD1-N 2.93Å; D299-T302 PolarHBondContact OD1-OG1 3.39Å; T302-K304 VanDerWaalsContact C-N 3.34Å; T302-K304 PolarHBondContact O-N 3.03Å; T302-Q305 WeakPolarHBondContact O-CB 3.27Å; T302-Q305 PolarHBondContact O-N 3.3Å; T302-M306 WeakPolarHBondContact O-CG 3.45Å; T302-M306 PolarHBondContact O-N 3.27Å
303	F	98.4	Very high	96	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.6	-35.7	179.4	-171.9	-126.9	0	0	0	112.1	I225 I231 L235 C250 F297 P298 D299 E301 Q305 M306 I307 H328	I225-F303 HydrophobicContact CD1-CE2 4.32Å; I225-F303 HydrophobicContact CD1-CZ 3.97Å; I225-F303 HydrophobicContact CG2-CZ 4.19Å; I231-F303 HydrophobicContact CG2-CE2 3.84Å; L235-F303 HydrophobicContact CD1-CE2 4.34Å; C250-F303 HydrophobicContact CB-CE1 4.16Å; C250-F303 HydrophobicContact CB-CZ 4.49Å; F297-F303 HydrophobicContact CE1-CD1 4.1Å; F297-F303 HydrophobicContact CE1-CD2 4.45Å; F297-F303 HydrophobicContact CE1-CE1 4.45Å; F297-F303 HydrophobicContact CE1-CG 4.11Å; F297-F303 HydrophobicContact CE2-CE2 4.41Å; F297-F303 AromaticContact CZ-CD1 3.94Å; F297-F303 HydrophobicContact CZ-CD1 3.94Å; F297-F303 AromaticContact CZ-CD2 3.83Å; F297-F303 HydrophobicContact CZ-CD2 3.83Å; F297-F303 AromaticContact CZ-CE1 3.93Å; F297-F303 HydrophobicContact CZ-CE1 3.93Å; F297-F303 AromaticContact CZ-CE2 3.84Å; F297-F303 HydrophobicContact CZ-CE2 3.84Å; F297-F303 AromaticContact CZ-CG 3.9Å; F297-F303 HydrophobicContact CZ-CG 3.9Å; F297-F303 AromaticContact CZ-CZ 3.9Å; F297-F303 HydrophobicContact CZ-CZ 3.9Å; P298-F303 HydrophobicContact CB-CB 4.09Å; P298-F303 HydrophobicContact CG-CB 3.88Å; P298-F303 HydrophobicContact CG-CD2 3.92Å; P298-F303 HydrophobicContact CG-CG 4.22Å; D299-F303 VanDerWaalsContact O-CB 3.3Å; D299-F303 WeakPolarHBondContact O-CB 3.44Å; D299-F303 PolarHBondContact O-N 2.93Å; E301-F303 PolarHBondContact O-N 3.39Å; F303-Q305 VanDerWaalsContact C-N 3.34Å; F303-M306 HydrophobicContact CD2-SD 4.26Å; F303-M306 PolarHBondContact O-N 3.48Å; F303-I307 HydrophobicContact CD1-CD1 3.86Å; F303-I307 HydrophobicContact CE1-CD1 3.67Å; F303-I307 HydrophobicContact CE1-CG1 4.4Å; F303-I307 HydrophobicContact CE2-CG1 4.41Å; F303-I307 HydrophobicContact CG-CD1 4.37Å; F303-I307 HydrophobicContact CZ-CD1 4.01Å; F303-I307 HydrophobicContact CZ-CG1 4.25Å; F303-I307 WeakPolarHBondContact O-CD1 3.36Å; F303-I307 VanDerWaalsContact O-CG1 3.25Å; F303-I307 WeakPolarHBondContact O-CG1 3.07Å; F303-I307 PolarHBondContact O-N 3.5Å; F303-H328 HydrophobicContact CD1-CB 4.45Å; F303-H328 AromaticContact CD1-CD2 3.7Å; F303-H328 AromaticContact CD1-CE1 3.81Å; F303-H328 AromaticContact CD1-CG 3.78Å; F303-H328 AromaticContact CD1-ND1 3.88Å; F303-H328 AromaticContact CD1-NE2 3.73Å; F303-H328 HydrophobicContact CE1-CB 4.34Å
304	K	98.6	Very high	96.5	Very high	40 Å²	40	52.1 Å²	52.1	17%	0.174	27%	0.269	C	S	.	.	H	α-helix	trans	-58.8	-46.7	171.1	171.1	-177.3	158.6	-131.8	0	111	Q300 E301 T302 M306 I307 E308 V315 Y317	Q300-K304 WeakPolarHBondContact O-CB 3.3Å; Q300-K304 PolarHBondContact O-N 3.1Å; E301-K304 WeakPolarHBondContact O-CB 3.31Å; E301-K304 PolarHBondContact O-N 2.86Å; E301-K304 IonicContact OE1-NZ 3.46Å; E301-K304 PolarHBondContact OE1-NZ 2.91Å; T302-K304 VanDerWaalsContact C-N 3.34Å; T302-K304 PolarHBondContact O-N 3.03Å; K304-M306 VanDerWaalsContact C-N 3.32Å; K304-M306 PolarHBondContact O-N 3.2Å; K304-I307 WeakPolarHBondContact O-CB 3.29Å; K304-I307 PolarHBondContact O-N 2.98Å; K304-I307 VanDerWaalsContact O-N 3.15Å; K304-E308 WeakPolarHBondContact CE-OE1 3.37Å; K304-E308 IonicContact NZ-OE1 2.87Å; K304-E308 WeakPolarHBondContact O-CG 3.13Å; K304-E308 PolarHBondContact O-N 3.36Å; K304-V315 HydrophobicContact CB-CG1 4.42Å; K304-V315 WeakPolarHBondContact CE-O 3.37Å; K304-V315 HydrophobicContact CG-CB 4.09Å; K304-V315 HydrophobicContact CG-CG1 3.78Å; K304-Y317 HydrophobicContact CB-CD1 4.12Å; K304-Y317 HydrophobicContact CB-CE1 4.44Å; K304-Y317 HydrophobicContact CD-CD1 3.94Å; K304-Y317 HydrophobicContact CD-CE1 3.96Å
305	Q	98.6	Very high	96.9	Very high	90 Å²	90	51.7 Å²	51.7	42%	0.421	27%	0.267	S	S	.	.	H	α-helix	trans	-60.6	-42.9	178.1	-171.5	62.6	59.4	0	0	111.2	E301 T302 F303 I307 E308 D309	E301-Q305 PolarHBondContact O-N 2.81Å; T302-Q305 WeakPolarHBondContact O-CB 3.27Å; T302-Q305 PolarHBondContact O-N 3.3Å; F303-Q305 VanDerWaalsContact C-N 3.34Å; Q305-I307 VanDerWaalsContact C-N 3.28Å; Q305-I307 PolarHBondContact O-N 2.91Å; Q305-E308 WeakPolarHBondContact O-CB 3.32Å; Q305-E308 PolarHBondContact O-N 2.95Å; Q305-E308 VanDerWaalsContact O-N 3.09Å; Q305-D309 PolarHBondContact NE2-OD1 3.12Å; Q305-D309 WeakPolarHBondContact O-CB 3.46Å; Q305-D309 PolarHBondContact O-N 3.21Å
306	M	98.6	Very high	97.4	Very high	55 Å²	55	54.2 Å²	54.2	27%	0.271	28%	0.277	S	S	.	.	H	α-helix	trans	-58.3	-39.6	175.4	-65.8	172.6	70.2	0	0	112.6	I231 L235 P298 T302 F303 K304 D309 A310	I231-M306 HydrophobicContact CB-CE 3.96Å; I231-M306 HydrophobicContact CG2-CE 3.7Å; L235-M306 HydrophobicContact CD1-CB 4.01Å; P298-M306 HydrophobicContact CB-SD 4.33Å; P298-M306 HydrophobicContact CG-SD 3.98Å; T302-M306 WeakPolarHBondContact O-CG 3.45Å; T302-M306 PolarHBondContact O-N 3.27Å; F303-M306 HydrophobicContact CD2-SD 4.26Å; F303-M306 PolarHBondContact O-N 3.48Å; K304-M306 VanDerWaalsContact C-N 3.32Å; K304-M306 PolarHBondContact O-N 3.2Å; M306-D309 PolarHBondContact O-N 3.37Å; M306-A310 PolarHBondContact O-N 3.27Å; M306-A310 VanDerWaalsContact O-N 3.09Å
307	I	98.7	Very high	97.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.4	-40.7	176.2	-65.5	162.5	0	0	0	110.7	L235 F248 F303 K304 Q305 A310 L312 V315 H328	L235-I307 HydrophobicContact CD1-CG1 4.16Å; L235-I307 HydrophobicContact CD2-CG1 3.9Å; F248-I307 HydrophobicContact CD1-CG2 4.18Å; F248-I307 HydrophobicContact CE1-CD1 3.84Å; F248-I307 HydrophobicContact CE1-CG1 4.07Å; F248-I307 HydrophobicContact CE1-CG2 4.3Å; F303-I307 HydrophobicContact CD1-CD1 3.86Å; F303-I307 HydrophobicContact CE1-CD1 3.67Å; F303-I307 HydrophobicContact CE1-CG1 4.4Å; F303-I307 HydrophobicContact CE2-CG1 4.41Å; F303-I307 HydrophobicContact CG-CD1 4.37Å; F303-I307 HydrophobicContact CZ-CD1 4.01Å; F303-I307 HydrophobicContact CZ-CG1 4.25Å; F303-I307 WeakPolarHBondContact O-CD1 3.36Å; F303-I307 VanDerWaalsContact O-CG1 3.25Å; F303-I307 WeakPolarHBondContact O-CG1 3.07Å; F303-I307 PolarHBondContact O-N 3.5Å; K304-I307 WeakPolarHBondContact O-CB 3.29Å; K304-I307 PolarHBondContact O-N 2.98Å; K304-I307 VanDerWaalsContact O-N 3.15Å; Q305-I307 VanDerWaalsContact C-N 3.28Å; Q305-I307 PolarHBondContact O-N 2.91Å; I307-A310 PolarHBondContact O-N 3.37Å; I307-L312 HydrophobicContact CG2-CB 3.8Å; I307-L312 HydrophobicContact CG2-CD1 3.52Å; I307-L312 HydrophobicContact CG2-CG 4.27Å; I307-L312 WeakPolarHBondContact O-CB 3.32Å; I307-L312 PolarHBondContact O-N 2.79Å; I307-V315 HydrophobicContact CB-CG1 3.98Å; I307-V315 HydrophobicContact CB-CG2 4.36Å; I307-V315 HydrophobicContact CD1-CG1 4.23Å; I307-V315 HydrophobicContact CG2-CB 4.33Å; I307-V315 HydrophobicContact CG2-CG1 3.66Å; I307-V315 HydrophobicContact CG2-CG2 3.63Å; I307-H328 HydrophobicContact CD1-CB 3.7Å
308	E	98.6	Very high	97.9	Very high	63 Å²	63	56.7 Å²	56.7	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-65.4	-43.7	176	-69.6	175.9	159.6	0	0	111.5	K304 Q305 A310 G311 L312 V315	K304-E308 WeakPolarHBondContact CE-OE1 3.37Å; K304-E308 IonicContact NZ-OE1 2.87Å; K304-E308 WeakPolarHBondContact O-CG 3.13Å; K304-E308 PolarHBondContact O-N 3.36Å; Q305-E308 WeakPolarHBondContact O-CB 3.32Å; Q305-E308 PolarHBondContact O-N 2.95Å; Q305-E308 VanDerWaalsContact O-N 3.09Å; E308-A310 VanDerWaalsContact C-N 3.26Å; E308-A310 PolarHBondContact O-N 3.08Å; E308-G311 PolarHBondContact O-N 3.38Å; E308-L312 WeakPolarHBondContact CA-O 3.46Å; E308-V315 HydrophobicContact CB-CG2 4.46Å; E308-V315 HydrophobicContact CG-CB 3.66Å; E308-V315 HydrophobicContact CG-CG2 3.41Å; E308-V315 VanDerWaalsContact CG-CG2 3.41Å
309	D	98.4	Very high	97.9	Very high	120 Å²	120	58.6 Å²	58.6	64%	0.642	30%	0.296	S	S	*	.	H	α-helix	trans	-64.3	-30.8	179	-65.8	-16.5	0	0	0	112.2	Q305 M306 G311	Q305-D309 PolarHBondContact NE2-OD1 3.12Å; Q305-D309 WeakPolarHBondContact O-CB 3.46Å; Q305-D309 PolarHBondContact O-N 3.21Å; M306-D309 PolarHBondContact O-N 3.37Å; D309-G311 PolarHBondContact O-N 3.44Å
310	A	98.1	Very high	97.8	Very high	22 Å²	22	57.7 Å²	57.7	18%	0.182	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.5	173	0	0	0	0	0	113.4	L235 V239 M306 I307 E308	L235-A310 HydrophobicContact CB-CB 3.65Å; V239-A310 HydrophobicContact CG2-CB 4.38Å; V239-A310 WeakPolarHBondContact CG2-O 3.45Å; M306-A310 PolarHBondContact O-N 3.27Å; M306-A310 VanDerWaalsContact O-N 3.09Å; I307-A310 PolarHBondContact O-N 3.37Å; E308-A310 VanDerWaalsContact C-N 3.26Å; E308-A310 PolarHBondContact O-N 3.08Å
311	G	97.6	Very high	97.5	Very high	30 Å²	30	60.7 Å²	60.7	31%	0.309	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	106	13.3	177.2	0	0	0	0	0	115	E308 D309 F313	E308-G311 PolarHBondContact O-N 3.38Å; D309-G311 PolarHBondContact O-N 3.44Å; G311-F313 VanDerWaalsContact O-CD2 3.3Å; G311-F313 WeakPolarHBondContact O-CD2 3.47Å; G311-F313 VanDerWaalsContact O-CE2 3.28Å; G311-F313 WeakPolarHBondContact O-CE2 3.29Å
312	L	98.3	Very high	97.1	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.016	31%	0.308	C	S	.	.			trans	-86.5	141.7	170.2	-70.3	163.7	0	0	0	110.7	V239 L242 F248 I307 E308 V315 F331 K332	V239-L312 HydrophobicContact CG2-CD1 4.2Å; V239-L312 HydrophobicContact CG2-CD2 4.14Å; V239-L312 HydrophobicContact CG2-CG 3.71Å; L242-L312 HydrophobicContact CD1-CD2 4.24Å; F248-L312 HydrophobicContact CB-CD1 3.47Å; F248-L312 VanDerWaalsContact CB-CD1 3.47Å; F248-L312 HydrophobicContact CB-CD2 4.05Å; F248-L312 HydrophobicContact CB-CG 4.41Å; F248-L312 HydrophobicContact CD1-CD1 3.82Å; F248-L312 HydrophobicContact CD2-CD1 4.16Å; F248-L312 HydrophobicContact CG-CD1 3.56Å; I307-L312 HydrophobicContact CG2-CB 3.8Å; I307-L312 HydrophobicContact CG2-CD1 3.52Å; I307-L312 HydrophobicContact CG2-CG 4.27Å; I307-L312 WeakPolarHBondContact O-CB 3.32Å; I307-L312 PolarHBondContact O-N 2.79Å; E308-L312 WeakPolarHBondContact CA-O 3.46Å; L312-V315 HydrophobicContact CB-CG2 4.1Å; L312-V315 WeakPolarHBondContact O-CG2 3.32Å; L312-F331 VanDerWaalsContact CD2-C 3.46Å; L312-K332 HydrophobicContact CD2-CB 4.31Å
313	F	97.9	Very high	96.8	Very high	104 Å²	104	54.8 Å²	54.8	46%	0.456	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	161.1	-175.5	-68.3	-97.7	0	0	0	112.3	G311 V315 G330 F331 L333	G311-F313 VanDerWaalsContact O-CD2 3.3Å; G311-F313 WeakPolarHBondContact O-CD2 3.47Å; G311-F313 VanDerWaalsContact O-CE2 3.28Å; G311-F313 WeakPolarHBondContact O-CE2 3.29Å; F313-V315 PolarHBondContact O-N 3.49Å; F313-G330 WeakPolarHBondContact O-CA 3.49Å; F313-F331 PolarHBondContact N-O 3.25Å; F313-F331 PolarHBondContact O-N 3.05Å; F313-L333 HydrophobicContact CB-CD1 3.82Å; F313-L333 HydrophobicContact CB-CD2 4.41Å; F313-L333 HydrophobicContact CB-CG 3.77Å; F313-L333 HydrophobicContact CD1-CD1 3.42Å; F313-L333 VanDerWaalsContact CD1-CD1 3.42Å; F313-L333 HydrophobicContact CD1-CG 4.22Å; F313-L333 HydrophobicContact CD2-CB 3.85Å; F313-L333 HydrophobicContact CD2-CD1 3.46Å; F313-L333 VanDerWaalsContact CD2-CD1 3.46Å; F313-L333 HydrophobicContact CD2-CG 3.39Å; F313-L333 HydrophobicContact CE1-CD1 3.74Å; F313-L333 HydrophobicContact CE2-CB 4.03Å; F313-L333 HydrophobicContact CE2-CD1 3.78Å; F313-L333 HydrophobicContact CE2-CG 3.97Å; F313-L333 HydrophobicContact CG-CB 4.45Å; F313-L333 HydrophobicContact CG-CD1 3.26Å; F313-L333 HydrophobicContact CG-CG 3.53Å; F313-L333 HydrophobicContact CZ-CD1 3.9Å
314	S	97.7	Very high	96.4	Very high	86 Å²	86	55.3 Å²	55.3	60%	0.601	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.9	39.5	-179.4	-63.5	0	0	0	0	112.7	R316	S314-R316 PolarHBondContact O-N 3.32Å
315	V	98.4	Very high	96.3	Very high	7 Å²	7	53.4 Å²	53.4	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	128.8	-174.6	-170.6	0	0	0	0	109.9	K304 I307 E308 L312 F313 S329	K304-V315 HydrophobicContact CB-CG1 4.42Å; K304-V315 WeakPolarHBondContact CE-O 3.37Å; K304-V315 HydrophobicContact CG-CB 4.09Å; K304-V315 HydrophobicContact CG-CG1 3.78Å; I307-V315 HydrophobicContact CB-CG1 3.98Å; I307-V315 HydrophobicContact CB-CG2 4.36Å; I307-V315 HydrophobicContact CD1-CG1 4.23Å; I307-V315 HydrophobicContact CG2-CB 4.33Å; I307-V315 HydrophobicContact CG2-CG1 3.66Å; I307-V315 HydrophobicContact CG2-CG2 3.63Å; E308-V315 HydrophobicContact CB-CG2 4.46Å; E308-V315 HydrophobicContact CG-CB 3.66Å; E308-V315 HydrophobicContact CG-CG2 3.41Å; E308-V315 VanDerWaalsContact CG-CG2 3.41Å; L312-V315 HydrophobicContact CB-CG2 4.1Å; L312-V315 WeakPolarHBondContact O-CG2 3.32Å; F313-V315 PolarHBondContact O-N 3.49Å; V315-S329 CarbonylContact C-O 3.59Å; V315-S329 VanDerWaalsContact CA-O 3.26Å; V315-S329 WeakPolarHBondContact CA-O 3.43Å
316	R	98	Very high	96.2	Very high	168 Å²	168	49.2 Å²	49.2	63%	0.634	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	153.7	178.3	-62.1	-178.2	-174.5	-162.1	0.6	109.6	S314 H328 S329	S314-R316 PolarHBondContact O-N 3.32Å; R316-H328 CarbonylContact O-C 3.54Å; R316-H328 WeakPolarHBondContact O-CA 3.39Å; R316-S329 PolarHBondContact N-O 2.9Å; R316-S329 PolarHBondContact O-N 3.03Å
317	Y	97.9	Very high	96.2	Very high	73 Å²	73	46.6 Å²	46.6	29%	0.286	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	153.2	168.5	61.8	-94.7	0	0	0	112	Q300 E301 K304 L327 H328	Q300-Y317 HydrophobicContact CB-CD1 4.08Å; Q300-Y317 HydrophobicContact CB-CD2 3.72Å; Q300-Y317 HydrophobicContact CB-CE1 3.95Å; Q300-Y317 HydrophobicContact CB-CE2 3.59Å; Q300-Y317 HydrophobicContact CB-CG 3.97Å; Q300-Y317 HydrophobicContact CG-CD2 3.98Å; Q300-Y317 HydrophobicContact CG-CE2 4.06Å; E301-Y317 VanDerWaalsContact OE2-CE1 3.23Å; E301-Y317 WeakPolarHBondContact OE2-CE1 3.24Å; E301-Y317 PolarHBondContact OE2-OH 3.24Å; K304-Y317 HydrophobicContact CB-CD1 4.12Å; K304-Y317 HydrophobicContact CB-CE1 4.44Å; K304-Y317 HydrophobicContact CD-CD1 3.94Å; K304-Y317 HydrophobicContact CD-CE1 3.96Å; Y317-L327 CarbonylContact C-O 3.58Å; Y317-L327 WeakPolarHBondContact CA-O 3.35Å; Y317-H328 AromaticContact CD1-NE2 3.94Å; Y317-H328 AromaticContact CG-NE2 3.94Å
318	H	95.9	Very high	96.2	Very high	92 Å²	92	46.7 Å²	46.7	43%	0.426	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.8	174.2	-58.8	82	0	0	0	109.2	A326 L327	H318-A326 WeakPolarHBondContact O-CA 3.21Å; H318-L327 PolarHBondContact N-O 2.97Å; H318-L327 PolarHBondContact O-N 3.22Å
319	N	96.3	Very high	96.2	Very high	64 Å²	64	44 Å²	44	34%	0.342	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	131.8	177.2	-76.2	-38	0	0	0	111	Q300	Q300-N319 WeakPolarHBondContact CG-OD1 3.35Å; Q300-N319 PolarHBondContact NE2-OD1 2.89Å
320	L	93.9	Very high	96.2	Very high	23 Å²	23	38.3 Å²	38.3	12%	0.12	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.4	174	-53	177.5	0	0	0	109	W94 M97 L251 G322 G323 V324 V325	W94-L320 HydrophobicContact CB-CD1 3.85Å; W94-L320 HydrophobicContact CG-CB 4.46Å; W94-L320 HydrophobicContact CG-CD1 3.9Å; M97-L320 HydrophobicContact CE-CD1 3.79Å; M97-L320 HydrophobicContact CE-CD2 3.84Å; M97-L320 HydrophobicContact CE-CG 4.3Å; M97-L320 HydrophobicContact CG-CD2 4.13Å; M97-L320 HydrophobicContact SD-CD2 4.37Å; L251-L320 HydrophobicContact CD1-CD1 3.76Å; L320-G322 VanDerWaalsContact C-N 3.27Å; L320-G322 PolarHBondContact O-N 2.63Å; L320-G323 PolarHBondContact O-N 2.91Å; L320-V324 PolarHBondContact O-N 2.85Å; L320-V325 HydrophobicContact CB-CB 4.31Å; L320-V325 HydrophobicContact CD1-CG1 4.11Å; L320-V325 PolarHBondContact N-O 3.44Å; L320-V325 PolarHBondContact O-N 3.14Å
321	T	92.2	Very high	96.2	Very high	77 Å²	77	41 Å²	41	47%	0.472	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	50.7	46.3	178.9	-48.7	0	0	0	0	112.5	W94 G323 V324	W94-T321 HydrophobicContact CZ2-CG2 4.41Å; W94-T321 WeakPolarHBondContact CZ2-OG1 3.35Å; W94-T321 PolarHBondContact NE1-OG1 2.75Å; T321-G323 VanDerWaalsContact C-N 3.31Å; T321-G323 PolarHBondContact O-N 3.28Å; T321-V324 HydrophobicContact CG2-CG2 4.43Å; T321-V324 WeakPolarHBondContact O-CG2 3.48Å
322	G	88.9	Confident	96.2	Very high	34 Å²	34	41.1 Å²	41.1	35%	0.351	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	71.1	20.5	178.1	0	0	0	0	0	115.2	T257 L320	T257-G322 PolarHBondContact N-O 2.75Å; T257-G322 PolarHBondContact OG1-O 2.96Å; L320-G322 VanDerWaalsContact C-N 3.27Å; L320-G322 PolarHBondContact O-N 2.63Å
323	G	91.4	Very high	95.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	98.5	3.5	176.2	0	0	0	0	0	114.6	S254 K255 L320 T321 V325	S254-G323 CarbonylContact C-O 3.5Å; S254-G323 VanDerWaalsContact C-O 3.3Å; K255-G323 CarbonylContact C-O 3.11Å; K255-G323 VanDerWaalsContact C-O 3.27Å; K255-G323 VanDerWaalsContact O-O 3.12Å; L320-G323 PolarHBondContact O-N 2.91Å; T321-G323 VanDerWaalsContact C-N 3.31Å; T321-G323 PolarHBondContact O-N 3.28Å; G323-V325 PolarHBondContact O-N 2.94Å
324	V	91.4	Very high	95.8	Very high	11 Å²	11	45.3 Å²	45.3	7%	0.067	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-39.6	170.8	176.4	0	0	0	0	110.4	W94 F253 S254 V256 Y265 L320 T321	W94-V324 HydrophobicContact CH2-CG1 4.1Å; W94-V324 HydrophobicContact CZ2-CG1 4.45Å; F253-V324 VanDerWaalsContact CA-O 3.31Å; F253-V324 WeakPolarHBondContact CA-O 3.18Å; F253-V324 HydrophobicContact CD1-CG1 4.13Å; F253-V324 WeakPolarHBondContact CD1-O 3.29Å; F253-V324 HydrophobicContact CE1-CG1 4.26Å; S254-V324 PolarHBondContact N-O 3.42Å; V256-V324 HydrophobicContact CG2-CG2 3.73Å; Y265-V324 HydrophobicContact CD2-CG1 4.41Å; Y265-V324 HydrophobicContact CD2-CG2 4.21Å; Y265-V324 HydrophobicContact CE2-CG1 3.84Å; Y265-V324 HydrophobicContact CE2-CG2 4.44Å; L320-V324 PolarHBondContact O-N 2.85Å; T321-V324 HydrophobicContact CG2-CG2 4.43Å; T321-V324 WeakPolarHBondContact O-CG2 3.48Å
325	V	95	Very high	95.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.1	174.3	173.3	0	0	0	0	108.8	W94 F223 L251 E252 F253 L320 G323	W94-V325 HydrophobicContact CD2-CB 4.19Å; W94-V325 HydrophobicContact CD2-CG1 4.48Å; W94-V325 HydrophobicContact CD2-CG2 3.89Å; W94-V325 HydrophobicContact CE3-CB 4.26Å; W94-V325 HydrophobicContact CE3-CG2 3.49Å; W94-V325 VanDerWaalsContact CE3-CG2 3.49Å; W94-V325 HydrophobicContact CH2-CG2 3.76Å; W94-V325 HydrophobicContact CZ2-CG2 4.1Å; W94-V325 HydrophobicContact CZ3-CG2 3.45Å; W94-V325 VanDerWaalsContact CZ3-CG2 3.45Å; F223-V325 HydrophobicContact CE1-CG1 4.05Å; F223-V325 HydrophobicContact CE1-CG2 3.82Å; F223-V325 HydrophobicContact CZ-CG1 4.09Å; F223-V325 HydrophobicContact CZ-CG2 4.17Å; L251-V325 HydrophobicContact CD1-CG1 3.45Å; L251-V325 VanDerWaalsContact CD1-CG1 3.45Å; L251-V325 HydrophobicContact CG-CG1 3.91Å; E252-V325 CarbonylContact O-C 3.55Å; E252-V325 WeakPolarHBondContact O-CA 3.27Å; E252-V325 WeakPolarHBondContact O-CG1 3.41Å; F253-V325 HydrophobicContact CD1-CG2 3.74Å; F253-V325 HydrophobicContact CE1-CG2 3.93Å; F253-V325 HydrophobicContact CG-CG2 4.39Å; L320-V325 HydrophobicContact CB-CB 4.31Å; L320-V325 HydrophobicContact CD1-CG1 4.11Å; L320-V325 PolarHBondContact N-O 3.44Å; L320-V325 PolarHBondContact O-N 3.14Å; G323-V325 PolarHBondContact O-N 2.94Å
326	A	97.5	Very high	95.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.008	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140.6	170.9	0	0	0	0	0	110.2	E252 Q300 H318	E252-A326 PolarHBondContact N-O 3.47Å; E252-A326 PolarHBondContact O-N 3.41Å; Q300-A326 HydrophobicContact CG-CB 3.92Å; H318-A326 WeakPolarHBondContact O-CA 3.21Å
327	L	98.4	Very high	95.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	107.7	165.4	175.2	69.8	0	0	0	108.7	M97 L98 V101 M249 C250 L251 Y317 H318	M97-L327 HydrophobicContact CE-CB 3.74Å; M97-L327 HydrophobicContact CE-CD2 3.28Å; M97-L327 HydrophobicContact CE-CG 4.06Å; M97-L327 HydrophobicContact SD-CD2 4.24Å; L98-L327 HydrophobicContact CB-CD1 4.35Å; L98-L327 HydrophobicContact CD1-CD1 3.91Å; L98-L327 HydrophobicContact CG-CD1 4.18Å; V101-L327 HydrophobicContact CB-CD2 3.77Å; V101-L327 HydrophobicContact CG1-CD2 3.71Å; V101-L327 HydrophobicContact CG2-CD2 4.09Å; M249-L327 HydrophobicContact CE-CD1 4.1Å; M249-L327 HydrophobicContact CE-CD2 3.86Å; M249-L327 HydrophobicContact CE-CG 4.46Å; C250-L327 CarbonylContact O-C 3.53Å; C250-L327 WeakPolarHBondContact O-CA 3.43Å; L251-L327 HydrophobicContact CB-CD1 4.29Å; L251-L327 HydrophobicContact CD1-CB 4.11Å; L251-L327 HydrophobicContact CD1-CD1 4.37Å; Y317-L327 CarbonylContact C-O 3.58Å; Y317-L327 WeakPolarHBondContact CA-O 3.35Å; H318-L327 PolarHBondContact N-O 2.97Å; H318-L327 PolarHBondContact O-N 3.22Å
328	H	98.7	Very high	95.3	Very high	3 Å²	3	35.8 Å²	35.8	1%	0.014	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	144.4	170.6	-69.1	65.1	0	0	0	110.5	M249 C250 Q300 F303 I307 R316 Y317	M249-H328 CarbonylContact C-O 3.5Å; M249-H328 WeakPolarHBondContact CA-O 3.3Å; C250-H328 HydrophobicContact CB-CB 4.44Å; C250-H328 PolarHBondContact N-O 3.16Å; C250-H328 PolarHBondContact O-N 3.18Å; Q300-H328 PolarHBondContact O-NE2 3.47Å; F303-H328 HydrophobicContact CD1-CB 4.45Å; F303-H328 AromaticContact CD1-CD2 3.7Å; F303-H328 AromaticContact CD1-CE1 3.81Å; F303-H328 AromaticContact CD1-CG 3.78Å; F303-H328 AromaticContact CD1-ND1 3.88Å; F303-H328 AromaticContact CD1-NE2 3.73Å; F303-H328 HydrophobicContact CE1-CB 4.34Å; I307-H328 HydrophobicContact CD1-CB 3.7Å; R316-H328 CarbonylContact O-C 3.54Å; R316-H328 WeakPolarHBondContact O-CA 3.39Å; Y317-H328 AromaticContact CD1-NE2 3.94Å; Y317-H328 AromaticContact CG-NE2 3.94Å
329	S	98.4	Very high	95.2	Very high	7 Å²	7	32 Å²	32	5%	0.049	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	142.9	175.6	-175	0	0	0	0	111.2	R247 F248 V315 R316	R247-S329 PolarHBondContact NE-OG 3.4Å; R247-S329 PolarHBondContact NH2-OG 3.16Å; F248-S329 WeakPolarHBondContact O-CA 3.02Å; F248-S329 WeakPolarHBondContact O-CB 3.41Å; F248-S329 PolarHBondContact O-OG 2.8Å; V315-S329 CarbonylContact C-O 3.59Å; V315-S329 VanDerWaalsContact CA-O 3.26Å; V315-S329 WeakPolarHBondContact CA-O 3.43Å; R316-S329 PolarHBondContact N-O 2.9Å; R316-S329 PolarHBondContact O-N 3.03Å
330	G	98.3	Very high	95.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	175	175.6	0	0	0	0	0	110.9	F248 F313	F248-G330 PolarHBondContact N-O 2.63Å; F248-G330 PolarHBondContact O-N 3.35Å; F248-G330 VanDerWaalsContact O-N 3.11Å; F313-G330 WeakPolarHBondContact O-CA 3.49Å
331	F	98.5	Very high	95.3	Very high	79 Å²	79	30.2 Å²	30.2	35%	0.346	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.5	-178.3	-63.3	-91.7	0	0	0	111.1	G246 R247 L312 F313	G246-F331 CarbonylContact O-C 3.55Å; G246-F331 WeakPolarHBondContact O-CA 3.48Å; R247-F331 HydrophobicContact CB-CD1 4Å; R247-F331 HydrophobicContact CB-CE1 3.89Å; R247-F331 HydrophobicContact CG-CD1 4.02Å; R247-F331 HydrophobicContact CG-CE1 3.67Å; R247-F331 HydrophobicContact CG-CZ 4.05Å; L312-F331 VanDerWaalsContact CD2-C 3.46Å; F313-F331 PolarHBondContact N-O 3.25Å; F313-F331 PolarHBondContact O-N 3.05Å
332	K	98.3	Very high	95.5	Very high	31 Å²	31	26.3 Å²	26.3	14%	0.135	15%	0.146	C	C	.	.			trans	-75.9	133.5	163.7	-174.9	-180	-173.1	170.7	0	108.3	D214 V239 R240 L242 K243 G245 G246 L312	D214-K332 IonicContact OD1-NZ 3.91Å; D214-K332 PolarHBondContact OD1-NZ 2.76Å; V239-K332 VanDerWaalsContact O-CD 3.27Å; V239-K332 WeakPolarHBondContact O-CD 3.28Å; V239-K332 VanDerWaalsContact O-CE 3.28Å; V239-K332 WeakPolarHBondContact O-CE 3.34Å; V239-K332 PolarHBondContact O-NZ 2.87Å; R240-K332 PolarHBondContact O-NZ 2.89Å; L242-K332 HydrophobicContact CB-CB 4.31Å; L242-K332 HydrophobicContact CB-CD 4.1Å; L242-K332 WeakPolarHBondContact O-CD 3.43Å; L242-K332 WeakPolarHBondContact O-CE 3.22Å; L242-K332 PolarHBondContact O-NZ 3.36Å; K243-K332 WeakPolarHBondContact O-CD 3.28Å; G245-K332 VanDerWaalsContact CA-O 3.26Å; G245-K332 WeakPolarHBondContact CA-O 3.41Å; G245-K332 PolarHBondContact N-O 3.09Å; G246-K332 PolarHBondContact O-N 3.19Å; L312-K332 HydrophobicContact CD2-CB 4.31Å
333	L	91.4	Very high	96.1	Very high	150 Å²	150	25.6 Å²	25.6	79%	0.785	13%	0.128	S	C	*	.			trans	-89.5	0	175.3	-72.8	-175.2	0	0	0	112.6	F313	F313-L333 HydrophobicContact CB-CD1 3.82Å; F313-L333 HydrophobicContact CB-CD2 4.41Å; F313-L333 HydrophobicContact CB-CG 3.77Å; F313-L333 HydrophobicContact CD1-CD1 3.42Å; F313-L333 VanDerWaalsContact CD1-CD1 3.42Å; F313-L333 HydrophobicContact CD1-CG 4.22Å; F313-L333 HydrophobicContact CD2-CB 3.85Å; F313-L333 HydrophobicContact CD2-CD1 3.46Å; F313-L333 VanDerWaalsContact CD2-CD1 3.46Å; F313-L333 HydrophobicContact CD2-CG 3.39Å; F313-L333 HydrophobicContact CE1-CD1 3.74Å; F313-L333 HydrophobicContact CE2-CB 4.03Å; F313-L333 HydrophobicContact CE2-CD1 3.78Å; F313-L333 HydrophobicContact CE2-CG 3.97Å; F313-L333 HydrophobicContact CG-CB 4.45Å; F313-L333 HydrophobicContact CG-CD1 3.26Å; F313-L333 HydrophobicContact CG-CG 3.53Å; F313-L333 HydrophobicContact CZ-CD1 3.9Å

Retrieved 333 of 333 residues in 89.5 ms (Link to these results)

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