A0A087Y5Q4_POEFO Loading...

Serine/threonine-protein kinase receptor

AlphaFold DB , UniProt , Accession A0A087Y5Q4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 522 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	48.4	Very low	46.9	Very low	199 Å²	199	112.8 Å²	112.8	98%	0.98	63%	0.625	S	S	*	*				0	-40.7	0	-72.8	-65.3	-88	0	0	113.8	T5	M1-T5 PolarHBondContact O-OG1 3.45Å; M1-T5 VanDerWaalsContact O-OG1 3.07Å
2	A	45	Very low	46.9	Very low	74 Å²	74	112.9 Å²	112.9	61%	0.612	62%	0.622	S	S	*	*	H	α-helix	trans	-76.7	-19.6	-178.7	0	0	0	0	0	116.3	T5	A2-T5 PolarHBondContact O-OG1 3.04Å
3	V	46.8	Very low	46.5	Very low	111 Å²	111	114.2 Å²	114.2	67%	0.673	63%	0.626	S	S	*	*	H	α-helix	trans	-83.8	-33.6	177.8	178.3	0	0	0	0	111.5	R6 L7	V3-R6 PolarHBondContact O-N 3.28Å; V3-L7 HydrophobicContact CG1-CD1 4.26Å; V3-L7 PolarHBondContact O-N 3.05Å
4	L	42.9	Very low	45.9	Very low	116 Å²	116	110.4 Å²	110.4	61%	0.607	62%	0.618	S	S	*	*	H	α-helix	trans	-69.9	-35.5	179.9	-150.3	80.3	0	0	0	111.8	L8	L4-L8 PolarHBondContact O-N 2.7Å; L4-L8 VanDerWaalsContact O-N 3.17Å
5	T	51.5	Low	45.4	Very low	93 Å²	93	111 Å²	111	57%	0.571	62%	0.619	S	S	*	*	H	α-helix	trans	-70.3	-30.7	175.6	30.2	0	0	0	0	113.3	M1 A2 A9	M1-T5 PolarHBondContact O-OG1 3.45Å; M1-T5 VanDerWaalsContact O-OG1 3.07Å; A2-T5 PolarHBondContact O-OG1 3.04Å; T5-A9 PolarHBondContact O-N 3.25Å
6	R	47.1	Very low	44.9	Very low	210 Å²	210	117.8 Å²	117.8	79%	0.792	63%	0.632	S	S	*	*	H	α-helix	trans	-75.3	-33.3	176.3	-72.7	-171.7	176	-166.1	-0.6	112.9	V3 A10	V3-R6 PolarHBondContact O-N 3.28Å; R6-A10 PolarHBondContact O-N 3.12Å
7	L	46.4	Very low	44.3	Very low	112 Å²	112	117.2 Å²	117.2	59%	0.586	63%	0.634	S	S	*	*	H	α-helix	trans	-71.3	-38.6	174.2	-87	153.1	0	0	0	112.6	V3 A10 L11	V3-L7 HydrophobicContact CG1-CD1 4.26Å; V3-L7 PolarHBondContact O-N 3.05Å; L7-A10 PolarHBondContact O-N 3.1Å; L7-L11 PolarHBondContact O-N 2.89Å; L7-L11 VanDerWaalsContact O-N 3.16Å
8	L	49.7	Very low	43.7	Very low	102 Å²	102	120.2 Å²	120.2	53%	0.534	64%	0.642	S	S	.	*	H	α-helix	trans	-67.2	-35.7	175.1	-96.5	145.3	0	0	0	113	L4 L11 L12	L4-L8 PolarHBondContact O-N 2.7Å; L4-L8 VanDerWaalsContact O-N 3.17Å; L8-L11 PolarHBondContact O-N 3.36Å; L8-L12 WeakPolarHBondContact O-CD1 3.09Å; L8-L12 WeakPolarHBondContact O-CG 3.47Å; L8-L12 PolarHBondContact O-N 2.94Å; L8-L12 VanDerWaalsContact O-N 3.15Å
9	A	50.2	Low	43.2	Very low	51 Å²	51	118.5 Å²	118.5	42%	0.421	65%	0.647	S	S	.	*	H	α-helix	trans	-68.2	-37.8	175.9	0	0	0	0	0	112.6	T5 L12 L13	T5-A9 PolarHBondContact O-N 3.25Å; A9-L12 PolarHBondContact O-N 3.37Å; A9-L13 PolarHBondContact O-N 3.33Å
10	A	44.9	Very low	42.5	Very low	62 Å²	62	117.8 Å²	117.8	51%	0.512	66%	0.657	S	S	.	*	H	α-helix	trans	-68.5	-36.3	176.2	0	0	0	0	0	112.5	R6 L7 L13 A14	R6-A10 PolarHBondContact O-N 3.12Å; L7-A10 PolarHBondContact O-N 3.1Å; A10-L13 PolarHBondContact O-N 3.21Å; A10-A14 PolarHBondContact O-N 2.98Å
11	L	42.7	Very low	41.9	Very low	111 Å²	111	115.5 Å²	115.5	58%	0.581	66%	0.661	S	S	*	*	H	α-helix	trans	-68.7	-37.3	176.2	-130.1	94.6	0	0	0	112.5	L7 L8 L13 A14 L15	L7-L11 PolarHBondContact O-N 2.89Å; L7-L11 VanDerWaalsContact O-N 3.16Å; L8-L11 PolarHBondContact O-N 3.36Å; L11-L13 VanDerWaalsContact C-N 3.33Å; L11-A14 PolarHBondContact O-N 3.06Å; L11-L15 HydrophobicContact CD2-CD1 4.45Å; L11-L15 WeakPolarHBondContact O-CD1 3.44Å; L11-L15 WeakPolarHBondContact O-CG 3.46Å; L11-L15 PolarHBondContact O-N 3.44Å; L11-L15 VanDerWaalsContact O-N 3.08Å
12	L	47.5	Very low	40.9	Very low	114 Å²	114	115.2 Å²	115.2	60%	0.597	66%	0.657	S	S	*	*	H	α-helix	trans	-70.4	-27.2	177.5	-78.9	162.6	0	0	0	113.3	L8 A9 R16	L8-L12 WeakPolarHBondContact O-CD1 3.09Å; L8-L12 WeakPolarHBondContact O-CG 3.47Å; L8-L12 PolarHBondContact O-N 2.94Å; L8-L12 VanDerWaalsContact O-N 3.15Å; A9-L12 PolarHBondContact O-N 3.37Å; L12-R16 PolarHBondContact O-N 2.65Å
13	L	41.3	Very low	40.1	Very low	129 Å²	129	119.1 Å²	119.1	68%	0.675	67%	0.667	S	S	*	*	H	α-helix	trans	-76.2	-35	172.8	-96.5	139.9	0	0	0	112.4	A9 A10 L11	A9-L13 PolarHBondContact O-N 3.33Å; A10-L13 PolarHBondContact O-N 3.21Å; L11-L13 VanDerWaalsContact C-N 3.33Å
14	A	37.8	Very low	39.3	Very low	62 Å²	62	118.3 Å²	118.3	51%	0.512	67%	0.665	S	S	.	*	H	α-helix	trans	-72.8	-29.6	175	0	0	0	0	0	113.2	A10 L11 T17	A10-A14 PolarHBondContact O-N 2.98Å; L11-A14 PolarHBondContact O-N 3.06Å; A14-T17 PolarHBondContact O-OG1 2.93Å
15	L	38.5	Very low	38.5	Very low	119 Å²	119	119.9 Å²	119.9	62%	0.623	67%	0.674	S	S	*	*	H	α-helix	trans	-80.2	-14.9	177.1	-77.2	160	0	0	0	113.8	L11	L11-L15 HydrophobicContact CD2-CD1 4.45Å; L11-L15 WeakPolarHBondContact O-CD1 3.44Å; L11-L15 WeakPolarHBondContact O-CG 3.46Å; L11-L15 PolarHBondContact O-N 3.44Å; L11-L15 VanDerWaalsContact O-N 3.08Å
16	R	38	Very low	37.5	Very low	219 Å²	219	124.4 Å²	124.4	83%	0.826	69%	0.688	S	S	*	*	S	Bend	trans	-82.7	-16.8	175	-94.2	-172.9	178.3	-161	-0.2	114.3	L12	L12-R16 PolarHBondContact O-N 2.65Å
17	T	35	Very low	36.5	Very low	109 Å²	109	119.8 Å²	119.8	67%	0.669	68%	0.683	S	S	*	*	S	Bend	trans	-97.4	4	-178.4	54.6	0	0	0	0	113.8	A14	A14-T17 PolarHBondContact O-OG1 2.93Å
18	H	33	Very low	35.6	Very low	171 Å²	171	122.5 Å²	122.5	79%	0.792	70%	0.697	S	S	*	*	S	Bend	trans	-119.5	17.9	175.8	-91.8	45.7	0	0	0	113.5
19	A	33.9	Very low	34.6	Very low	87 Å²	87	125.4 Å²	125.4	72%	0.719	71%	0.712	S	S	*	*			trans	-102.8	66	170.4	0	0	0	0	0	110.8
20	A	30.3	Very low	33.4	Very low	104 Å²	104	126 Å²	126	86%	0.86	72%	0.723	S	S	*	*			trans	-146.8	55.3	157.2	0	0	0	0	0	107.8
21	G	28.8	Very low	32.6	Very low	71 Å²	71	130 Å²	130	73%	0.732	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-75.4	130	170.4	0	0	0	0	0	110
22	Q	28.2	Very low	31.8	Very low	193 Å²	193	128.2 Å²	128.2	90%	0.902	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-47.8	135.1	166.3	-67.6	160.8	-40.3	0	0	111
23	N	27.6	Very low	30.9	Very low	155 Å²	155	129.7 Å²	129.7	83%	0.829	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-94	119.1	169.8	-157.3	22.7	0	0	0	108.2
24	P	30.4	Very low	30.3	Very low	95 Å²	95	130.9 Å²	130.9	62%	0.617	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-81.6	163.9	165.7	32.6	-26.2	0	0	0	110
25	D	25.5	Very low	30.1	Very low	149 Å²	149	133.2 Å²	133.2	80%	0.797	78%	0.781	S	S	*	*			trans	83.2	94.4	179.5	-54.9	-26.9	0	0	0	117.5
26	H	29.7	Very low	29.5	Very low	187 Å²	187	136.7 Å²	136.7	87%	0.866	79%	0.794	S	S	*	*				-156.8	127.2	123.8	-118.3	-73.3	0	0	0	113.1
27	V	27.5	Very low	29.2	Very low	113 Å²	113	131 Å²	131	69%	0.685	79%	0.793	S	S	*	*			trans	84.8	87.2	154.1	-161	0	0	0	0	119.1
28	L	27.1	Very low	28.7	Very low	170 Å²	170	137.6 Å²	137.6	89%	0.89	81%	0.806	S	S	*	*			trans	-78.4	129.5	130.3	-84.7	163.9	0	0	0	109.3
29	L	28.5	Very low	28.5	Very low	162 Å²	162	140.9 Å²	140.9	85%	0.848	81%	0.811	S	S	*	*			trans	-174.8	99.9	147.8	-99	146.8	0	0	0	105.2
30	G	25.3	Very low	28.8	Very low	64 Å²	64	142.9 Å²	142.9	66%	0.66	82%	0.817	S	S	*	*				74.4	106.7	94.4	0	0	0	0	0	108.9
31	T	27.4	Very low	28.7	Very low	145 Å²	145	141.4 Å²	141.4	89%	0.89	81%	0.811	S	S	*	*				-164.5	146.4	79.9	39.1	0	0	0	0	111.1
32	G	27.2	Very low	29.2	Very low	74 Å²	74	147.5 Å²	147.5	76%	0.763	82%	0.821	S	S	*	*			trans	-78.1	144.3	169.3	0	0	0	0	0	112.2
33	V	27.1	Very low	29.9	Very low	145 Å²	145	145.8 Å²	145.8	88%	0.879	82%	0.818	S	S	*	*			trans	-142	133.1	151.1	-178.5	0	0	0	0	107.5
34	N	29	Very low	30.2	Very low	154 Å²	154	143.4 Å²	143.4	82%	0.824	81%	0.814	S	S	*	*			trans	-70.1	165.5	-177.5	-137	10.9	0	0	0	111.9
35	P	34.1	Very low	30.6	Very low	112 Å²	112	145.6 Å²	145.6	73%	0.727	83%	0.825	S	S	*	*			trans	-87	134.7	-167.4	35	-31.9	0	0	0	112
36	E	26.5	Very low	31.2	Very low	192 Å²	192	145 Å²	145	90%	0.897	82%	0.821	S	S	*	*			trans	-125	130	159.6	-84.8	-168.7	162.6	0	0	111.1
37	A	31	Very low	31.5	Very low	98 Å²	98	139 Å²	139	81%	0.81	80%	0.803	S	S	*	*			trans	-63.7	137.5	176.8	0	0	0	0	0	112.1
38	R	25.2	Very low	32.3	Very low	249 Å²	249	139.3 Å²	139.3	94%	0.94	81%	0.807	S	S	*	*			trans	-134.5	124.2	146.8	-77.6	-170.3	-180	175.7	0.4	110.7
39	R	29.2	Very low	33.3	Very low	240 Å²	240	139.7 Å²	139.7	91%	0.906	81%	0.805	S	S	*	*			trans	-77.7	170.9	170.3	-98.2	-173.3	-172.2	-177.6	2.7	110.6
40	P	38.8	Very low	34.3	Very low	129 Å²	129	138.1 Å²	138.1	84%	0.838	80%	0.797	S	S	*	*			trans	-87.4	151.6	-138.6	36	-34.6	0	0	0	113.4
41	G	28.1	Very low	35.5	Very low	72 Å²	72	141.5 Å²	141.5	74%	0.742	80%	0.799	S	S	*	*			trans	-122.1	122.9	163.9	0	0	0	0	0	108.7	D43	G41-D43 PolarHBondContact O-N 3.08Å
42	E	39.8	Very low	36.9	Very low	199 Å²	199	138.9 Å²	138.9	93%	0.93	79%	0.785	S	S	*	*			trans	-48.9	124.7	170.7	-69.2	160.8	138.1	0	0	111.1
43	D	43.8	Very low	38.9	Very low	157 Å²	157	144.3 Å²	144.3	84%	0.84	78%	0.783	S	S	*	*				155.5	92.4	117.2	-125.3	-7.8	0	0	0	107.1	G41	G41-D43 PolarHBondContact O-N 3.08Å
44	S	33.2	Very low	41.6	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	76%	0.764	S	S	*	*			trans	-143.7	102.6	163.1	38.2	0	0	0	0	108.2	I46	S44-I46 PolarHBondContact O-N 3.31Å; S44-I46 VanDerWaalsContact O-N 3.11Å
45	T	39	Very low	44.4	Very low	140 Å²	140	135.8 Å²	135.8	86%	0.859	73%	0.727	S	S	*	*			trans	-46.3	110.7	164.8	39.7	0	0	0	0	110.1	A47	T45-A47 PolarHBondContact O-N 3.14Å
46	I	36.8	Very low	47.1	Very low	138 Å²	138	131.3 Å²	131.3	71%	0.708	70%	0.698	S	S	*	*			trans	-67.7	126.1	170.9	-60.8	170.7	0	0	0	107.4	S44 D50	S44-I46 PolarHBondContact O-N 3.31Å; S44-I46 VanDerWaalsContact O-N 3.11Å; I46-D50 HydrophobicContact CG2-CB 4.28Å
47	A	36.3	Very low	50.2	Low	59 Å²	59	122.1 Å²	122.1	49%	0.488	66%	0.655	S	S	.	*			trans	-64.8	147.9	173.5	0	0	0	0	0	110	T45 E49 D50	T45-A47 PolarHBondContact O-N 3.14Å; A47-E49 PolarHBondContact O-N 2.63Å; A47-D50 PolarHBondContact O-N 3.35Å
48	P	44.1	Very low	53.1	Low	120 Å²	120	120.9 Å²	120.9	78%	0.779	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-4.9	-171.4	-18	30.5	0	0	0	115.6
49	E	50	Low	56.2	Low	179 Å²	179	109 Å²	109	84%	0.836	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-6	-172.9	-57.9	-163.6	175.7	0	0	114	A47	A47-E49 PolarHBondContact O-N 2.63Å
50	D	49.2	Very low	59	Low	129 Å²	129	100 Å²	100	69%	0.69	56%	0.559	S	S	*	*			trans	-107.9	24.5	179.9	-71.7	-40.6	0	0	0	113.9	I46 A47	I46-D50 HydrophobicContact CG2-CB 4.28Å; A47-D50 PolarHBondContact O-N 3.35Å
51	L	50.3	Low	61.1	Low	134 Å²	134	97.3 Å²	97.3	70%	0.702	56%	0.555	S	S	*	*	S	Bend	trans	-72.9	132.8	161.2	-95.8	102.6	0	0	0	109.2	R53	L51-R53 PolarHBondContact O-N 3.49Å
52	P	55.9	Low	63.7	Low	91 Å²	91	99 Å²	99	59%	0.591	54%	0.543	S	S	*	.			trans	-61.9	101.5	174.1	23.7	-30.7	0	0	0	109.3	F54	P52-F54 HydrophobicContact CB-CD2 4.42Å; P52-F54 HydrophobicContact CB-CE2 3.92Å; P52-F54 HydrophobicContact CG-CE2 4.21Å; P52-F54 VanDerWaalsContact O-CD2 3.3Å; P52-F54 WeakPolarHBondContact O-CD2 3.4Å; P52-F54 PolarHBondContact O-N 3.35Å
53	R	70.1	Confident	65.9	Low	188 Å²	188	92 Å²	92	71%	0.709	52%	0.516	S	S	*	.			trans	-74.9	106.9	177	-168.4	174.1	-178.8	167.1	-0.5	108.1	L51	L51-R53 PolarHBondContact O-N 3.49Å
54	F	82.5	Confident	67.7	Low	111 Å²	111	87 Å²	87	49%	0.487	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-84.7	120.2	172.7	-75.9	-90.1	0	0	0	109.5	P52 T74 N75	P52-F54 HydrophobicContact CB-CD2 4.42Å; P52-F54 HydrophobicContact CB-CE2 3.92Å; P52-F54 HydrophobicContact CG-CE2 4.21Å; P52-F54 VanDerWaalsContact O-CD2 3.3Å; P52-F54 WeakPolarHBondContact O-CD2 3.4Å; P52-F54 PolarHBondContact O-N 3.35Å; F54-T74 CarbonylContact C-O 3.51Å; F54-T74 WeakPolarHBondContact CA-O 3.33Å; F54-N75 HydrophobicContact CD1-CB 4.47Å; F54-N75 HydrophobicContact CE1-CB 4.26Å
55	L	87.6	Confident	70	Confident	8 Å²	8	90.7 Å²	90.7	4%	0.042	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	140.2	171.5	-66.4	169.1	0	0	0	109.7	R73 T74 G76 N122 D124	L55-R73 CarbonylContact O-C 3.56Å; L55-R73 VanDerWaalsContact O-CA 3.28Å; L55-R73 WeakPolarHBondContact O-CA 3.47Å; L55-T74 HydrophobicContact CB-CG2 4.38Å; L55-T74 PolarHBondContact N-O 2.73Å; L55-T74 PolarHBondContact O-N 2.95Å; L55-G76 WeakPolarHBondContact CD1-O 3.4Å; L55-N122 WeakPolarHBondContact CD2-O 2.99Å; L55-D124 WeakPolarHBondContact CA-OD1 3.32Å
56	S	90.8	Very high	71.9	Confident	18 Å²	18	90.3 Å²	90.3	13%	0.126	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.8	167.6	-51.4	0	0	0	0	108.4	C72 D124 F125	S56-C72 WeakPolarHBondContact CA-O 3.32Å; S56-D124 PolarHBondContact N-OD1 2.73Å; S56-D124 CarbonylContact O-C 3.51Å; S56-D124 WeakPolarHBondContact O-CA 3.41Å; S56-F125 PolarHBondContact O-N 2.88Å
57	C	91.7	Very high	74.1	Confident	0 Å²	0	85.3 Å²	85.3	0%	0	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	152.8	-179.1	-46.6	0	0	0	0	110.5	T71 C72 C78 C96	C57-T71 WeakPolarHBondContact O-CA 3.36Å; C57-C72 PolarHBondContact N-O 3.42Å; C57-C72 PolarHBondContact O-N 2.94Å; C57-C78 HydrophobicContact CB-CB 3.6Å; C57-C78 WeakPolarHBondContact CB-SG 3.39Å; C57-C78 WeakPolarHBondContact SG-CA 3.35Å; C57-C78 WeakPolarHBondContact SG-CB 3.35Å; C57-C78 CovalentContact SG-SG 2.02Å; C57-C78 PolarHBondContact SG-SG 3.36Å; C57-C96 VanDerWaalsContact CB-SG 3.51Å
58	Y	92.7	Very high	76.2	Confident	72 Å²	72	88.8 Å²	88.8	28%	0.282	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	136.9	166.8	178.7	-104.2	0	0	0	109.5	N70 N127	Y58-N70 CarbonylContact C-O 3.56Å; Y58-N70 WeakPolarHBondContact CA-O 3.43Å; Y58-N70 HydrophobicContact CD2-CB 4.16Å; Y58-N70 HydrophobicContact CE2-CB 3.73Å; Y58-N127 PolarHBondContact N-OD1 3.39Å; Y58-N127 VanDerWaalsContact N-OD1 3.09Å; Y58-N127 PolarHBondContact O-ND2 2.75Å
59	C	89.4	Confident	78.2	Confident	0 Å²	0	90.1 Å²	90.1	0%	0	49%	0.485	C	S	.	.			trans	-125.1	137.3	174.3	72.3	0	0	0	0	111.3	C63 N70 C72 S94	C59-C63 HydrophobicContact CB-CB 3.99Å; C59-C63 WeakPolarHBondContact CB-SG 3.49Å; C59-C63 PolarHBondContact O-SG 3Å; C59-C63 VanDerWaalsContact SG-CA 3.51Å; C59-C63 WeakPolarHBondContact SG-CB 3.49Å; C59-C63 CovalentContact SG-SG 2.04Å; C59-C63 PolarHBondContact SG-SG 3.36Å; C59-N70 PolarHBondContact N-O 3.08Å; C59-N70 WeakPolarHBondContact O-CB 3.42Å; C59-N70 VanDerWaalsContact SG-C 3.55Å; C59-C72 HydrophobicContact CB-CB 4.3Å; C59-S94 CarbonylContact C-O 3.58Å; C59-S94 VanDerWaalsContact CA-O 3.24Å; C59-S94 WeakPolarHBondContact CA-O 3.21Å
60	S	87.9	Confident	80	Confident	50 Å²	50	85.8 Å²	85.8	35%	0.35	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	-153.5	127.4	175.5	-176.8	0	0	0	0	107.7	H62 A93 S94	S60-H62 PolarHBondContact O-N 2.95Å; S60-A93 CarbonylContact O-C 3.52Å; S60-A93 VanDerWaalsContact O-CA 3.28Å; S60-A93 WeakPolarHBondContact O-CA 3.34Å; S60-A93 WeakPolarHBondContact O-CB 3.41Å; S60-S94 PolarHBondContact N-O 3.18Å; S60-S94 PolarHBondContact O-N 3.15Å; S60-S94 VanDerWaalsContact O-O 3.11Å
61	G	83.5	Confident	82	Confident	73 Å²	73	81.7 Å²	81.7	75%	0.753	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	75.1	-36.8	-170.3	0	0	0	0	0	114.8
62	H	82.5	Confident	83.8	Confident	106 Å²	106	75.4 Å²	75.4	49%	0.491	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	61	176.8	-81.2	-59.6	0	0	0	112.5	S60 F79	S60-H62 PolarHBondContact O-N 2.95Å; H62-F79 HydrophobicContact CB-CZ 3.98Å
63	C	85.9	Confident	85.4	Confident	53 Å²	53	79.9 Å²	79.9	36%	0.358	42%	0.42	S	S	.	.			trans	-92.2	135.7	171.2	-70.8	0	0	0	0	111.2	C59 A67	C59-C63 HydrophobicContact CB-CB 3.99Å; C59-C63 WeakPolarHBondContact CB-SG 3.49Å; C59-C63 PolarHBondContact O-SG 3Å; C59-C63 VanDerWaalsContact SG-CA 3.51Å; C59-C63 WeakPolarHBondContact SG-CB 3.49Å; C59-C63 CovalentContact SG-SG 2.04Å; C59-C63 PolarHBondContact SG-SG 3.36Å; C63-A67 HydrophobicContact CB-CB 3.9Å
64	P	82.7	Confident	86.2	Confident	53 Å²	53	71.3 Å²	71.3	34%	0.344	39%	0.388	S	S	.	.			trans	-69.9	159.2	167.1	32	-35.1	0	0	0	111.1	D66 A67 C72	P64-D66 VanDerWaalsContact CB-OD1 3.27Å; P64-D66 WeakPolarHBondContact CB-OD1 3.37Å; P64-D66 WeakPolarHBondContact CG-OD1 3.37Å; P64-D66 PolarHBondContact O-N 3.08Å; P64-D66 VanDerWaalsContact O-N 3.1Å; P64-A67 HydrophobicContact CG-CB 4.35Å; P64-A67 WeakPolarHBondContact O-CB 3.46Å; P64-A67 PolarHBondContact O-N 3.45Å; P64-C72 HydrophobicContact CG-CB 3.75Å
65	D	80	Confident	86.3	Confident	183 Å²	183	69.6 Å²	69.6	98%	0.979	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.7	-174.2	-62.2	-40.6	0	0	0	113.9
66	D	80.2	Confident	86.3	Confident	132 Å²	132	69.8 Å²	69.8	71%	0.706	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	6.5	177.8	66.5	-31.5	0	0	0	113.7	P64 I68	P64-D66 VanDerWaalsContact CB-OD1 3.27Å; P64-D66 WeakPolarHBondContact CB-OD1 3.37Å; P64-D66 WeakPolarHBondContact CG-OD1 3.37Å; P64-D66 PolarHBondContact O-N 3.08Å; P64-D66 VanDerWaalsContact O-N 3.1Å; D66-I68 PolarHBondContact O-N 3.01Å
67	A	82	Confident	86.3	Confident	32 Å²	32	71.3 Å²	71.3	26%	0.264	39%	0.393	S	S	.	.			trans	-68.2	130.5	178.8	0	0	0	0	0	112	C63 P64 T71	C63-A67 HydrophobicContact CB-CB 3.9Å; P64-A67 HydrophobicContact CG-CB 4.35Å; P64-A67 WeakPolarHBondContact O-CB 3.46Å; P64-A67 PolarHBondContact O-N 3.45Å; A67-T71 WeakPolarHBondContact CA-O 3.41Å
68	I	81.4	Confident	86.3	Confident	132 Å²	132	71.3 Å²	71.3	68%	0.677	39%	0.393	S	S	*	.	B	Isolated β-bridge	trans	-118.2	131.1	174.9	-56.9	174	0	0	0	107.4	D66 N70 T71	D66-I68 PolarHBondContact O-N 3.01Å; I68-N70 PolarHBondContact O-N 3.44Å; I68-T71 WeakPolarHBondContact O-CB 3.43Å; I68-T71 PolarHBondContact O-N 3.24Å
69	N	85.3	Confident	86.3	Confident	148 Å²	148	68.9 Å²	68.9	79%	0.791	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	49.8	-178.6	-67.1	-12.2	0	0	0	113.5	T71	N69-T71 PolarHBondContact O-N 3.17Å; N69-T71 PolarHBondContact O-OG1 3.15Å; N69-T71 VanDerWaalsContact O-OG1 3.04Å
70	N	89.1	Confident	86.4	Confident	88 Å²	88	69 Å²	69	47%	0.471	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	29.8	178.2	-62	-25.9	0	0	0	113.4	Y58 C59 I68	Y58-N70 CarbonylContact C-O 3.56Å; Y58-N70 WeakPolarHBondContact CA-O 3.43Å; Y58-N70 HydrophobicContact CD2-CB 4.16Å; Y58-N70 HydrophobicContact CE2-CB 3.73Å; C59-N70 PolarHBondContact N-O 3.08Å; C59-N70 WeakPolarHBondContact O-CB 3.42Å; C59-N70 VanDerWaalsContact SG-C 3.55Å; I68-N70 PolarHBondContact O-N 3.44Å
71	T	89.8	Confident	86.5	Confident	43 Å²	43	67.4 Å²	67.4	26%	0.264	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	128.7	-179.1	-55.1	0	0	0	0	108.8	C57 A67 I68 N69 F125	C57-T71 WeakPolarHBondContact O-CA 3.36Å; A67-T71 WeakPolarHBondContact CA-O 3.41Å; I68-T71 WeakPolarHBondContact O-CB 3.43Å; I68-T71 PolarHBondContact O-N 3.24Å; N69-T71 PolarHBondContact O-N 3.17Å; N69-T71 PolarHBondContact O-OG1 3.15Å; N69-T71 VanDerWaalsContact O-OG1 3.04Å; T71-F125 HydrophobicContact CG2-CE1 3.77Å; T71-F125 HydrophobicContact CG2-CZ 3.83Å
72	C	89.8	Confident	86.7	Confident	3 Å²	3	65 Å²	65	2%	0.02	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	156.9	173.9	63.1	0	0	0	0	109.9	S56 C57 C59 P64 C96	S56-C72 WeakPolarHBondContact CA-O 3.32Å; C57-C72 PolarHBondContact N-O 3.42Å; C57-C72 PolarHBondContact O-N 2.94Å; C59-C72 HydrophobicContact CB-CB 4.3Å; P64-C72 HydrophobicContact CG-CB 3.75Å; C72-C96 HydrophobicContact CB-CB 3.85Å; C72-C96 WeakPolarHBondContact CB-SG 3.45Å; C72-C96 PolarHBondContact O-SG 2.9Å; C72-C96 WeakPolarHBondContact SG-CB 3.49Å; C72-C96 PolarHBondContact SG-N 3.35Å; C72-C96 CovalentContact SG-SG 2.03Å; C72-C96 PolarHBondContact SG-SG 3.45Å
73	R	89.6	Confident	86.9	Confident	185 Å²	185	62.9 Å²	62.9	70%	0.698	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	137.3	177.4	-84.3	-178.2	156.3	-163.6	-5.5	111.8	L55	L55-R73 CarbonylContact O-C 3.56Å; L55-R73 VanDerWaalsContact O-CA 3.28Å; L55-R73 WeakPolarHBondContact O-CA 3.47Å
74	T	86.3	Confident	86.8	Confident	7 Å²	7	61.4 Å²	61.4	4%	0.043	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	152.8	178.1	-172.1	0	0	0	0	113.4	F54 L55 G76 C96 M97	F54-T74 CarbonylContact C-O 3.51Å; F54-T74 WeakPolarHBondContact CA-O 3.33Å; L55-T74 HydrophobicContact CB-CG2 4.38Å; L55-T74 PolarHBondContact N-O 2.73Å; L55-T74 PolarHBondContact O-N 2.95Å; T74-G76 PolarHBondContact OG1-N 2.91Å; T74-C96 HydrophobicContact CG2-CB 3.98Å; T74-M97 PolarHBondContact OG1-O 3.24Å
75	N	85.2	Confident	86.5	Confident	76 Å²	76	61.2 Å²	61.2	41%	0.406	32%	0.316	S	S	.	.	S	Bend	trans	-92.2	4.4	167.3	67.5	-23.7	0	0	0	113	F54 Y99	F54-N75 HydrophobicContact CD1-CB 4.47Å; F54-N75 HydrophobicContact CE1-CB 4.26Å; N75-Y99 PolarHBondContact OD1-N 2.74Å
76	G	87.5	Confident	86.2	Confident	12 Å²	12	60.2 Å²	60.2	12%	0.124	31%	0.311	C	S	.	.	S	Bend	trans	-104	-113.8	177.3	0	0	0	0	0	112.6	L55 T74 M97	L55-G76 WeakPolarHBondContact CD1-O 3.4Å; T74-G76 PolarHBondContact OG1-N 2.91Å; G76-M97 VanDerWaalsContact CA-O 3.25Å; G76-M97 WeakPolarHBondContact CA-O 3.24Å
77	Q	90.2	Very high	85.9	Confident	50 Å²	50	60.9 Å²	60.9	23%	0.234	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	153	-175.7	-67.7	-179.6	-49.6	0	0	111.2	M97 C106 C120	Q77-M97 PolarHBondContact N-O 2.83Å; Q77-M97 VanDerWaalsContact N-O 3.16Å; Q77-M97 WeakPolarHBondContact O-CB 3.34Å; Q77-M97 PolarHBondContact O-N 3.25Å; Q77-C106 PolarHBondContact OE1-SG 2.91Å; Q77-C120 HydrophobicContact CB-CB 4.37Å
78	C	91.9	Very high	85.3	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	146.2	166.7	-52.3	0	0	0	0	109	C57 C120 C121 N127	C57-C78 HydrophobicContact CB-CB 3.6Å; C57-C78 WeakPolarHBondContact CB-SG 3.39Å; C57-C78 WeakPolarHBondContact SG-CA 3.35Å; C57-C78 WeakPolarHBondContact SG-CB 3.35Å; C57-C78 CovalentContact SG-SG 2.02Å; C57-C78 PolarHBondContact SG-SG 3.36Å; C78-C120 CarbonylContact O-C 3.6Å; C78-C120 VanDerWaalsContact O-CA 3.23Å; C78-C120 WeakPolarHBondContact O-CA 2.96Å; C78-C121 PolarHBondContact N-O 3.04Å; C78-C121 PolarHBondContact O-N 3.39Å; C78-N127 HydrophobicContact CB-CB 3.89Å
79	F	92.5	Very high	85.3	Confident	20 Å²	20	61 Å²	61	9%	0.088	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	156.6	177.6	74.9	-88.7	0	0	0	112.9	H62 I81 S94 G95 M97 I118 E119 N127	H62-F79 HydrophobicContact CB-CZ 3.98Å; F79-I81 HydrophobicContact CD2-CB 4.24Å; F79-I81 HydrophobicContact CD2-CG2 4.22Å; F79-I81 HydrophobicContact CE2-CB 4.36Å; F79-I81 HydrophobicContact CE2-CG2 3.87Å; F79-S94 VanDerWaalsContact O-CA 3.3Å; F79-S94 WeakPolarHBondContact O-CA 3.46Å; F79-G95 VanDerWaalsContact CD1-C 3.48Å; F79-G95 WeakPolarHBondContact CD1-O 3.4Å; F79-G95 PolarHBondContact N-O 3.1Å; F79-G95 PolarHBondContact O-N 3.45Å; F79-G95 VanDerWaalsContact O-N 3.09Å; F79-M97 HydrophobicContact CD1-CB 4.13Å; F79-M97 HydrophobicContact CD1-CE 4.09Å; F79-M97 HydrophobicContact CG-CE 4.33Å; F79-I118 HydrophobicContact CB-CD1 4.11Å; F79-I118 HydrophobicContact CB-CG1 4.18Å; F79-I118 HydrophobicContact CD2-CD1 3.88Å; F79-I118 HydrophobicContact CD2-CG1 4.23Å; F79-I118 HydrophobicContact CG-CD1 4.12Å; F79-E119 CarbonylContact C-O 3.55Å; F79-E119 VanDerWaalsContact CA-O 3.24Å; F79-E119 WeakPolarHBondContact CA-O 3.45Å; F79-N127 PolarHBondContact O-ND2 3.14Å
80	A	91.2	Very high	85.1	Confident	2 Å²	2	58.7 Å²	58.7	2%	0.017	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.9	163.5	0	0	0	0	0	108.6	A93 E119 L130 P132	A80-A93 WeakPolarHBondContact CA-O 3.31Å; A80-E119 PolarHBondContact N-O 2.95Å; A80-E119 PolarHBondContact O-N 2.98Å; A80-L130 HydrophobicContact CB-CB 3.69Å; A80-L130 HydrophobicContact CB-CD1 4.03Å; A80-P132 HydrophobicContact CB-CG 4.39Å
81	I	89.6	Confident	85	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.087	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	138.7	-177.1	-168.2	172.6	0	0	0	110.4	F79 E83 L92 A93 T117 I118	F79-I81 HydrophobicContact CD2-CB 4.24Å; F79-I81 HydrophobicContact CD2-CG2 4.22Å; F79-I81 HydrophobicContact CE2-CB 4.36Å; F79-I81 HydrophobicContact CE2-CG2 3.87Å; I81-E83 HydrophobicContact CD1-CG 3.75Å; I81-E83 VanDerWaalsContact CD1-OE1 3.28Å; I81-E83 WeakPolarHBondContact CD1-OE1 3.5Å; I81-E83 HydrophobicContact CG1-CG 3.76Å; I81-L92 WeakPolarHBondContact O-CA 3.29Å; I81-L92 WeakPolarHBondContact O-CD1 3.41Å; I81-A93 HydrophobicContact CG2-CB 3.85Å; I81-A93 PolarHBondContact N-O 3.41Å; I81-A93 PolarHBondContact O-N 2.76Å; I81-T117 WeakPolarHBondContact CA-O 3.29Å; I81-T117 WeakPolarHBondContact CG1-O 3.43Å; I81-I118 HydrophobicContact CB-CB 4.27Å; I81-I118 HydrophobicContact CB-CG1 4.19Å; I81-I118 HydrophobicContact CD1-CB 4.12Å; I81-I118 HydrophobicContact CD1-CD1 4.37Å; I81-I118 HydrophobicContact CD1-CG1 4.5Å; I81-I118 HydrophobicContact CG1-CB 3.96Å; I81-I118 HydrophobicContact CG1-CG1 4.39Å
82	I	88.4	Confident	84.9	Confident	22 Å²	22	62.8 Å²	62.8	11%	0.113	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	124	170.7	-168.7	169.3	0	0	0	108.5	I90 Q91 L92 R116 T117 P132 L134	I82-I90 HydrophobicContact CD1-CG2 3.57Å; I82-I90 HydrophobicContact CG1-CG2 3.49Å; I82-I90 VanDerWaalsContact CG1-CG2 3.49Å; I82-Q91 WeakPolarHBondContact CA-O 3.26Å; I82-L92 HydrophobicContact CB-CD1 4.14Å; I82-R116 CarbonylContact O-C 3.59Å; I82-R116 VanDerWaalsContact O-CA 3.24Å; I82-R116 WeakPolarHBondContact O-CA 3.46Å; I82-T117 PolarHBondContact N-O 3.36Å; I82-T117 PolarHBondContact O-N 2.78Å; I82-P132 HydrophobicContact CB-CG 4.14Å; I82-P132 HydrophobicContact CG2-CB 3.86Å; I82-P132 HydrophobicContact CG2-CG 4.01Å; I82-L134 HydrophobicContact CD1-CG 4.09Å; I82-L134 HydrophobicContact CG1-CD2 4.22Å; I82-L134 HydrophobicContact CG1-CG 4.08Å; I82-L134 HydrophobicContact CG2-CD2 3.98Å; I82-L134 HydrophobicContact CG2-CG 4.19Å
83	E	86.3	Confident	84.9	Confident	63 Å²	63	63.3 Å²	63.3	29%	0.294	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.2	179.5	-53	-161.3	126.8	0	0	109.9	I81 Q91 R116	I81-E83 HydrophobicContact CD1-CG 3.75Å; I81-E83 VanDerWaalsContact CD1-OE1 3.28Å; I81-E83 WeakPolarHBondContact CD1-OE1 3.5Å; I81-E83 HydrophobicContact CG1-CG 3.76Å; E83-Q91 PolarHBondContact N-O 3.1Å; E83-Q91 PolarHBondContact O-N 2.81Å; E83-R116 HydrophobicContact CB-CB 4.33Å; E83-R116 HydrophobicContact CG-CB 3.74Å; E83-R116 VanDerWaalsContact OE1-CD 3.3Å; E83-R116 WeakPolarHBondContact OE1-CD 3.18Å
84	E	83.8	Confident	85	Confident	22 Å²	22	55 Å²	55	10%	0.103	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.4	169.7	-173.5	176.6	-169.7	0	0	108.5	E89 P114 R115 L134 R137	E84-E89 WeakPolarHBondContact CA-O 3.48Å; E84-P114 WeakPolarHBondContact O-CB 3.23Å; E84-R115 HydrophobicContact CB-CB 4.28Å; E84-R115 PolarHBondContact N-O 3.35Å; E84-R115 IonicContact OE1-NH1 3.69Å; E84-R115 VanDerWaalsContact OE2-CD 3.31Å; E84-R115 WeakPolarHBondContact OE2-CD 3.36Å; E84-R115 IonicContact OE2-CZ 3.93Å; E84-R115 IonicContact OE2-NE 3.37Å; E84-R115 IonicContact OE2-NH1 2.72Å; E84-R115 PolarHBondContact OE2-NH1 3.02Å; E84-L134 HydrophobicContact CB-CD1 4.22Å; E84-R137 IonicContact OE1-CZ 3.84Å; E84-R137 IonicContact OE1-NE 3.41Å; E84-R137 IonicContact OE1-NH2 3.93Å; E84-R137 PolarHBondContact OE1-NH2 2.75Å
85	D	76.1	Confident	85.2	Confident	49 Å²	49	54.6 Å²	54.6	26%	0.262	29%	0.291	S	S	.	.			trans	-74.5	173.6	179.3	73.8	13.9	0	0	0	112.5	N87 G88 E89 Q91	D85-N87 PolarHBondContact O-N 3.28Å; D85-N87 VanDerWaalsContact O-N 3.07Å; D85-N87 WeakPolarHBondContact OD1-CA 3.47Å; D85-N87 WeakPolarHBondContact OD1-CB 3.47Å; D85-N87 PolarHBondContact OD1-N 3.34Å; D85-G88 PolarHBondContact O-N 2.85Å; D85-G88 PolarHBondContact OD1-N 2.61Å; D85-E89 PolarHBondContact N-O 3.47Å; D85-E89 PolarHBondContact OD1-N 3.05Å; D85-Q91 PolarHBondContact OD2-NE2 2.93Å
86	D	73.6	Confident	85.5	Confident	162 Å²	162	52.5 Å²	52.5	87%	0.866	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.2	-179.8	-67.6	-32.4	0	0	0	113.3
87	N	73.9	Confident	85.5	Confident	145 Å²	145	52.5 Å²	52.5	78%	0.775	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-3.6	176.8	-60.3	-37.7	0	0	0	112.6	D85	D85-N87 PolarHBondContact O-N 3.28Å; D85-N87 VanDerWaalsContact O-N 3.07Å; D85-N87 WeakPolarHBondContact OD1-CA 3.47Å; D85-N87 WeakPolarHBondContact OD1-CB 3.47Å; D85-N87 PolarHBondContact OD1-N 3.34Å
88	G	70.6	Confident	85.2	Confident	34 Å²	34	58 Å²	58	35%	0.351	30%	0.302	S	S	.	.	S	Bend	trans	83	10.4	-178.2	0	0	0	0	0	114.4	D85	D85-G88 PolarHBondContact O-N 2.85Å; D85-G88 PolarHBondContact OD1-N 2.61Å
89	E	80.1	Confident	84.6	Confident	132 Å²	132	65.8 Å²	65.8	62%	0.617	33%	0.332	S	S	*	.			trans	-81.8	138.6	174.7	-69.9	-68.2	157	0	0	110.2	E84 D85	E84-E89 WeakPolarHBondContact CA-O 3.48Å; D85-E89 PolarHBondContact N-O 3.47Å; D85-E89 PolarHBondContact OD1-N 3.05Å
90	I	82.8	Confident	83.8	Confident	101 Å²	101	73.2 Å²	73.2	52%	0.518	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.9	-176.8	-60.5	177.1	0	0	0	108.8	I82 L134	I82-I90 HydrophobicContact CD1-CG2 3.57Å; I82-I90 HydrophobicContact CG1-CG2 3.49Å; I82-I90 VanDerWaalsContact CG1-CG2 3.49Å; I90-L134 HydrophobicContact CD1-CD1 3.78Å; I90-L134 HydrophobicContact CG1-CD1 3.85Å; I90-L134 HydrophobicContact CG2-CD1 4.25Å
91	Q	85.6	Confident	82.6	Confident	117 Å²	117	74.7 Å²	74.7	55%	0.547	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	128.7	176.8	-59.5	-172.6	17	0	0	110.2	I82 E83 D85	I82-Q91 WeakPolarHBondContact CA-O 3.26Å; E83-Q91 PolarHBondContact N-O 3.1Å; E83-Q91 PolarHBondContact O-N 2.81Å; D85-Q91 PolarHBondContact OD2-NE2 2.93Å
92	L	87.6	Confident	81.7	Confident	100 Å²	100	74.5 Å²	74.5	52%	0.524	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.6	172.2	-172.8	78.2	0	0	0	108.6	I81 I82 P132	I81-L92 WeakPolarHBondContact O-CA 3.29Å; I81-L92 WeakPolarHBondContact O-CD1 3.41Å; I82-L92 HydrophobicContact CB-CD1 4.14Å; L92-P132 HydrophobicContact CD1-CG 4.15Å
93	A	89.8	Confident	80.8	Confident	13 Å²	13	78.9 Å²	78.9	11%	0.107	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	157.8	174.8	0	0	0	0	0	110.8	S60 A80 I81	S60-A93 CarbonylContact O-C 3.52Å; S60-A93 VanDerWaalsContact O-CA 3.28Å; S60-A93 WeakPolarHBondContact O-CA 3.34Å; S60-A93 WeakPolarHBondContact O-CB 3.41Å; A80-A93 WeakPolarHBondContact CA-O 3.31Å; I81-A93 HydrophobicContact CG2-CB 3.85Å; I81-A93 PolarHBondContact N-O 3.41Å; I81-A93 PolarHBondContact O-N 2.76Å
94	S	91.6	Very high	80.2	Confident	10 Å²	10	83.8 Å²	83.8	7%	0.07	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	150.6	179.1	-59.9	0	0	0	0	109.6	C59 S60 F79	C59-S94 CarbonylContact C-O 3.58Å; C59-S94 VanDerWaalsContact CA-O 3.24Å; C59-S94 WeakPolarHBondContact CA-O 3.21Å; S60-S94 PolarHBondContact N-O 3.18Å; S60-S94 PolarHBondContact O-N 3.15Å; S60-S94 VanDerWaalsContact O-O 3.11Å; F79-S94 VanDerWaalsContact O-CA 3.3Å; F79-S94 WeakPolarHBondContact O-CA 3.46Å
95	G	91.4	Very high	79.8	Confident	0 Å²	0	88 Å²	88	0%	0	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179	-162.8	-179.5	0	0	0	0	0	115.1	F79	F79-G95 VanDerWaalsContact CD1-C 3.48Å; F79-G95 WeakPolarHBondContact CD1-O 3.4Å; F79-G95 PolarHBondContact N-O 3.1Å; F79-G95 PolarHBondContact O-N 3.45Å; F79-G95 VanDerWaalsContact O-N 3.09Å
96	C	90.3	Very high	79.8	Confident	32 Å²	32	87 Å²	87	22%	0.216	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.2	-175.8	-75.9	0	0	0	0	111.6	C57 C72 T74	C57-C96 VanDerWaalsContact CB-SG 3.51Å; C72-C96 HydrophobicContact CB-CB 3.85Å; C72-C96 WeakPolarHBondContact CB-SG 3.45Å; C72-C96 PolarHBondContact O-SG 2.9Å; C72-C96 WeakPolarHBondContact SG-CB 3.49Å; C72-C96 PolarHBondContact SG-N 3.35Å; C72-C96 CovalentContact SG-SG 2.03Å; C72-C96 PolarHBondContact SG-SG 3.45Å; T74-C96 HydrophobicContact CG2-CB 3.98Å
97	M	88	Confident	79.8	Confident	12 Å²	12	85.8 Å²	85.8	6%	0.059	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	134.6	176.6	-169.2	173.2	-73.8	0	0	110.9	T74 G76 Q77 F79 S102 Q105 I118	T74-M97 PolarHBondContact OG1-O 3.24Å; G76-M97 VanDerWaalsContact CA-O 3.25Å; G76-M97 WeakPolarHBondContact CA-O 3.24Å; Q77-M97 PolarHBondContact N-O 2.83Å; Q77-M97 VanDerWaalsContact N-O 3.16Å; Q77-M97 WeakPolarHBondContact O-CB 3.34Å; Q77-M97 PolarHBondContact O-N 3.25Å; F79-M97 HydrophobicContact CD1-CB 4.13Å; F79-M97 HydrophobicContact CD1-CE 4.09Å; F79-M97 HydrophobicContact CG-CE 4.33Å; M97-S102 VanDerWaalsContact SD-CA 3.58Å; M97-Q105 HydrophobicContact CE-CB 3.59Å; M97-Q105 HydrophobicContact CE-CG 4.49Å; M97-Q105 VanDerWaalsContact CE-OE1 3.26Å; M97-Q105 HydrophobicContact SD-CB 3.48Å; M97-Q105 WeakPolarHBondContact SD-CB 3.24Å; M97-Q105 HydrophobicContact SD-CG 4.34Å; M97-Q105 PolarHBondContact SD-OE1 2.64Å; M97-Q105 VanDerWaalsContact SD-OE1 3.36Å; M97-I118 HydrophobicContact CE-CD1 3.86Å
98	K	83.8	Confident	79.5	Confident	166 Å²	166	81.7 Å²	81.7	72%	0.722	40%	0.404	S	S	*	.			trans	-69.4	155.6	179.2	-65.6	-177.1	-179.9	179.3	0	111.4	E100 S102	K98-E100 VanDerWaalsContact C-N 3.34Å; K98-E100 PolarHBondContact O-N 2.98Å; K98-S102 WeakPolarHBondContact O-CB 3.24Å
99	Y	80.1	Confident	78.9	Confident	163 Å²	163	83 Å²	83	64%	0.639	41%	0.408	S	S	*	.	S	Bend	trans	-58.6	-40.3	180	-176.3	-97.3	0	0	0	113.8	N75 G101 S102	N75-Y99 PolarHBondContact OD1-N 2.74Å; Y99-G101 PolarHBondContact O-N 3.13Å; Y99-G101 VanDerWaalsContact O-N 3.14Å; Y99-S102 PolarHBondContact O-N 3.3Å; Y99-S102 PolarHBondContact O-OG 3.14Å; Y99-S102 VanDerWaalsContact O-OG 3.13Å
100	E	76.3	Confident	77.8	Confident	176 Å²	176	82.7 Å²	82.7	82%	0.822	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	111.4	179	-73.4	-176.2	165.7	0	0	111.5	K98	K98-E100 VanDerWaalsContact C-N 3.34Å; K98-E100 PolarHBondContact O-N 2.98Å
101	G	64.6	Low	76.5	Confident	33 Å²	33	84.8 Å²	84.8	34%	0.34	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	0.2	176.1	0	0	0	0	0	115.6	Y99 H103 F104 Q105	Y99-G101 PolarHBondContact O-N 3.13Å; Y99-G101 VanDerWaalsContact O-N 3.14Å; G101-H103 VanDerWaalsContact C-N 3.31Å; G101-H103 PolarHBondContact O-N 3.38Å; G101-F104 PolarHBondContact O-N 3.35Å; G101-F104 VanDerWaalsContact O-N 3.07Å; G101-Q105 PolarHBondContact O-N 3.43Å; G101-Q105 VanDerWaalsContact O-N 3.12Å
102	S	70.8	Confident	75	Confident	12 Å²	12	80.6 Å²	80.6	8%	0.084	42%	0.415	C	S	.	.	H	α-helix	trans	-56.2	-42.8	179.5	53.6	0	0	0	0	113	M97 K98 Y99 F104 Q105 C106	M97-S102 VanDerWaalsContact SD-CA 3.58Å; K98-S102 WeakPolarHBondContact O-CB 3.24Å; Y99-S102 PolarHBondContact O-N 3.3Å; Y99-S102 PolarHBondContact O-OG 3.14Å; Y99-S102 VanDerWaalsContact O-OG 3.13Å; S102-F104 PolarHBondContact O-N 2.99Å; S102-Q105 PolarHBondContact O-N 3.09Å; S102-Q105 VanDerWaalsContact O-N 3.13Å; S102-C106 WeakPolarHBondContact O-CB 3.38Å; S102-C106 PolarHBondContact O-N 2.81Å; S102-C106 PolarHBondContact O-SG 3.44Å
103	H	70.3	Confident	73.6	Confident	115 Å²	115	84.1 Å²	84.1	53%	0.532	43%	0.434	S	S	.	.	H	α-helix	trans	-61.6	-27.5	179.5	-177.5	-89.6	0	0	0	113.6	G101	G101-H103 VanDerWaalsContact C-N 3.31Å; G101-H103 PolarHBondContact O-N 3.38Å
104	F	73.1	Confident	72.5	Confident	166 Å²	166	86.1 Å²	86.1	73%	0.728	45%	0.446	S	S	*	.	H	α-helix	trans	-85.5	-34.7	175.7	-67.5	-74.3	0	0	0	112.2	G101 S102 K107	G101-F104 PolarHBondContact O-N 3.35Å; G101-F104 VanDerWaalsContact O-N 3.07Å; S102-F104 PolarHBondContact O-N 2.99Å; F104-K107 PolarHBondContact O-N 3.49Å
105	Q	75.3	Confident	71.6	Confident	110 Å²	110	88.8 Å²	88.8	51%	0.514	45%	0.454	S	S	.	.	H	α-helix	trans	-73.9	-29.2	179.3	-68.9	176.1	27.4	0	0	112.3	M97 G101 S102 K107 I118	M97-Q105 HydrophobicContact CE-CB 3.59Å; M97-Q105 HydrophobicContact CE-CG 4.49Å; M97-Q105 VanDerWaalsContact CE-OE1 3.26Å; M97-Q105 HydrophobicContact SD-CB 3.48Å; M97-Q105 WeakPolarHBondContact SD-CB 3.24Å; M97-Q105 HydrophobicContact SD-CG 4.34Å; M97-Q105 PolarHBondContact SD-OE1 2.64Å; M97-Q105 VanDerWaalsContact SD-OE1 3.36Å; G101-Q105 PolarHBondContact O-N 3.43Å; G101-Q105 VanDerWaalsContact O-N 3.12Å; S102-Q105 PolarHBondContact O-N 3.09Å; S102-Q105 VanDerWaalsContact O-N 3.13Å; Q105-K107 PolarHBondContact O-N 3.34Å; Q105-I118 WeakPolarHBondContact O-CG2 3.28Å
106	C	76.6	Confident	71.3	Confident	29 Å²	29	93.6 Å²	93.6	20%	0.196	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	7.7	174.6	-63.7	0	0	0	0	114.1	Q77 S102 C120	Q77-C106 PolarHBondContact OE1-SG 2.91Å; S102-C106 WeakPolarHBondContact O-CB 3.38Å; S102-C106 PolarHBondContact O-N 2.81Å; S102-C106 PolarHBondContact O-SG 3.44Å; C106-C120 VanDerWaalsContact CA-SG 3.59Å; C106-C120 HydrophobicContact CB-CB 3.61Å; C106-C120 WeakPolarHBondContact CB-SG 3.39Å; C106-C120 WeakPolarHBondContact SG-CB 3.43Å; C106-C120 CovalentContact SG-SG 2.02Å; C106-C120 PolarHBondContact SG-SG 3.08Å
107	K	73.6	Confident	71	Confident	136 Å²	136	93.3 Å²	93.3	59%	0.591	47%	0.469	S	S	*	.	S	Bend	trans	-112.7	113.5	171.1	-74.9	-172.4	-179.4	-173.2	0	109.1	F104 Q105	F104-K107 PolarHBondContact O-N 3.49Å; Q105-K107 PolarHBondContact O-N 3.34Å
108	D	66.8	Low	71	Confident	59 Å²	59	93.8 Å²	93.8	32%	0.316	47%	0.472	S	S	.	.			trans	-77.6	148.9	-179.4	-155.4	13.5	0	0	0	112.3	R116 T117 I118	D108-R116 IonicContact OD1-NE 3.66Å; D108-T117 VanDerWaalsContact OD2-CA 3.26Å; D108-T117 WeakPolarHBondContact OD2-CA 3.31Å; D108-I118 HydrophobicContact CB-CG2 4.47Å
109	S	59.5	Low	71.3	Confident	62 Å²	62	89.4 Å²	89.4	43%	0.434	45%	0.454	S	S	.	.			trans	-98.2	121.2	178.3	179.9	0	0	0	0	109.4	N111 A112	S109-N111 PolarHBondContact O-N 2.91Å; S109-A112 PolarHBondContact O-N 2.88Å; S109-A112 VanDerWaalsContact O-N 3.13Å
110	P	55.7	Low	71.7	Confident	124 Å²	124	83.3 Å²	83.3	81%	0.805	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-8.2	-177.6	24.6	-33.1	0	0	0	114.2
111	N	55	Low	72.3	Confident	145 Å²	145	75.9 Å²	75.9	78%	0.775	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	15.8	-178.6	-66.1	-26.4	0	0	0	113.1	S109 L113	S109-N111 PolarHBondContact O-N 2.91Å; N111-L113 PolarHBondContact O-N 2.85Å
112	A	54.6	Low	73.4	Confident	29 Å²	29	79.6 Å²	79.6	24%	0.24	41%	0.414	C	S	.	.			trans	-71.7	125.9	177	0	0	0	0	0	111	S109 P114 R116	S109-A112 PolarHBondContact O-N 2.88Å; S109-A112 VanDerWaalsContact O-N 3.13Å; A112-P114 CarbonylContact C-O 3.58Å; A112-P114 CarbonylContact O-C 3.5Å; A112-P114 VanDerWaalsContact O-O 3.12Å; A112-R116 HydrophobicContact CB-CG 4.43Å
113	L	58.7	Low	74.2	Confident	175 Å²	175	82.8 Å²	82.8	92%	0.916	43%	0.433	S	S	*	.	S	Bend	trans	-104.2	117.4	161.3	-81.3	152.1	0	0	0	105.4	N111	N111-L113 PolarHBondContact O-N 2.85Å
114	P	66.1	Low	75.1	Confident	55 Å²	55	81.2 Å²	81.2	36%	0.357	43%	0.429	S	S	.	.	S	Bend	cis	-82.7	166.2	11.1	31.4	-35	0	0	0	116.1	E84 A112 R116	E84-P114 WeakPolarHBondContact O-CB 3.23Å; A112-P114 CarbonylContact C-O 3.58Å; A112-P114 CarbonylContact O-C 3.5Å; A112-P114 VanDerWaalsContact O-O 3.12Å; P114-R116 PolarHBondContact O-N 2.67Å
115	R	74.1	Confident	75.9	Confident	65 Å²	65	77.4 Å²	77.4	25%	0.245	41%	0.412	C	S	.	.			trans	-60.8	107.9	174.6	-78.7	173.2	69.6	-143.2	4.4	108.6	E84 L134 P135	E84-R115 HydrophobicContact CB-CB 4.28Å; E84-R115 PolarHBondContact N-O 3.35Å; E84-R115 IonicContact OE1-NH1 3.69Å; E84-R115 VanDerWaalsContact OE2-CD 3.31Å; E84-R115 WeakPolarHBondContact OE2-CD 3.36Å; E84-R115 IonicContact OE2-CZ 3.93Å; E84-R115 IonicContact OE2-NE 3.37Å; E84-R115 IonicContact OE2-NH1 2.72Å; E84-R115 PolarHBondContact OE2-NH1 3.02Å; R115-L134 HydrophobicContact CB-CD2 4.28Å; R115-L134 WeakPolarHBondContact O-CD2 3.43Å; R115-P135 HydrophobicContact CG-CG 4.42Å; R115-P135 PolarHBondContact NE-O 2.7Å; R115-P135 PolarHBondContact NH2-O 3.1Å
116	R	84	Confident	76.6	Confident	102 Å²	102	72.9 Å²	72.9	39%	0.385	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	158.8	176.7	66.5	179.3	-172.8	-155	1.2	110.8	I82 E83 D108 A112 P114	I82-R116 CarbonylContact O-C 3.59Å; I82-R116 VanDerWaalsContact O-CA 3.24Å; I82-R116 WeakPolarHBondContact O-CA 3.46Å; E83-R116 HydrophobicContact CB-CB 4.33Å; E83-R116 HydrophobicContact CG-CB 3.74Å; E83-R116 VanDerWaalsContact OE1-CD 3.3Å; E83-R116 WeakPolarHBondContact OE1-CD 3.18Å; D108-R116 IonicContact OD1-NE 3.66Å; A112-R116 HydrophobicContact CB-CG 4.43Å; P114-R116 PolarHBondContact O-N 2.67Å
117	T	84.8	Confident	77.3	Confident	25 Å²	25	71.6 Å²	71.6	15%	0.153	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	127.7	167.9	-60.1	0	0	0	0	110.1	I81 I82 D108 P132 T133	I81-T117 WeakPolarHBondContact CA-O 3.29Å; I81-T117 WeakPolarHBondContact CG1-O 3.43Å; I82-T117 PolarHBondContact N-O 3.36Å; I82-T117 PolarHBondContact O-N 2.78Å; D108-T117 VanDerWaalsContact OD2-CA 3.26Å; D108-T117 WeakPolarHBondContact OD2-CA 3.31Å; T117-P132 HydrophobicContact CG2-CB 4.13Å; T117-T133 PolarHBondContact OG1-O 2.95Å
118	I	88.4	Confident	78	Confident	22 Å²	22	70.3 Å²	70.3	11%	0.113	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.5	178.7	-172.8	169.9	0	0	0	110.4	F79 I81 M97 Q105 D108	F79-I118 HydrophobicContact CB-CD1 4.11Å; F79-I118 HydrophobicContact CB-CG1 4.18Å; F79-I118 HydrophobicContact CD2-CD1 3.88Å; F79-I118 HydrophobicContact CD2-CG1 4.23Å; F79-I118 HydrophobicContact CG-CD1 4.12Å; I81-I118 HydrophobicContact CB-CB 4.27Å; I81-I118 HydrophobicContact CB-CG1 4.19Å; I81-I118 HydrophobicContact CD1-CB 4.12Å; I81-I118 HydrophobicContact CD1-CD1 4.37Å; I81-I118 HydrophobicContact CD1-CG1 4.5Å; I81-I118 HydrophobicContact CG1-CB 3.96Å; I81-I118 HydrophobicContact CG1-CG1 4.39Å; M97-I118 HydrophobicContact CE-CD1 3.86Å; Q105-I118 WeakPolarHBondContact O-CG2 3.28Å; D108-I118 HydrophobicContact CB-CG2 4.47Å
119	E	88.4	Confident	78.8	Confident	75 Å²	75	73.8 Å²	73.8	35%	0.35	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.5	172.4	-72.6	-178.2	-168.1	0	0	109.8	F79 A80 L130 P132	F79-E119 CarbonylContact C-O 3.55Å; F79-E119 VanDerWaalsContact CA-O 3.24Å; F79-E119 WeakPolarHBondContact CA-O 3.45Å; A80-E119 PolarHBondContact N-O 2.95Å; A80-E119 PolarHBondContact O-N 2.98Å; E119-L130 HydrophobicContact CB-CD1 4.06Å; E119-L130 HydrophobicContact CB-CD2 4.34Å; E119-L130 WeakPolarHBondContact O-CD1 3.09Å; E119-P132 HydrophobicContact CG-CB 4.15Å
120	C	90.4	Very high	80.2	Confident	35 Å²	35	72.3 Å²	72.3	24%	0.236	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150	-177.9	-61.4	0	0	0	0	112.1	Q77 C78 C106	Q77-C120 HydrophobicContact CB-CB 4.37Å; C78-C120 CarbonylContact O-C 3.6Å; C78-C120 VanDerWaalsContact O-CA 3.23Å; C78-C120 WeakPolarHBondContact O-CA 2.96Å; C106-C120 VanDerWaalsContact CA-SG 3.59Å; C106-C120 HydrophobicContact CB-CB 3.61Å; C106-C120 WeakPolarHBondContact CB-SG 3.39Å; C106-C120 WeakPolarHBondContact SG-CB 3.43Å; C106-C120 CovalentContact SG-SG 2.02Å; C106-C120 PolarHBondContact SG-SG 3.08Å
121	C	87.9	Confident	81.5	Confident	20 Å²	20	74.6 Å²	74.6	14%	0.135	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	167.4	-178.7	59.7	0	0	0	0	111.3	C78 C126 N127 L130	C78-C121 PolarHBondContact N-O 3.04Å; C78-C121 PolarHBondContact O-N 3.39Å; C121-C126 HydrophobicContact CB-CB 3.71Å; C121-C126 WeakPolarHBondContact CB-SG 3.31Å; C121-C126 WeakPolarHBondContact SG-CB 3.28Å; C121-C126 CovalentContact SG-SG 2Å; C121-C126 PolarHBondContact SG-SG 2.89Å; C121-N127 PolarHBondContact SG-N 3.05Å; C121-N127 VanDerWaalsContact SG-N 3.37Å; C121-L130 HydrophobicContact CB-CD1 4.33Å
122	N	87.6	Confident	82.9	Confident	111 Å²	111	68 Å²	68	59%	0.594	34%	0.343	S	S	*	.			trans	-131.2	24.2	-163.9	66.1	-13	0	0	0	115	L55	L55-N122 WeakPolarHBondContact CD2-O 2.99Å
123	T	86.8	Confident	84.2	Confident	78 Å²	78	71.8 Å²	71.8	48%	0.479	36%	0.364	S	S	.	.	S	Bend	trans	-124.4	159.7	172.7	59	0	0	0	0	110.7	F125 C126	T123-F125 PolarHBondContact O-N 3.14Å; T123-C126 VanDerWaalsContact O-CB 3.31Å; T123-C126 WeakPolarHBondContact O-CB 3.41Å; T123-C126 PolarHBondContact O-N 2.62Å; T123-C126 PolarHBondContact O-SG 3.41Å; T123-C126 VanDerWaalsContact OG1-CB 3.28Å; T123-C126 WeakPolarHBondContact OG1-CB 3.28Å
124	D	90.6	Very high	85.2	Confident	82 Å²	82	65 Å²	65	44%	0.439	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	132.1	-179.6	-67	-47.4	0	0	0	110.8	L55 S56 C126	L55-D124 WeakPolarHBondContact CA-OD1 3.32Å; S56-D124 PolarHBondContact N-OD1 2.73Å; S56-D124 CarbonylContact O-C 3.51Å; S56-D124 WeakPolarHBondContact O-CA 3.41Å; D124-C126 PolarHBondContact O-N 3.4Å
125	F	90.3	Very high	85.5	Confident	86 Å²	86	65 Å²	65	38%	0.377	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	16.3	-179.8	-57.3	-81.9	0	0	0	116	S56 T71 T123 N127 E128	S56-F125 PolarHBondContact O-N 2.88Å; T71-F125 HydrophobicContact CG2-CE1 3.77Å; T71-F125 HydrophobicContact CG2-CZ 3.83Å; T123-F125 PolarHBondContact O-N 3.14Å; F125-N127 PolarHBondContact O-N 3.29Å; F125-E128 WeakPolarHBondContact O-CB 3.34Å; F125-E128 PolarHBondContact O-N 3.24Å; F125-E128 VanDerWaalsContact O-N 3.14Å
126	C	89.4	Confident	85.3	Confident	16 Å²	16	67.4 Å²	67.4	11%	0.108	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-60.9	-22.8	-176	62.4	0	0	0	0	114.9	C121 T123 D124 E128 D129	C121-C126 HydrophobicContact CB-CB 3.71Å; C121-C126 WeakPolarHBondContact CB-SG 3.31Å; C121-C126 WeakPolarHBondContact SG-CB 3.28Å; C121-C126 CovalentContact SG-SG 2Å; C121-C126 PolarHBondContact SG-SG 2.89Å; T123-C126 VanDerWaalsContact O-CB 3.31Å; T123-C126 WeakPolarHBondContact O-CB 3.41Å; T123-C126 PolarHBondContact O-N 2.62Å; T123-C126 PolarHBondContact O-SG 3.41Å; T123-C126 VanDerWaalsContact OG1-CB 3.28Å; T123-C126 WeakPolarHBondContact OG1-CB 3.28Å; D124-C126 PolarHBondContact O-N 3.4Å; C126-E128 VanDerWaalsContact C-N 3.25Å; C126-E128 PolarHBondContact O-N 2.68Å; C126-D129 PolarHBondContact O-N 2.88Å
127	N	91.1	Very high	84.4	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.011	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-78.3	-8.1	-178.1	63.8	-34.8	0	0	0	113.8	Y58 C78 F79 C121 F125 D129 L130	Y58-N127 PolarHBondContact N-OD1 3.39Å; Y58-N127 VanDerWaalsContact N-OD1 3.09Å; Y58-N127 PolarHBondContact O-ND2 2.75Å; C78-N127 HydrophobicContact CB-CB 3.89Å; F79-N127 PolarHBondContact O-ND2 3.14Å; C121-N127 PolarHBondContact SG-N 3.05Å; C121-N127 VanDerWaalsContact SG-N 3.37Å; F125-N127 PolarHBondContact O-N 3.29Å; N127-D129 PolarHBondContact O-N 3.06Å; N127-L130 HydrophobicContact CB-CD1 4.03Å; N127-L130 PolarHBondContact O-N 2.9Å
128	E	87.5	Confident	83.1	Confident	108 Å²	108	76 Å²	76	51%	0.505	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-68.2	-27.3	172.7	-164.2	169.8	-151.5	0	0	112.1	F125 C126 R131	F125-E128 WeakPolarHBondContact O-CB 3.34Å; F125-E128 PolarHBondContact O-N 3.24Å; F125-E128 VanDerWaalsContact O-N 3.14Å; C126-E128 VanDerWaalsContact C-N 3.25Å; C126-E128 PolarHBondContact O-N 2.68Å; E128-R131 PolarHBondContact O-NH1 3.46Å; E128-R131 PolarHBondContact O-NH2 3.4Å
129	D	85	Confident	81	Confident	133 Å²	133	80 Å²	80	71%	0.711	43%	0.425	S	S	*	.	S	Bend	trans	-93.6	-10.9	-179.9	-66.2	-43.3	0	0	0	113.7	C126 N127	C126-D129 PolarHBondContact O-N 2.88Å; N127-D129 PolarHBondContact O-N 3.06Å
130	L	87.4	Confident	78.9	Confident	31 Å²	31	82.6 Å²	82.6	16%	0.162	45%	0.447	C	S	.	.			trans	-70.8	139.8	179.8	-66.6	178.7	0	0	0	111.2	A80 E119 C121 N127	A80-L130 HydrophobicContact CB-CB 3.69Å; A80-L130 HydrophobicContact CB-CD1 4.03Å; E119-L130 HydrophobicContact CB-CD1 4.06Å; E119-L130 HydrophobicContact CB-CD2 4.34Å; E119-L130 WeakPolarHBondContact O-CD1 3.09Å; C121-L130 HydrophobicContact CB-CD1 4.33Å; N127-L130 HydrophobicContact CB-CD1 4.03Å; N127-L130 PolarHBondContact O-N 2.9Å
131	R	84.3	Confident	76.5	Confident	171 Å²	171	89.3 Å²	89.3	65%	0.645	48%	0.475	S	S	*	.			trans	-138.2	68.4	-177.7	-62.2	-67.9	179.7	-94.3	-4.3	110.1	E128	E128-R131 PolarHBondContact O-NH1 3.46Å; E128-R131 PolarHBondContact O-NH2 3.4Å
132	P	83.8	Confident	74.6	Confident	7 Å²	7	94 Å²	94	5%	0.045	51%	0.508	C	S	.	.			trans	-63.6	148.2	179.8	28.2	-35.1	0	0	0	111.1	A80 I82 L92 T117 E119	A80-P132 HydrophobicContact CB-CG 4.39Å; I82-P132 HydrophobicContact CB-CG 4.14Å; I82-P132 HydrophobicContact CG2-CB 3.86Å; I82-P132 HydrophobicContact CG2-CG 4.01Å; L92-P132 HydrophobicContact CD1-CG 4.15Å; T117-P132 HydrophobicContact CG2-CB 4.13Å; E119-P132 HydrophobicContact CG-CB 4.15Å
133	T	81.3	Confident	73	Confident	109 Å²	109	92.8 Å²	92.8	67%	0.669	51%	0.508	S	S	*	.			trans	-124.3	141.6	-179.4	57	0	0	0	0	111.4	T117	T117-T133 PolarHBondContact OG1-O 2.95Å
134	L	79.3	Confident	71.7	Confident	32 Å²	32	93.2 Å²	93.2	17%	0.168	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-70.5	140	-178.1	-69.9	170.5	0	0	0	112.1	I82 E84 I90 R115	I82-L134 HydrophobicContact CD1-CG 4.09Å; I82-L134 HydrophobicContact CG1-CD2 4.22Å; I82-L134 HydrophobicContact CG1-CG 4.08Å; I82-L134 HydrophobicContact CG2-CD2 3.98Å; I82-L134 HydrophobicContact CG2-CG 4.19Å; E84-L134 HydrophobicContact CB-CD1 4.22Å; I90-L134 HydrophobicContact CD1-CD1 3.78Å; I90-L134 HydrophobicContact CG1-CD1 3.85Å; I90-L134 HydrophobicContact CG2-CD1 4.25Å; R115-L134 HydrophobicContact CB-CD2 4.28Å; R115-L134 WeakPolarHBondContact O-CD2 3.43Å
135	P	72.5	Confident	70.2	Confident	56 Å²	56	97.2 Å²	97.2	36%	0.364	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-66.2	146.4	-180	26.7	-34.3	0	0	0	111.5	R115	R115-P135 HydrophobicContact CG-CG 4.42Å; R115-P135 PolarHBondContact NE-O 2.7Å; R115-P135 PolarHBondContact NH2-O 3.1Å
136	P	70.6	Confident	68.7	Low	115 Å²	115	102 Å²	102	75%	0.747	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-61	143.1	-175.8	24.3	-33.3	0	0	0	113	V138	P136-V138 PolarHBondContact O-N 3.4Å
137	R	65.4	Low	67.5	Low	180 Å²	180	106.5 Å²	106.5	68%	0.679	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-68.5	117.2	176.7	-69.6	-175.8	176.8	174.2	-1.1	109.8	E84 S139	E84-R137 IonicContact OE1-CZ 3.84Å; E84-R137 IonicContact OE1-NE 3.41Å; E84-R137 IonicContact OE1-NH2 3.93Å; E84-R137 PolarHBondContact OE1-NH2 2.75Å; R137-S139 PolarHBondContact O-N 3.39Å
138	V	57.6	Low	66.4	Low	127 Å²	127	109 Å²	109	77%	0.77	59%	0.589	S	S	*	*			trans	-82.1	103.2	175	-175.9	0	0	0	0	109	P136 T140	P136-V138 PolarHBondContact O-N 3.4Å; V138-T140 PolarHBondContact O-N 3.44Å
139	S	44.9	Very low	65.7	Low	105 Å²	105	109.8 Å²	109.8	73%	0.734	59%	0.591	S	S	*	*			trans	-71.9	107.8	170.2	51.5	0	0	0	0	109.8	R137 E141	R137-S139 PolarHBondContact O-N 3.39Å; S139-E141 PolarHBondContact O-N 3.06Å
140	T	43.9	Very low	65.2	Low	131 Å²	131	108.1 Å²	108.1	80%	0.804	58%	0.581	S	S	*	*			trans	-84.1	89.1	173.6	21.7	0	0	0	0	109.9	V138 S142	V138-T140 PolarHBondContact O-N 3.44Å; T140-S142 PolarHBondContact O-N 3.48Å
141	E	39.9	Very low	65	Low	176 Å²	176	110.7 Å²	110.7	82%	0.822	59%	0.594	S	S	*	*			trans	-74.6	118.6	165.2	-80.9	-170.5	153.3	0	0	110.6	S139 S143	S139-E141 PolarHBondContact O-N 3.06Å; E141-S143 PolarHBondContact O-N 3.4Å
142	S	47.4	Very low	64.9	Low	119 Å²	119	106 Å²	106	83%	0.832	59%	0.587	S	S	*	*	S	Bend	trans	7.1	69	152.1	179.6	0	0	0	0	118.5	T140	T140-S142 PolarHBondContact O-N 3.48Å
143	S	54.3	Low	64.9	Low	84 Å²	84	110 Å²	110	59%	0.587	61%	0.606	S	S	*	*			trans	-128.8	-6.6	172	176.6	0	0	0	0	114.1	E141	E141-S143 PolarHBondContact O-N 3.4Å
144	S	58.6	Low	65	Low	88 Å²	88	108.5 Å²	108.5	62%	0.615	60%	0.597	S	S	*	*	H	α-helix	trans	-86.1	-29.2	-167.8	-51.3	0	0	0	0	114.3	A148	S144-A148 WeakPolarHBondContact O-CB 3.37Å; S144-A148 PolarHBondContact O-N 2.89Å
145	H	59.5	Low	65.4	Low	165 Å²	165	111.8 Å²	111.8	76%	0.764	61%	0.614	S	S	*	*	H	α-helix	trans	-73	-38.4	-177.1	-70.4	-78.7	0	0	0	113.4	A148 F149	H145-A148 PolarHBondContact O-N 2.62Å; H145-F149 WeakPolarHBondContact O-CB 3.42Å; H145-F149 PolarHBondContact O-N 3.41Å
146	W	59.5	Low	66.2	Low	188 Å²	188	111.8 Å²	111.8	71%	0.712	62%	0.615	S	S	*	*	H	α-helix	trans	-68.5	-37.6	178.3	-78.5	103.3	0	0	0	112.4	F149 I150	W146-F149 PolarHBondContact O-N 3.28Å; W146-I150 VanDerWaalsContact O-CG1 3.3Å; W146-I150 WeakPolarHBondContact O-CG1 3.48Å; W146-I150 PolarHBondContact O-N 2.93Å; W146-I150 VanDerWaalsContact O-N 3.09Å
147	L	62.8	Low	67.1	Low	109 Å²	109	109.5 Å²	109.5	57%	0.571	60%	0.6	S	S	*	*	H	α-helix	trans	-66.9	-43.9	176.6	-150.8	84.2	0	0	0	111.2	F149 I150 I151	L147-F149 VanDerWaalsContact C-N 3.33Å; L147-F149 PolarHBondContact O-N 3.23Å; L147-I150 PolarHBondContact O-N 3.38Å; L147-I151 HydrophobicContact CD2-CD1 4.28Å; L147-I151 HydrophobicContact CG-CD1 4.21Å; L147-I151 WeakPolarHBondContact O-CB 3.47Å; L147-I151 WeakPolarHBondContact O-CD1 3.22Å; L147-I151 WeakPolarHBondContact O-CG1 3.42Å; L147-I151 PolarHBondContact O-N 3.11Å
148	A	68.9	Low	68.2	Low	56 Å²	56	104.5 Å²	104.5	46%	0.463	59%	0.592	S	S	.	*	H	α-helix	trans	-62.1	-39.4	176.5	0	0	0	0	0	112.3	S144 H145 I151 S152	S144-A148 WeakPolarHBondContact O-CB 3.37Å; S144-A148 PolarHBondContact O-N 2.89Å; H145-A148 PolarHBondContact O-N 2.62Å; A148-I151 PolarHBondContact O-N 3.14Å; A148-S152 WeakPolarHBondContact O-CB 3.28Å; A148-S152 PolarHBondContact O-N 3.15Å
149	F	72.8	Confident	69.6	Low	124 Å²	124	101.7 Å²	101.7	54%	0.544	58%	0.576	S	S	.	*	H	α-helix	trans	-64.3	-44.2	176	-176.1	-99.1	0	0	0	112.3	H145 W146 L147 S152 M153	H145-F149 WeakPolarHBondContact O-CB 3.42Å; H145-F149 PolarHBondContact O-N 3.41Å; W146-F149 PolarHBondContact O-N 3.28Å; L147-F149 VanDerWaalsContact C-N 3.33Å; L147-F149 PolarHBondContact O-N 3.23Å; F149-S152 PolarHBondContact O-N 3.13Å; F149-M153 HydrophobicContact CE1-CG 4.06Å; F149-M153 HydrophobicContact CZ-CG 4.07Å; F149-M153 WeakPolarHBondContact O-CB 3.3Å; F149-M153 PolarHBondContact O-N 3.35Å
150	I	75.6	Confident	71.8	Confident	98 Å²	98	101.7 Å²	101.7	50%	0.503	57%	0.567	S	S	.	*	H	α-helix	trans	-65.6	-40.6	178	-67.2	168.6	0	0	0	111.1	W146 L147 M153 T154	W146-I150 VanDerWaalsContact O-CG1 3.3Å; W146-I150 WeakPolarHBondContact O-CG1 3.48Å; W146-I150 PolarHBondContact O-N 2.93Å; W146-I150 VanDerWaalsContact O-N 3.09Å; L147-I150 PolarHBondContact O-N 3.38Å; I150-M153 PolarHBondContact O-N 3.23Å; I150-T154 PolarHBondContact O-N 3.15Å; I150-T154 PolarHBondContact O-OG1 2.87Å
151	I	81.4	Confident	74.1	Confident	85 Å²	85	100 Å²	100	44%	0.436	55%	0.552	S	S	.	*	H	α-helix	trans	-64.2	-44.4	175.9	-67.1	165	0	0	0	110.5	L147 A148 M153 T154 I155	L147-I151 HydrophobicContact CD2-CD1 4.28Å; L147-I151 HydrophobicContact CG-CD1 4.21Å; L147-I151 WeakPolarHBondContact O-CB 3.47Å; L147-I151 WeakPolarHBondContact O-CD1 3.22Å; L147-I151 WeakPolarHBondContact O-CG1 3.42Å; L147-I151 PolarHBondContact O-N 3.11Å; A148-I151 PolarHBondContact O-N 3.14Å; I151-M153 PolarHBondContact O-N 3.12Å; I151-T154 WeakPolarHBondContact CA-OG1 3.49Å; I151-T154 PolarHBondContact O-N 3.4Å; I151-T154 PolarHBondContact O-OG1 2.96Å; I151-I155 HydrophobicContact CG2-CD1 3.79Å; I151-I155 HydrophobicContact CG2-CG1 4.47Å; I151-I155 VanDerWaalsContact O-CG1 3.29Å; I151-I155 WeakPolarHBondContact O-CG1 3.23Å; I151-I155 PolarHBondContact O-N 3.14Å
152	S	82.4	Confident	76.4	Confident	72 Å²	72	95.3 Å²	95.3	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-63.3	-41.4	177.8	-172.6	0	0	0	0	112.3	A148 F149 C156	A148-S152 WeakPolarHBondContact O-CB 3.28Å; A148-S152 PolarHBondContact O-N 3.15Å; F149-S152 PolarHBondContact O-N 3.13Å; S152-C156 WeakPolarHBondContact O-CB 3.02Å; S152-C156 PolarHBondContact O-N 3.28Å
153	M	84	Confident	78.5	Confident	90 Å²	90	94.2 Å²	94.2	44%	0.443	52%	0.522	S	S	.	.	H	α-helix	trans	-66.4	-42	177	-85.4	-70.2	104	0	0	112.3	F149 I150 I151 C156 C157	F149-M153 HydrophobicContact CE1-CG 4.06Å; F149-M153 HydrophobicContact CZ-CG 4.07Å; F149-M153 WeakPolarHBondContact O-CB 3.3Å; F149-M153 PolarHBondContact O-N 3.35Å; I150-M153 PolarHBondContact O-N 3.23Å; I151-M153 PolarHBondContact O-N 3.12Å; M153-C156 HydrophobicContact CE-CB 4.46Å; M153-C156 PolarHBondContact O-N 2.83Å; M153-C157 WeakPolarHBondContact O-CB 3.49Å; M153-C157 PolarHBondContact O-N 2.51Å; M153-C157 PolarHBondContact O-SG 3.24Å
154	T	83.4	Confident	80.1	Confident	78 Å²	78	93.4 Å²	93.4	48%	0.479	52%	0.516	S	S	.	.	H	α-helix	trans	-65.7	-41.4	177	36.9	0	0	0	0	112.3	I150 I151 C156 C157 C158	I150-T154 PolarHBondContact O-N 3.15Å; I150-T154 PolarHBondContact O-OG1 2.87Å; I151-T154 WeakPolarHBondContact CA-OG1 3.49Å; I151-T154 PolarHBondContact O-N 3.4Å; I151-T154 PolarHBondContact O-OG1 2.96Å; T154-C156 PolarHBondContact O-N 3.03Å; T154-C157 PolarHBondContact O-N 3Å; T154-C158 WeakPolarHBondContact O-CB 3.48Å; T154-C158 PolarHBondContact O-N 3.13Å; T154-C158 PolarHBondContact O-SG 3.26Å
155	I	89.1	Confident	81.6	Confident	102 Å²	102	93 Å²	93	52%	0.523	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-45.9	174.2	-67.3	168.2	0	0	0	110.4	I151 C157 C158 T159	I151-I155 HydrophobicContact CG2-CD1 3.79Å; I151-I155 HydrophobicContact CG2-CG1 4.47Å; I151-I155 VanDerWaalsContact O-CG1 3.29Å; I151-I155 WeakPolarHBondContact O-CG1 3.23Å; I151-I155 PolarHBondContact O-N 3.14Å; I155-C157 PolarHBondContact O-N 3.44Å; I155-C158 PolarHBondContact O-N 2.9Å; I155-T159 HydrophobicContact CG2-CG2 4.34Å; I155-T159 VanDerWaalsContact O-CG2 3.32Å; I155-T159 WeakPolarHBondContact O-CG2 3.45Å; I155-T159 PolarHBondContact O-N 3.24Å; I155-T159 PolarHBondContact O-OG1 3.34Å
156	C	89	Confident	83.1	Confident	56 Å²	56	88.6 Å²	88.6	38%	0.378	49%	0.491	S	S	.	.	H	α-helix	trans	-61.3	-46.4	179.2	-163.1	0	0	0	0	111.5	S152 M153 T154 C158 T159 L160	S152-C156 WeakPolarHBondContact O-CB 3.02Å; S152-C156 PolarHBondContact O-N 3.28Å; M153-C156 HydrophobicContact CE-CB 4.46Å; M153-C156 PolarHBondContact O-N 2.83Å; T154-C156 PolarHBondContact O-N 3.03Å; C156-C158 PolarHBondContact O-N 3.49Å; C156-T159 WeakPolarHBondContact CA-OG1 3.5Å; C156-T159 PolarHBondContact O-N 3.13Å; C156-T159 PolarHBondContact O-OG1 3.07Å; C156-L160 WeakPolarHBondContact O-CG 3.37Å; C156-L160 PolarHBondContact O-N 2.99Å
157	C	88	Confident	84.6	Confident	66 Å²	66	86.6 Å²	86.6	45%	0.446	49%	0.488	S	S	.	.	H	α-helix	trans	-60.8	-43.7	175.2	-69	0	0	0	0	112.5	M153 T154 I155 T159 L160 I161	M153-C157 WeakPolarHBondContact O-CB 3.49Å; M153-C157 PolarHBondContact O-N 2.51Å; M153-C157 PolarHBondContact O-SG 3.24Å; T154-C157 PolarHBondContact O-N 3Å; I155-C157 PolarHBondContact O-N 3.44Å; C157-T159 PolarHBondContact O-N 3.08Å; C157-L160 PolarHBondContact O-N 3.35Å; C157-I161 VanDerWaalsContact O-CG1 3.27Å; C157-I161 WeakPolarHBondContact O-CG1 3.2Å; C157-I161 PolarHBondContact O-N 2.9Å
158	C	88.9	Confident	85.9	Confident	75 Å²	75	87.9 Å²	87.9	51%	0.507	49%	0.486	S	S	.	.	H	α-helix	trans	-62.2	-42.3	176.4	-72.2	0	0	0	0	111.8	T154 I155 C156 L160 I161 C162	T154-C158 WeakPolarHBondContact O-CB 3.48Å; T154-C158 PolarHBondContact O-N 3.13Å; T154-C158 PolarHBondContact O-SG 3.26Å; I155-C158 PolarHBondContact O-N 2.9Å; C156-C158 PolarHBondContact O-N 3.49Å; C158-L160 PolarHBondContact O-N 3.36Å; C158-I161 PolarHBondContact O-N 3.43Å; C158-C162 WeakPolarHBondContact O-CB 3.45Å; C158-C162 PolarHBondContact O-N 3.3Å; C158-C162 PolarHBondContact O-SG 3.5Å; C158-C162 VanDerWaalsContact O-SG 3.4Å
159	T	88.1	Confident	86.6	Confident	69 Å²	69	92 Å²	92	42%	0.423	49%	0.49	S	S	.	.	H	α-helix	trans	-64.2	-40.3	176.8	59.7	0	0	0	0	112.2	I155 C156 C157 C162 L163	I155-T159 HydrophobicContact CG2-CG2 4.34Å; I155-T159 VanDerWaalsContact O-CG2 3.32Å; I155-T159 WeakPolarHBondContact O-CG2 3.45Å; I155-T159 PolarHBondContact O-N 3.24Å; I155-T159 PolarHBondContact O-OG1 3.34Å; C156-T159 WeakPolarHBondContact CA-OG1 3.5Å; C156-T159 PolarHBondContact O-N 3.13Å; C156-T159 PolarHBondContact O-OG1 3.07Å; C157-T159 PolarHBondContact O-N 3.08Å; T159-C162 PolarHBondContact O-N 3.39Å; T159-L163 WeakPolarHBondContact O-CB 3.42Å; T159-L163 VanDerWaalsContact O-CG 3.26Å; T159-L163 WeakPolarHBondContact O-CG 3.47Å; T159-L163 PolarHBondContact O-N 3.47Å
160	L	90.4	Very high	87.2	Confident	105 Å²	105	94.4 Å²	94.4	55%	0.55	50%	0.496	S	S	.	.	H	α-helix	trans	-66.8	-37.2	175.8	-70.5	172.3	0	0	0	112.1	C156 C157 C158 S164	C156-L160 WeakPolarHBondContact O-CG 3.37Å; C156-L160 PolarHBondContact O-N 2.99Å; C157-L160 PolarHBondContact O-N 3.35Å; C158-L160 PolarHBondContact O-N 3.36Å; L160-S164 VanDerWaalsContact O-CB 3.31Å; L160-S164 WeakPolarHBondContact O-CB 3.32Å; L160-S164 PolarHBondContact O-N 2.8Å; L160-S164 PolarHBondContact O-OG 2.87Å
161	I	91.3	Very high	87.6	Confident	95 Å²	95	96.8 Å²	96.8	49%	0.487	50%	0.5	S	S	.	.	H	α-helix	trans	-66.6	-45	173.7	-68.3	166.3	0	0	0	110.3	C157 C158 L163 S164 I165	C157-I161 VanDerWaalsContact O-CG1 3.27Å; C157-I161 WeakPolarHBondContact O-CG1 3.2Å; C157-I161 PolarHBondContact O-N 2.9Å; C158-I161 PolarHBondContact O-N 3.43Å; I161-L163 PolarHBondContact O-N 3.47Å; I161-S164 VanDerWaalsContact CA-OG 3.28Å; I161-S164 WeakPolarHBondContact CA-OG 3.35Å; I161-S164 PolarHBondContact O-N 3.27Å; I161-S164 PolarHBondContact O-OG 3.13Å; I161-I165 HydrophobicContact CG2-CD1 3.67Å; I161-I165 HydrophobicContact CG2-CG1 4.31Å; I161-I165 VanDerWaalsContact O-CB 3.31Å; I161-I165 WeakPolarHBondContact O-CB 2.92Å; I161-I165 WeakPolarHBondContact O-CG1 3.41Å; I161-I165 PolarHBondContact O-N 3.09Å
162	C	89.7	Confident	87.6	Confident	77 Å²	77	96.6 Å²	96.6	52%	0.52	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-43.6	176	-74.4	0	0	0	0	112	C158 T159 I165 V166	C158-C162 WeakPolarHBondContact O-CB 3.45Å; C158-C162 PolarHBondContact O-N 3.3Å; C158-C162 PolarHBondContact O-SG 3.5Å; C158-C162 VanDerWaalsContact O-SG 3.4Å; T159-C162 PolarHBondContact O-N 3.39Å; C162-I165 PolarHBondContact O-N 2.9Å; C162-V166 WeakPolarHBondContact O-CB 3.49Å; C162-V166 VanDerWaalsContact O-CG2 3.28Å; C162-V166 WeakPolarHBondContact O-CG2 3.33Å; C162-V166 PolarHBondContact O-N 2.98Å
163	L	91.2	Very high	86.9	Confident	96 Å²	96	101.8 Å²	101.8	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-65.2	-44.1	176.9	-72.6	173.9	0	0	0	111.3	T159 I161 I165 V166 F167	T159-L163 WeakPolarHBondContact O-CB 3.42Å; T159-L163 VanDerWaalsContact O-CG 3.26Å; T159-L163 WeakPolarHBondContact O-CG 3.47Å; T159-L163 PolarHBondContact O-N 3.47Å; I161-L163 PolarHBondContact O-N 3.47Å; L163-I165 VanDerWaalsContact C-N 3.33Å; L163-I165 PolarHBondContact O-N 3.24Å; L163-V166 PolarHBondContact O-N 3.29Å; L163-F167 WeakPolarHBondContact O-CB 3.16Å; L163-F167 VanDerWaalsContact O-CD2 3.31Å; L163-F167 WeakPolarHBondContact O-CD2 3.45Å; L163-F167 PolarHBondContact O-N 2.99Å
164	S	87.7	Confident	86.5	Confident	67 Å²	67	103.5 Å²	103.5	47%	0.469	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-34.2	176	51.4	0	0	0	0	112.4	L160 I161 Y168	L160-S164 VanDerWaalsContact O-CB 3.31Å; L160-S164 WeakPolarHBondContact O-CB 3.32Å; L160-S164 PolarHBondContact O-N 2.8Å; L160-S164 PolarHBondContact O-OG 2.87Å; I161-S164 VanDerWaalsContact CA-OG 3.28Å; I161-S164 WeakPolarHBondContact CA-OG 3.35Å; I161-S164 PolarHBondContact O-N 3.27Å; I161-S164 PolarHBondContact O-OG 3.13Å; S164-Y168 WeakPolarHBondContact O-CA 3.34Å; S164-Y168 WeakPolarHBondContact O-CB 3.31Å; S164-Y168 PolarHBondContact O-N 2.72Å
165	I	90.4	Very high	85.9	Confident	79 Å²	79	100.9 Å²	100.9	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-64.8	-45.9	170	-72.7	169.5	0	0	0	110.5	I161 C162 L163 Y168 Y169	I161-I165 HydrophobicContact CG2-CD1 3.67Å; I161-I165 HydrophobicContact CG2-CG1 4.31Å; I161-I165 VanDerWaalsContact O-CB 3.31Å; I161-I165 WeakPolarHBondContact O-CB 2.92Å; I161-I165 WeakPolarHBondContact O-CG1 3.41Å; I161-I165 PolarHBondContact O-N 3.09Å; C162-I165 PolarHBondContact O-N 2.9Å; L163-I165 VanDerWaalsContact C-N 3.33Å; L163-I165 PolarHBondContact O-N 3.24Å; I165-Y168 CarbonylContact O-C 3.24Å; I165-Y168 PolarHBondContact O-N 3.27Å; I165-Y169 HydrophobicContact CG2-CD2 3.45Å; I165-Y169 VanDerWaalsContact CG2-CD2 3.45Å; I165-Y169 HydrophobicContact CG2-CE2 3.47Å; I165-Y169 VanDerWaalsContact CG2-CE2 3.47Å; I165-Y169 WeakPolarHBondContact O-CB 3.11Å; I165-Y169 WeakPolarHBondContact O-CD2 3.37Å; I165-Y169 PolarHBondContact O-N 3.07Å
166	V	90.5	Very high	84.7	Confident	74 Å²	74	101.1 Å²	101.1	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-42.2	177.3	168.6	0	0	0	0	111.2	C162 L163 Y169 R170	C162-V166 WeakPolarHBondContact O-CB 3.49Å; C162-V166 VanDerWaalsContact O-CG2 3.28Å; C162-V166 WeakPolarHBondContact O-CG2 3.33Å; C162-V166 PolarHBondContact O-N 2.98Å; L163-V166 PolarHBondContact O-N 3.29Å; V166-Y169 PolarHBondContact O-N 3.08Å; V166-R170 VanDerWaalsContact O-CB 3.3Å; V166-R170 WeakPolarHBondContact O-CB 3.48Å; V166-R170 WeakPolarHBondContact O-CG 3.45Å; V166-R170 PolarHBondContact O-N 3.42Å
167	F	90.1	Very high	83.3	Confident	146 Å²	146	107.6 Å²	107.6	64%	0.64	51%	0.51	S	S	*	.	H	α-helix	trans	-66.5	-39.5	174.1	-92.1	-77.3	0	0	0	111.5	L163 R170 Y171	L163-F167 WeakPolarHBondContact O-CB 3.16Å; L163-F167 VanDerWaalsContact O-CD2 3.31Å; L163-F167 WeakPolarHBondContact O-CD2 3.45Å; L163-F167 PolarHBondContact O-N 2.99Å; F167-R170 PolarHBondContact O-N 2.74Å; F167-Y171 WeakPolarHBondContact O-CA 3.28Å; F167-Y171 WeakPolarHBondContact O-CB 3.24Å; F167-Y171 PolarHBondContact O-N 2.92Å
168	Y	90.8	Very high	81.7	Confident	136 Å²	136	112.3 Å²	112.3	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-64.5	-43.4	173.7	173.2	-97.3	0	0	0	111.1	S164 I165 K172	S164-Y168 WeakPolarHBondContact O-CA 3.34Å; S164-Y168 WeakPolarHBondContact O-CB 3.31Å; S164-Y168 PolarHBondContact O-N 2.72Å; I165-Y168 CarbonylContact O-C 3.24Å; I165-Y168 PolarHBondContact O-N 3.27Å; Y168-K172 HydrophobicContact CE1-CD 4.18Å; Y168-K172 WeakPolarHBondContact O-CA 3.41Å; Y168-K172 WeakPolarHBondContact O-CB 3.47Å; Y168-K172 PolarHBondContact O-N 3.35Å
169	Y	84	Confident	79.8	Confident	141 Å²	141	117.8 Å²	117.8	55%	0.553	54%	0.536	S	S	*	.	H	α-helix	trans	-69.2	-34.6	175	-84.2	-69.9	0	0	0	111.6	I165 V166 W173	I165-Y169 HydrophobicContact CG2-CD2 3.45Å; I165-Y169 VanDerWaalsContact CG2-CD2 3.45Å; I165-Y169 HydrophobicContact CG2-CE2 3.47Å; I165-Y169 VanDerWaalsContact CG2-CE2 3.47Å; I165-Y169 WeakPolarHBondContact O-CB 3.11Å; I165-Y169 WeakPolarHBondContact O-CD2 3.37Å; I165-Y169 PolarHBondContact O-N 3.07Å; V166-Y169 PolarHBondContact O-N 3.08Å; Y169-W173 WeakPolarHBondContact O-CA 3.38Å; Y169-W173 WeakPolarHBondContact O-CB 3.28Å; Y169-W173 PolarHBondContact O-N 3.5Å
170	R	85.8	Confident	77.6	Confident	175 Å²	175	122.8 Å²	122.8	66%	0.66	55%	0.548	S	S	*	.	H	α-helix	trans	-71.4	-40.6	174.2	-80.2	-165.4	165.5	167.5	-0.3	112.4	V166 F167 W173 Q174	V166-R170 VanDerWaalsContact O-CB 3.3Å; V166-R170 WeakPolarHBondContact O-CB 3.48Å; V166-R170 WeakPolarHBondContact O-CG 3.45Å; V166-R170 PolarHBondContact O-N 3.42Å; F167-R170 PolarHBondContact O-N 2.74Å; R170-W173 PolarHBondContact O-N 2.72Å; R170-Q174 VanDerWaalsContact O-CB 3.3Å; R170-Q174 WeakPolarHBondContact O-CB 3.35Å; R170-Q174 WeakPolarHBondContact O-CG 3.36Å; R170-Q174 PolarHBondContact O-N 3.37Å
171	Y	83.1	Confident	75.4	Confident	149 Å²	149	121 Å²	121	58%	0.584	54%	0.543	S	S	*	.	H	α-helix	trans	-65.8	-45	173	175.5	-98.9	0	0	0	110.5	F167 W173 Q174 T175	F167-Y171 WeakPolarHBondContact O-CA 3.28Å; F167-Y171 WeakPolarHBondContact O-CB 3.24Å; F167-Y171 PolarHBondContact O-N 2.92Å; Y171-W173 VanDerWaalsContact C-N 3.35Å; Y171-Q174 PolarHBondContact O-N 3.15Å; Y171-T175 HydrophobicContact CD1-CG2 4.46Å; Y171-T175 HydrophobicContact CD2-CG2 4.42Å; Y171-T175 HydrophobicContact CE1-CG2 3.95Å; Y171-T175 HydrophobicContact CE2-CG2 3.91Å; Y171-T175 WeakPolarHBondContact O-CB 3.49Å; Y171-T175 PolarHBondContact O-N 3.44Å; Y171-T175 PolarHBondContact O-OG1 3.48Å
172	K	81	Confident	73.1	Confident	81 Å²	81	124.5 Å²	124.5	35%	0.352	56%	0.555	S	S	.	*	H	α-helix	trans	-62.7	-40.5	172.6	-173.1	178.8	178.1	-177.2	0	110.6	Y168 T175 E176	Y168-K172 HydrophobicContact CE1-CD 4.18Å; Y168-K172 WeakPolarHBondContact O-CA 3.41Å; Y168-K172 WeakPolarHBondContact O-CB 3.47Å; Y168-K172 PolarHBondContact O-N 3.35Å; K172-T175 VanDerWaalsContact CA-OG1 3.3Å; K172-T175 WeakPolarHBondContact CA-OG1 3.44Å; K172-T175 CarbonylContact O-C 3.52Å; K172-T175 PolarHBondContact O-N 2.64Å; K172-T175 PolarHBondContact O-OG1 3.04Å; K172-E176 WeakPolarHBondContact CE-OE1 3.45Å; K172-E176 HydrophobicContact CG-CG 3.87Å; K172-E176 WeakPolarHBondContact O-CA 3.35Å; K172-E176 WeakPolarHBondContact O-CB 3.39Å; K172-E176 WeakPolarHBondContact O-CG 3.43Å; K172-E176 PolarHBondContact O-N 3.09Å
173	W	67.9	Low	70.6	Confident	181 Å²	181	126.9 Å²	126.9	69%	0.686	56%	0.562	S	S	*	*	H	α-helix	trans	-69.2	-34.6	176.5	-165.8	-69.6	0	0	0	112.2	Y169 R170 Y171 R177	Y169-W173 WeakPolarHBondContact O-CA 3.38Å; Y169-W173 WeakPolarHBondContact O-CB 3.28Å; Y169-W173 PolarHBondContact O-N 3.5Å; R170-W173 PolarHBondContact O-N 2.72Å; Y171-W173 VanDerWaalsContact C-N 3.35Å; W173-R177 VanDerWaalsContact O-CB 3.27Å; W173-R177 WeakPolarHBondContact O-CB 3.44Å; W173-R177 PolarHBondContact O-N 3.1Å
174	Q	75.4	Confident	68.3	Low	126 Å²	126	129.3 Å²	129.3	59%	0.589	58%	0.575	S	S	*	*	H	α-helix	trans	-71.4	-44.4	172.4	-82	179.4	-27.9	0	0	111.4	R170 Y171 R177 E178	R170-Q174 VanDerWaalsContact O-CB 3.3Å; R170-Q174 WeakPolarHBondContact O-CB 3.35Å; R170-Q174 WeakPolarHBondContact O-CG 3.36Å; R170-Q174 PolarHBondContact O-N 3.37Å; Y171-Q174 PolarHBondContact O-N 3.15Å; Q174-R177 CarbonylContact O-C 3.46Å; Q174-R177 WeakPolarHBondContact O-CA 3.03Å; Q174-R177 WeakPolarHBondContact O-CB 3.49Å; Q174-R177 PolarHBondContact O-N 2.94Å; Q174-R177 VanDerWaalsContact O-N 3.15Å; Q174-E178 PolarHBondContact O-N 2.91Å
175	T	71.9	Confident	65.9	Low	22 Å²	22	132.3 Å²	132.3	14%	0.135	58%	0.581	C	S	.	*	H	α-helix	trans	-73.9	-26	176.3	45.2	0	0	0	0	113	Y171 K172 R177 R179	Y171-T175 HydrophobicContact CD1-CG2 4.46Å; Y171-T175 HydrophobicContact CD2-CG2 4.42Å; Y171-T175 HydrophobicContact CE1-CG2 3.95Å; Y171-T175 HydrophobicContact CE2-CG2 3.91Å; Y171-T175 WeakPolarHBondContact O-CB 3.49Å; Y171-T175 PolarHBondContact O-N 3.44Å; Y171-T175 PolarHBondContact O-OG1 3.48Å; K172-T175 VanDerWaalsContact CA-OG1 3.3Å; K172-T175 WeakPolarHBondContact CA-OG1 3.44Å; K172-T175 CarbonylContact O-C 3.52Å; K172-T175 PolarHBondContact O-N 2.64Å; K172-T175 PolarHBondContact O-OG1 3.04Å; T175-R177 VanDerWaalsContact C-N 3.35Å; T175-R179 VanDerWaalsContact O-CA 3.24Å; T175-R179 WeakPolarHBondContact O-CA 3.49Å; T175-R179 WeakPolarHBondContact O-CB 3.42Å; T175-R179 WeakPolarHBondContact O-CG 3.42Å; T175-R179 PolarHBondContact O-N 3.48Å
176	E	64.6	Low	63.3	Low	107 Å²	107	136.2 Å²	136.2	50%	0.5	60%	0.598	S	S	.	*	H	α-helix	trans	-79.3	-19.1	167.5	-67.7	-99.9	174.1	0	0	111	K172 Y180	K172-E176 WeakPolarHBondContact CE-OE1 3.45Å; K172-E176 HydrophobicContact CG-CG 3.87Å; K172-E176 WeakPolarHBondContact O-CA 3.35Å; K172-E176 WeakPolarHBondContact O-CB 3.39Å; K172-E176 WeakPolarHBondContact O-CG 3.43Å; K172-E176 PolarHBondContact O-N 3.09Å; E176-Y180 WeakPolarHBondContact O-CA 3.46Å; E176-Y180 WeakPolarHBondContact O-CB 3.43Å; E176-Y180 PolarHBondContact O-N 3.35Å
177	R	58.5	Low	60.7	Low	192 Å²	192	139.2 Å²	139.2	73%	0.725	61%	0.607	S	S	*	*	H	α-helix	trans	-78.6	-35.9	166	-97.6	-176.6	163.5	-173.6	-4.1	112.2	W173 Q174 T175	W173-R177 VanDerWaalsContact O-CB 3.27Å; W173-R177 WeakPolarHBondContact O-CB 3.44Å; W173-R177 PolarHBondContact O-N 3.1Å; Q174-R177 CarbonylContact O-C 3.46Å; Q174-R177 WeakPolarHBondContact O-CA 3.03Å; Q174-R177 WeakPolarHBondContact O-CB 3.49Å; Q174-R177 PolarHBondContact O-N 2.94Å; Q174-R177 VanDerWaalsContact O-N 3.15Å; T175-R177 VanDerWaalsContact C-N 3.35Å
178	E	54.3	Low	58.3	Low	165 Å²	165	136.9 Å²	136.9	77%	0.771	61%	0.605	S	S	*	*	H	α-helix	trans	-85.7	-25.7	176.5	-74.4	-174.4	161.3	0	0	112.9	Q174	Q174-E178 PolarHBondContact O-N 2.91Å
179	R	48.4	Very low	55.8	Low	191 Å²	191	137.8 Å²	137.8	72%	0.721	61%	0.611	S	S	*	*	S	Bend	trans	-105.7	18.9	169	-57.7	175.8	176.5	174.4	-1.6	112.2	T175 P181	T175-R179 VanDerWaalsContact O-CA 3.24Å; T175-R179 WeakPolarHBondContact O-CA 3.49Å; T175-R179 WeakPolarHBondContact O-CB 3.42Å; T175-R179 WeakPolarHBondContact O-CG 3.42Å; T175-R179 PolarHBondContact O-N 3.48Å; R179-P181 WeakPolarHBondContact O-CD 3.43Å
180	Y	41.7	Very low	54.1	Low	174 Å²	174	132.6 Å²	132.6	68%	0.682	59%	0.593	S	S	*	*	S	Bend	trans	-73.2	96.1	142.8	-139.3	-88.1	0	0	0	102.3	E176 K182	E176-Y180 WeakPolarHBondContact O-CA 3.46Å; E176-Y180 WeakPolarHBondContact O-CB 3.43Å; E176-Y180 PolarHBondContact O-N 3.35Å; Y180-K182 PolarHBondContact O-N 3.47Å
181	P	45.8	Very low	52.1	Low	67 Å²	67	132.6 Å²	132.6	44%	0.435	59%	0.593	S	S	.	*			trans	-65.3	144	-175	-7.5	27.4	0	0	0	105.3	R179 D183	R179-P181 WeakPolarHBondContact O-CD 3.43Å; P181-D183 HydrophobicContact CB-CB 3.73Å; P181-D183 WeakPolarHBondContact CB-OD2 3.4Å; P181-D183 PolarHBondContact O-N 2.68Å
182	K	42.9	Very low	50.3	Low	169 Å²	169	129.7 Å²	129.7	74%	0.735	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.5	24.2	150.2	-78.5	171.4	156.7	178.2	0	113.5	Y180 E185	Y180-K182 PolarHBondContact O-N 3.47Å; K182-E185 WeakPolarHBondContact O-CB 3.3Å
183	D	36.9	Very low	49.1	Very low	127 Å²	127	129.8 Å²	129.8	68%	0.679	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	9	-178.1	-54.4	-34.4	0	0	0	112.5	P181	P181-D183 HydrophobicContact CB-CB 3.73Å; P181-D183 WeakPolarHBondContact CB-OD2 3.4Å; P181-D183 PolarHBondContact O-N 2.68Å
184	L	41.8	Very low	48.9	Very low	146 Å²	146	124.5 Å²	124.5	76%	0.764	62%	0.616	S	S	*	*	S	Bend	trans	-107.6	17.6	146.8	-131.8	88.8	0	0	0	111.8	Q186	L184-Q186 PolarHBondContact O-N 3.24Å
185	E	37.8	Very low	48.8	Very low	130 Å²	130	120.6 Å²	120.6	61%	0.607	60%	0.602	S	S	*	*			trans	-79.9	60	134.7	-67.8	176.2	154.4	0	0	106.8	K182 E187	K182-E185 WeakPolarHBondContact O-CB 3.3Å; E185-E187 PolarHBondContact O-N 2.76Å
186	Q	35.6	Very low	49.1	Very low	162 Å²	162	120.4 Å²	120.4	76%	0.757	60%	0.6	S	S	*	*			trans	-64.6	87.8	131.8	-162	137.3	15.7	0	0	102.6	L184 V188	L184-Q186 PolarHBondContact O-N 3.24Å; Q186-V188 PolarHBondContact O-N 3.39Å
187	E	37	Very low	49.8	Very low	137 Å²	137	122.1 Å²	122.1	64%	0.64	61%	0.606	S	S	*	*			trans	-39.3	105	147.8	-71.3	-170.3	156.9	0	0	102.5	E185 F189	E185-E187 PolarHBondContact O-N 2.76Å; E187-F189 PolarHBondContact O-N 3.11Å
188	V	39.3	Very low	50.8	Low	97 Å²	97	116.6 Å²	116.6	59%	0.588	59%	0.591	S	S	*	*			trans	-53.8	99	148.5	179.8	0	0	0	0	99.7	Q186 I190	Q186-V188 PolarHBondContact O-N 3.39Å; V188-I190 HydrophobicContact CB-CG1 4.27Å; V188-I190 HydrophobicContact CG1-CD1 4.21Å; V188-I190 HydrophobicContact CG1-CG1 3.71Å; V188-I190 WeakPolarHBondContact O-CG1 3.48Å; V188-I190 PolarHBondContact O-N 2.89Å
189	F	37.6	Very low	51.9	Low	154 Å²	154	109.4 Å²	109.4	68%	0.675	56%	0.558	S	S	*	*			trans	-68.6	75.2	-175.3	-171.9	-94	0	0	0	103.3	E187 R191	E187-F189 PolarHBondContact O-N 3.11Å; F189-R191 HydrophobicContact CD1-CG 3.76Å; F189-R191 HydrophobicContact CE1-CG 3.71Å; F189-R191 PolarHBondContact O-N 3.34Å
190	I	48.3	Very low	53.4	Low	33 Å²	33	100.4 Å²	100.4	17%	0.169	52%	0.524	C	S	.	.			trans	-74.1	95.8	172.6	-62	173.6	0	0	0	101.5	V188 G192 L199 R244	V188-I190 HydrophobicContact CB-CG1 4.27Å; V188-I190 HydrophobicContact CG1-CD1 4.21Å; V188-I190 HydrophobicContact CG1-CG1 3.71Å; V188-I190 WeakPolarHBondContact O-CG1 3.48Å; V188-I190 PolarHBondContact O-N 2.89Å; I190-G192 PolarHBondContact O-N 3.47Å; I190-L199 HydrophobicContact CB-CD2 4.37Å; I190-L199 HydrophobicContact CD1-CD2 4.06Å; I190-L199 HydrophobicContact CG1-CD2 4.04Å; I190-L199 HydrophobicContact CG2-CD1 3.71Å; I190-L199 HydrophobicContact CG2-CD2 3.47Å; I190-L199 VanDerWaalsContact CG2-CD2 3.47Å; I190-L199 HydrophobicContact CG2-CG 4.12Å; I190-R244 VanDerWaalsContact CB-NH1 3.32Å; I190-R244 VanDerWaalsContact CD1-NH2 3.3Å
191	R	43.6	Very low	55.1	Low	174 Å²	174	97.4 Å²	97.4	66%	0.657	52%	0.516	S	S	*	.			trans	-43.5	126.2	-178.5	-80.9	178.1	178.6	-175	0.3	108	F189 G193 E194	F189-R191 HydrophobicContact CD1-CG 3.76Å; F189-R191 HydrophobicContact CE1-CG 3.71Å; F189-R191 PolarHBondContact O-N 3.34Å; R191-G193 PolarHBondContact O-N 2.78Å; R191-E194 PolarHBondContact O-N 2.92Å
192	G	45.4	Very low	56.4	Low	89 Å²	89	99.3 Å²	99.3	92%	0.918	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	111.7	166.5	0	0	0	0	0	108.1	I190	I190-G192 PolarHBondContact O-N 3.47Å
193	G	55.5	Low	57.8	Low	83 Å²	83	92.4 Å²	92.4	86%	0.856	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	133.1	-16.6	-176.4	0	0	0	0	0	115.5	R191	R191-G193 PolarHBondContact O-N 2.78Å
194	E	63.8	Low	59.2	Low	70 Å²	70	88.6 Å²	88.6	33%	0.327	47%	0.47	S	S	.	.			trans	-81.1	132.7	176.1	-67	-171.9	142.3	0	0	111.8	R191 Q202	R191-E194 PolarHBondContact O-N 2.92Å; E194-Q202 PolarHBondContact OE1-NE2 3.48Å
195	S	75	Confident	60.3	Low	44 Å²	44	87 Å²	87	31%	0.308	47%	0.471	S	S	.	.			trans	-72.4	151.7	178.5	83.6	0	0	0	0	110.8	K197 D198 L199	S195-K197 PolarHBondContact O-N 3.07Å; S195-K197 VanDerWaalsContact O-N 3.14Å; S195-D198 VanDerWaalsContact CB-OD2 3.31Å; S195-D198 WeakPolarHBondContact CB-OD2 3.48Å; S195-D198 PolarHBondContact N-OD2 2.97Å; S195-D198 PolarHBondContact O-N 3.45Å; S195-D198 PolarHBondContact OG-N 3.07Å; S195-D198 PolarHBondContact OG-OD2 3.14Å; S195-L199 PolarHBondContact O-N 3.06Å
196	L	78.1	Confident	61.5	Low	17 Å²	17	85.4 Å²	85.4	9%	0.089	47%	0.474	C	S	.	.	H	α-helix	trans	-51.3	-37.5	174.7	172.8	57.7	0	0	0	112.6	I200 W243 E246 V248 I282	L196-I200 HydrophobicContact CD1-CD1 3.86Å; L196-I200 HydrophobicContact CD1-CG1 4.33Å; L196-I200 HydrophobicContact CG-CD1 4.05Å; L196-I200 WeakPolarHBondContact O-CG1 3.48Å; L196-I200 PolarHBondContact O-N 2.88Å; L196-W243 HydrophobicContact CD1-CE3 3.51Å; L196-W243 HydrophobicContact CD1-CH2 4.26Å; L196-W243 HydrophobicContact CD1-CZ3 3.15Å; L196-E246 HydrophobicContact CB-CB 4.42Å; L196-E246 HydrophobicContact CB-CG 4.09Å; L196-E246 HydrophobicContact CD2-CB 4.26Å; L196-V248 HydrophobicContact CD2-CG1 3.99Å; L196-I282 HydrophobicContact CD1-CG2 4.22Å; L196-I282 HydrophobicContact CD2-CD1 3.84Å
197	K	77.6	Confident	62.5	Low	144 Å²	144	80.1 Å²	80.1	63%	0.626	46%	0.464	S	S	*	.	H	α-helix	trans	-65.7	-42	179.1	-68.9	-177.5	178.7	178.6	0	111.5	S195 L199 I200 H201	S195-K197 PolarHBondContact O-N 3.07Å; S195-K197 VanDerWaalsContact O-N 3.14Å; K197-L199 VanDerWaalsContact C-N 3.34Å; K197-L199 PolarHBondContact O-N 2.95Å; K197-I200 PolarHBondContact O-N 3.25Å; K197-H201 WeakPolarHBondContact O-CB 3.39Å; K197-H201 PolarHBondContact O-CD2 3.22Å; K197-H201 PolarHBondContact O-N 3.45Å
198	D	79.6	Confident	63.4	Low	76 Å²	76	79 Å²	79	41%	0.406	47%	0.471	S	S	.	.	H	α-helix	trans	-63.9	-42.1	-178.6	-57	-38	0	0	0	110.9	S195 I200 H201 Q202	S195-D198 VanDerWaalsContact CB-OD2 3.31Å; S195-D198 WeakPolarHBondContact CB-OD2 3.48Å; S195-D198 PolarHBondContact N-OD2 2.97Å; S195-D198 PolarHBondContact O-N 3.45Å; S195-D198 PolarHBondContact OG-N 3.07Å; S195-D198 PolarHBondContact OG-OD2 3.14Å; D198-I200 PolarHBondContact O-N 3.23Å; D198-H201 PolarHBondContact O-N 3.45Å; D198-Q202 WeakPolarHBondContact O-CB 3.31Å; D198-Q202 VanDerWaalsContact O-CG 3.28Å; D198-Q202 WeakPolarHBondContact O-CG 3.45Å; D198-Q202 PolarHBondContact O-N 3.28Å
199	L	78.9	Confident	64.5	Low	14 Å²	14	75.7 Å²	75.7	7%	0.073	46%	0.456	C	S	.	.	H	α-helix	trans	-61.2	-43.3	177.4	-70.6	162.7	0	0	0	112.8	I190 S195 K197 H201 S203 L212 R244	I190-L199 HydrophobicContact CB-CD2 4.37Å; I190-L199 HydrophobicContact CD1-CD2 4.06Å; I190-L199 HydrophobicContact CG1-CD2 4.04Å; I190-L199 HydrophobicContact CG2-CD1 3.71Å; I190-L199 HydrophobicContact CG2-CD2 3.47Å; I190-L199 VanDerWaalsContact CG2-CD2 3.47Å; I190-L199 HydrophobicContact CG2-CG 4.12Å; S195-L199 PolarHBondContact O-N 3.06Å; K197-L199 VanDerWaalsContact C-N 3.34Å; K197-L199 PolarHBondContact O-N 2.95Å; L199-H201 VanDerWaalsContact C-N 3.35Å; L199-S203 PolarHBondContact O-N 2.83Å; L199-S203 PolarHBondContact O-OG 3.38Å; L199-L212 HydrophobicContact CB-CD2 4.19Å; L199-R244 VanDerWaalsContact CD1-NH1 3.31Å
200	I	79	Confident	66.1	Low	1 Å²	1	68.9 Å²	68.9	1%	0.005	43%	0.427	C	S	.	.	H	α-helix	trans	-67.5	-38.3	177.6	-67.5	169.8	0	0	0	110.6	L196 K197 D198 S203 Q204 L212 I282	L196-I200 HydrophobicContact CD1-CD1 3.86Å; L196-I200 HydrophobicContact CD1-CG1 4.33Å; L196-I200 HydrophobicContact CG-CD1 4.05Å; L196-I200 WeakPolarHBondContact O-CG1 3.48Å; L196-I200 PolarHBondContact O-N 2.88Å; K197-I200 PolarHBondContact O-N 3.25Å; D198-I200 PolarHBondContact O-N 3.23Å; I200-S203 PolarHBondContact O-OG 3.11Å; I200-S203 VanDerWaalsContact O-OG 3.06Å; I200-Q204 WeakPolarHBondContact O-CB 3.4Å; I200-Q204 VanDerWaalsContact O-CD 3.28Å; I200-Q204 WeakPolarHBondContact O-CG 3.4Å; I200-Q204 PolarHBondContact O-N 3.25Å; I200-Q204 VanDerWaalsContact O-N 3.16Å; I200-L212 HydrophobicContact CG1-CD2 4.25Å; I200-L212 HydrophobicContact CG1-CG 4.35Å; I200-I282 HydrophobicContact CD1-CG1 3.98Å; I200-I282 HydrophobicContact CD1-CG2 4.33Å
201	H	76.9	Confident	67.3	Low	112 Å²	112	67.5 Å²	67.5	52%	0.519	42%	0.421	S	S	.	.	H	α-helix	trans	-66.3	-45.6	176.6	-87.5	-67.2	0	0	0	111.9	K197 D198 L199 S203 Q204 S205	K197-H201 WeakPolarHBondContact O-CB 3.39Å; K197-H201 PolarHBondContact O-CD2 3.22Å; K197-H201 PolarHBondContact O-N 3.45Å; D198-H201 PolarHBondContact O-N 3.45Å; L199-H201 VanDerWaalsContact C-N 3.35Å; H201-S203 VanDerWaalsContact C-N 3.34Å; H201-S203 PolarHBondContact O-N 3.48Å; H201-Q204 PolarHBondContact O-N 3.04Å; H201-S205 PolarHBondContact O-N 3.09Å; H201-S205 PolarHBondContact O-OG 3.2Å
202	Q	74.6	Confident	68.8	Low	106 Å²	106	59.8 Å²	59.8	50%	0.495	39%	0.393	S	S	.	.	H	α-helix	trans	-60.7	-42.1	177.2	-71.2	173.9	13.4	0	0	111.7	E194 D198 Q204	E194-Q202 PolarHBondContact OE1-NE2 3.48Å; D198-Q202 WeakPolarHBondContact O-CB 3.31Å; D198-Q202 VanDerWaalsContact O-CG 3.28Å; D198-Q202 WeakPolarHBondContact O-CG 3.45Å; D198-Q202 PolarHBondContact O-N 3.28Å; Q202-Q204 VanDerWaalsContact C-N 3.33Å; Q202-Q204 PolarHBondContact O-N 3.47Å
203	S	71.8	Confident	70	Confident	24 Å²	24	58.9 Å²	58.9	17%	0.168	37%	0.371	C	S	.	.	H	α-helix	trans	-69.8	-28.8	179.2	66.9	0	0	0	0	113.6	L199 I200 H201 S206 G211	L199-S203 PolarHBondContact O-N 2.83Å; L199-S203 PolarHBondContact O-OG 3.38Å; I200-S203 PolarHBondContact O-OG 3.11Å; I200-S203 VanDerWaalsContact O-OG 3.06Å; H201-S203 VanDerWaalsContact C-N 3.34Å; H201-S203 PolarHBondContact O-N 3.48Å; S203-S206 PolarHBondContact O-N 3.04Å; S203-G211 PolarHBondContact OG-O 3.42Å
204	Q	66.4	Low	70.6	Confident	48 Å²	48	60.6 Å²	60.6	22%	0.224	36%	0.36	C	S	.	.	H	α-helix	trans	-75.6	-29.1	-179.6	-77.9	167.7	8.4	0	0	113.6	I200 H201 Q202 S206 G207	I200-Q204 WeakPolarHBondContact O-CB 3.4Å; I200-Q204 VanDerWaalsContact O-CD 3.28Å; I200-Q204 WeakPolarHBondContact O-CG 3.4Å; I200-Q204 PolarHBondContact O-N 3.25Å; I200-Q204 VanDerWaalsContact O-N 3.16Å; H201-Q204 PolarHBondContact O-N 3.04Å; Q202-Q204 VanDerWaalsContact C-N 3.33Å; Q202-Q204 PolarHBondContact O-N 3.47Å; Q204-S206 PolarHBondContact O-N 3.07Å; Q204-S206 VanDerWaalsContact O-N 3.1Å; Q204-G207 PolarHBondContact O-N 3.33Å
205	S	65.3	Low	70.4	Confident	112 Å²	112	64.4 Å²	64.4	78%	0.783	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.5	173.9	-63.8	0	0	0	0	113.1	H201 G207	H201-S205 PolarHBondContact O-N 3.09Å; H201-S205 PolarHBondContact O-OG 3.2Å; S205-G207 VanDerWaalsContact C-N 3.35Å
206	S	62.2	Low	70	Confident	96 Å²	96	63.5 Å²	63.5	67%	0.671	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.8	175.2	-53.1	0	0	0	0	114.6	S203 Q204 S208	S203-S206 PolarHBondContact O-N 3.04Å; Q204-S206 PolarHBondContact O-N 3.07Å; Q204-S206 VanDerWaalsContact O-N 3.1Å; S206-S208 PolarHBondContact O-N 3.42Å
207	G	57.3	Low	69.8	Low	52 Å²	52	63.1 Å²	63.1	54%	0.536	37%	0.372	S	S	.	.			trans	79.5	8.6	160.4	0	0	0	0	0	118.9	Q204 S205	Q204-G207 PolarHBondContact O-N 3.33Å; S205-G207 VanDerWaalsContact C-N 3.35Å
208	S	55.8	Low	69.5	Low	114 Å²	114	65.4 Å²	65.4	80%	0.797	38%	0.377	S	S	*	.	S	Bend	trans	-98.6	-2	-171.7	-61.4	0	0	0	0	116.7	S206	S206-S208 PolarHBondContact O-N 3.42Å
209	G	61.9	Low	69.5	Low	27 Å²	27	64.6 Å²	64.6	28%	0.278	38%	0.375	S	S	.	.			trans	149.2	178.7	179.8	0	0	0	0	0	114
210	S	72.3	Confident	69.8	Low	10 Å²	10	64 Å²	64	7%	0.07	37%	0.371	C	S	.	.	S	Bend	trans	-83.7	141	175.5	105.4	0	0	0	0	111.2	Y268 F281	S210-Y268 PolarHBondContact OG-O 3.33Å; S210-F281 WeakPolarHBondContact O-CD1 3.39Å; S210-F281 WeakPolarHBondContact O-CE1 3.44Å
211	G	72.8	Confident	70.2	Confident	4 Å²	4	63.9 Å²	63.9	4%	0.041	37%	0.371	C	S	.	.	S	Bend	trans	97.5	-166.2	-178.8	0	0	0	0	0	115.1	S203 I282	S203-G211 PolarHBondContact OG-O 3.42Å; G211-I282 WeakPolarHBondContact CA-O 3.41Å
212	L	74.6	Confident	70.6	Confident	13 Å²	13	66.7 Å²	66.7	7%	0.068	38%	0.382	C	S	.	.	S	Bend	trans	-83.4	163.3	-179.7	-70.9	169.4	0	0	0	112.4	L199 I200 V216 Q217 I220 W243 I282	L199-L212 HydrophobicContact CB-CD2 4.19Å; I200-L212 HydrophobicContact CG1-CD2 4.25Å; I200-L212 HydrophobicContact CG1-CG 4.35Å; L212-V216 HydrophobicContact CB-CB 4.44Å; L212-V216 HydrophobicContact CB-CG1 4.34Å; L212-V216 HydrophobicContact CD1-CG1 4.13Å; L212-Q217 HydrophobicContact CB-CG 4.19Å; L212-Q217 WeakPolarHBondContact O-CG 3.3Å; L212-Q217 PolarHBondContact O-NE2 2.94Å; L212-I220 HydrophobicContact CD1-CD1 3.57Å; L212-W243 HydrophobicContact CD1-CH2 3.52Å; L212-W243 HydrophobicContact CD1-CZ3 3.81Å; L212-I282 HydrophobicContact CD1-CG2 4.04Å; L212-I282 PolarHBondContact N-O 3.42Å
213	P	71.2	Confident	71.3	Confident	69 Å²	69	66.2 Å²	66.2	45%	0.448	38%	0.379	S	S	.	.			trans	-62.9	147.2	176.5	-20.8	33.9	0	0	0	112.5	L215 V216 Q217	P213-L215 VanDerWaalsContact C-N 3.3Å; P213-L215 PolarHBondContact O-N 3.07Å; P213-L215 VanDerWaalsContact O-N 3.15Å; P213-V216 HydrophobicContact CB-CG2 4.4Å; P213-V216 HydrophobicContact CG-CG2 4.42Å; P213-V216 WeakPolarHBondContact O-CA 3.32Å; P213-V216 WeakPolarHBondContact O-CB 3.24Å; P213-V216 PolarHBondContact O-N 2.66Å; P213-Q217 WeakPolarHBondContact O-CG 3.48Å; P213-Q217 PolarHBondContact O-N 3.03Å
214	L	67.9	Low	72.3	Confident	119 Å²	119	65.4 Å²	65.4	62%	0.623	37%	0.373	S	S	*	.	H	α-helix	trans	-51.7	-40.9	-173.9	-73.9	170.5	0	0	0	114.7	V216 Q217 R218	L214-V216 VanDerWaalsContact C-N 3.34Å; L214-Q217 PolarHBondContact O-N 3.04Å; L214-R218 PolarHBondContact O-N 3.26Å
215	L	60	Low	73.6	Confident	150 Å²	150	69.4 Å²	69.4	79%	0.785	39%	0.392	S	S	*	.	H	α-helix	trans	-64.7	-39.1	178	-70.8	173.8	0	0	0	112	P213	P213-L215 VanDerWaalsContact C-N 3.3Å; P213-L215 PolarHBondContact O-N 3.07Å; P213-L215 VanDerWaalsContact O-N 3.15Å
216	V	66.1	Low	74.9	Confident	25 Å²	25	66.8 Å²	66.8	15%	0.152	37%	0.368	C	S	.	.	H	α-helix	trans	-67.9	-45.1	175.1	-177.8	0	0	0	0	109.2	L212 P213 L214 R218 T219 I220	L212-V216 HydrophobicContact CB-CB 4.44Å; L212-V216 HydrophobicContact CB-CG1 4.34Å; L212-V216 HydrophobicContact CD1-CG1 4.13Å; P213-V216 HydrophobicContact CB-CG2 4.4Å; P213-V216 HydrophobicContact CG-CG2 4.42Å; P213-V216 WeakPolarHBondContact O-CA 3.32Å; P213-V216 WeakPolarHBondContact O-CB 3.24Å; P213-V216 PolarHBondContact O-N 2.66Å; L214-V216 VanDerWaalsContact C-N 3.34Å; V216-R218 VanDerWaalsContact C-N 3.3Å; V216-R218 PolarHBondContact O-N 3.22Å; V216-T219 PolarHBondContact O-N 2.8Å; V216-T219 PolarHBondContact O-OG1 2.69Å; V216-I220 HydrophobicContact CG1-CD1 4.37Å; V216-I220 WeakPolarHBondContact O-CG1 3.46Å
217	Q	74.3	Confident	76.5	Confident	10 Å²	10	65.5 Å²	65.5	5%	0.047	36%	0.356	C	S	.	.	H	α-helix	trans	-53	-43.4	-179.1	-67	-174.3	6.1	0	0	112.8	L212 P213 L214 T219 I220 A283 D285	L212-Q217 HydrophobicContact CB-CG 4.19Å; L212-Q217 WeakPolarHBondContact O-CG 3.3Å; L212-Q217 PolarHBondContact O-NE2 2.94Å; P213-Q217 WeakPolarHBondContact O-CG 3.48Å; P213-Q217 PolarHBondContact O-N 3.03Å; L214-Q217 PolarHBondContact O-N 3.04Å; Q217-T219 PolarHBondContact O-N 3.41Å; Q217-I220 PolarHBondContact O-N 3.34Å; Q217-A283 HydrophobicContact CB-CB 4.08Å; Q217-A283 HydrophobicContact CG-CB 3.77Å; Q217-D285 WeakPolarHBondContact O-CB 3.44Å; Q217-D285 VanDerWaalsContact O-OD2 3.04Å
218	R	71.8	Confident	78.4	Confident	191 Å²	191	69.2 Å²	69.2	72%	0.721	35%	0.354	S	S	*	.	H	α-helix	trans	-68.8	4.8	-176.7	-73	-172.2	176.3	-176.1	-0.1	116.4	L214 V216 D285	L214-R218 PolarHBondContact O-N 3.26Å; V216-R218 VanDerWaalsContact C-N 3.3Å; V216-R218 PolarHBondContact O-N 3.22Å; R218-D285 VanDerWaalsContact CA-OD1 3.28Å; R218-D285 WeakPolarHBondContact CA-OD1 3.34Å
219	T	78.9	Confident	80.3	Confident	59 Å²	59	67.5 Å²	67.5	36%	0.362	33%	0.333	S	S	.	.	H	α-helix	trans	-127.4	-6.1	-179.6	62.8	0	0	0	0	113.6	V216 Q217 K222 D285	V216-T219 PolarHBondContact O-N 2.8Å; V216-T219 PolarHBondContact O-OG1 2.69Å; Q217-T219 PolarHBondContact O-N 3.41Å; T219-K222 PolarHBondContact O-N 3.42Å; T219-D285 PolarHBondContact N-OD2 3.27Å
220	I	85.6	Confident	81.8	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-71.2	-39.6	-172.1	-65.7	170.8	0	0	0	110.9	L212 V216 Q217 K222 Q223 I224 W243 A283 D285 I298	L212-I220 HydrophobicContact CD1-CD1 3.57Å; V216-I220 HydrophobicContact CG1-CD1 4.37Å; V216-I220 WeakPolarHBondContact O-CG1 3.46Å; Q217-I220 PolarHBondContact O-N 3.34Å; I220-K222 PolarHBondContact O-N 3.27Å; I220-K222 VanDerWaalsContact O-N 3.14Å; I220-Q223 PolarHBondContact O-N 3.48Å; I220-I224 HydrophobicContact CG2-CD1 3.68Å; I220-I224 HydrophobicContact CG2-CG1 3.97Å; I220-I224 WeakPolarHBondContact O-CG1 3.4Å; I220-I224 PolarHBondContact O-N 3Å; I220-W243 HydrophobicContact CD1-CH2 4.16Å; I220-W243 HydrophobicContact CD1-CZ2 4.35Å; I220-W243 HydrophobicContact CG1-CH2 4.35Å; I220-W243 HydrophobicContact CG1-CZ2 4.03Å; I220-W243 HydrophobicContact CG2-CD2 4.08Å; I220-W243 HydrophobicContact CG2-CE3 4.48Å; I220-W243 HydrophobicContact CG2-CG 4.37Å; I220-W243 HydrophobicContact CG2-CZ2 4.42Å; I220-A283 HydrophobicContact CD1-CB 3.46Å; I220-A283 VanDerWaalsContact CD1-CB 3.46Å; I220-D285 PolarHBondContact N-OD2 3.49Å; I220-D285 VanDerWaalsContact N-OD2 3.08Å; I220-I298 HydrophobicContact CB-CD1 4.22Å; I220-I298 HydrophobicContact CG2-CD1 3.72Å
221	A	85.9	Confident	82.5	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-62.9	-25.1	-177.9	0	0	0	0	0	113.3	D285 K287 F296	A221-D285 HydrophobicContact CB-CB 3.86Å; A221-D285 VanDerWaalsContact CB-OD2 3.23Å; A221-D285 WeakPolarHBondContact CB-OD2 3.48Å; A221-D285 PolarHBondContact N-OD2 2.87Å; A221-K287 HydrophobicContact CB-CB 4.03Å; A221-K287 HydrophobicContact CB-CD 4.4Å; A221-K287 PolarHBondContact O-NZ 3.1Å; A221-F296 HydrophobicContact CB-CD2 3.56Å; A221-F296 HydrophobicContact CB-CE2 3.96Å; A221-F296 HydrophobicContact CB-CG 4.22Å
222	K	86	Confident	83.2	Confident	170 Å²	170	77.2 Å²	77.2	74%	0.739	38%	0.376	S	S	*	.	H	α-helix	trans	-72.6	-31.5	173.5	-66.6	-178.1	-179	175.1	0	112.3	T219 I220	T219-K222 PolarHBondContact O-N 3.42Å; I220-K222 PolarHBondContact O-N 3.27Å; I220-K222 VanDerWaalsContact O-N 3.14Å
223	Q	89	Confident	83.2	Confident	96 Å²	96	78.5 Å²	78.5	45%	0.449	39%	0.392	S	S	.	.	H	α-helix	trans	-89.3	-16.2	-178.2	-60.1	176.8	14.9	0	0	113.2	I220 Q225	I220-Q223 PolarHBondContact O-N 3.48Å; Q223-Q225 PolarHBondContact O-N 3.3Å
224	I	92.5	Very high	83.3	Confident	7 Å²	7	83.9 Å²	83.9	4%	0.036	40%	0.403	C	S	.	.			trans	-74.5	126.4	177.6	-72.5	172	0	0	0	110.6	I220 M226 W243 V248 V250 I298	I220-I224 HydrophobicContact CG2-CD1 3.68Å; I220-I224 HydrophobicContact CG2-CG1 3.97Å; I220-I224 WeakPolarHBondContact O-CG1 3.4Å; I220-I224 PolarHBondContact O-N 3Å; I224-M226 HydrophobicContact CG2-SD 3.84Å; I224-W243 HydrophobicContact CG1-CB 4.03Å; I224-W243 HydrophobicContact CG1-CG 4.22Å; I224-V248 HydrophobicContact CD1-CG2 4.41Å; I224-V250 HydrophobicContact CD1-CG2 4.13Å; I224-V250 HydrophobicContact CG2-CG2 4.09Å; I224-I298 HydrophobicContact CD1-CB 4.49Å; I224-I298 HydrophobicContact CD1-CD1 3.48Å; I224-I298 VanDerWaalsContact CD1-CD1 3.48Å; I224-I298 HydrophobicContact CD1-CG1 3.68Å; I224-I298 HydrophobicContact CD1-CG2 3.95Å
225	Q	93.6	Very high	83.9	Confident	132 Å²	132	79 Å²	79	62%	0.617	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	115	164.8	-173.7	-178.2	19.4	0	0	109.5	Q223 G241 R242	Q223-Q225 PolarHBondContact O-N 3.3Å; Q225-G241 CarbonylContact O-C 3.6Å; Q225-G241 VanDerWaalsContact O-CA 3.22Å; Q225-G241 WeakPolarHBondContact O-CA 3.14Å; Q225-R242 PolarHBondContact N-O 3.4Å; Q225-R242 PolarHBondContact O-N 2.58Å
226	M	94.1	Very high	85.2	Confident	58 Å²	58	72 Å²	72	29%	0.286	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	127.7	172.8	-56	-63.1	-85.5	0	0	109	I224 W239 V250 V252 F296	I224-M226 HydrophobicContact CG2-SD 3.84Å; M226-W239 HydrophobicContact CB-CE3 4.21Å; M226-W239 HydrophobicContact CE-CB 3.32Å; M226-W239 HydrophobicContact CE-CD2 3.89Å; M226-W239 HydrophobicContact CE-CE3 4.37Å; M226-W239 HydrophobicContact CE-CG 3.4Å; M226-W239 VanDerWaalsContact CE-CG 3.4Å; M226-W239 HydrophobicContact SD-CB 4.4Å; M226-V250 HydrophobicContact CE-CB 4.13Å; M226-V250 HydrophobicContact CE-CG1 4.04Å; M226-V250 HydrophobicContact SD-CB 4.17Å; M226-V250 HydrophobicContact SD-CG1 4.14Å; M226-V250 HydrophobicContact SD-CG2 4.21Å; M226-V252 HydrophobicContact CE-CG2 3.68Å; M226-F296 HydrophobicContact CE-CZ 4.25Å; M226-F296 HydrophobicContact SD-CE2 4.08Å; M226-F296 HydrophobicContact SD-CZ 4.25Å
227	V	95.9	Very high	86.5	Confident	69 Å²	69	73.1 Å²	73.1	42%	0.418	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-61.2	-174.5	-178.2	0	0	0	0	111.4	L240 R242	V227-L240 WeakPolarHBondContact CA-O 3.44Å; V227-L240 HydrophobicContact CB-CD2 4.41Å; V227-L240 HydrophobicContact CB-CG 4.18Å; V227-L240 VanDerWaalsContact CB-O 3.3Å; V227-L240 WeakPolarHBondContact CB-O 3.3Å; V227-L240 HydrophobicContact CG1-CD2 4.35Å; V227-L240 HydrophobicContact CG2-CG 4.49Å; V227-L240 PolarHBondContact N-O 3.39Å; V227-R242 HydrophobicContact CG2-CB 4.44Å; V227-R242 HydrophobicContact CG2-CG 3.88Å
228	R	95.8	Very high	87.4	Confident	129 Å²	129	74.5 Å²	74.5	49%	0.487	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	152.1	179.3	67.4	179.5	-178.6	90.1	0.9	111	I230 W239 L240	R228-I230 HydrophobicContact CG-CG2 4.22Å; R228-W239 CarbonylContact O-C 3.55Å; R228-W239 WeakPolarHBondContact O-CA 3.23Å; R228-L240 HydrophobicContact CG-CB 4.2Å; R228-L240 HydrophobicContact CG-CD2 4.36Å; R228-L240 PolarHBondContact N-O 2.8Å; R228-L240 PolarHBondContact O-N 2.86Å
229	Q	95.6	Very high	88.6	Confident	78 Å²	78	68.6 Å²	68.6	36%	0.364	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	133.9	169.2	-168.1	173.4	2.4	0	0	109.7	G231 E237 W239	Q229-G231 WeakPolarHBondContact CG-O 3.4Å; Q229-G231 PolarHBondContact NE2-O 3.11Å; Q229-E237 PolarHBondContact NE2-OE1 3.15Å; Q229-W239 HydrophobicContact CB-CD2 4.16Å; Q229-W239 HydrophobicContact CB-CE3 4.42Å; Q229-W239 HydrophobicContact CB-CH2 4.38Å; Q229-W239 HydrophobicContact CB-CZ2 4.11Å
230	I	93.5	Very high	89.5	Confident	61 Å²	61	66.4 Å²	66.4	31%	0.313	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-15.3	178.2	62.1	176	0	0	0	112.6	R228 V238 L240 A249 Y301	R228-I230 HydrophobicContact CG-CG2 4.22Å; I230-V238 HydrophobicContact CD1-CG1 3.84Å; I230-V238 HydrophobicContact CG1-CB 4.06Å; I230-V238 HydrophobicContact CG1-CG1 3.75Å; I230-V238 WeakPolarHBondContact CG1-O 3.38Å; I230-V238 PolarHBondContact N-O 3.43Å; I230-L240 HydrophobicContact CG2-CB 3.62Å; I230-A249 HydrophobicContact CD1-CB 4.43Å; I230-Y301 HydrophobicContact CD1-CD2 3.97Å; I230-Y301 HydrophobicContact CD1-CE2 3.76Å
231	G	88.4	Confident	90	Very high	28 Å²	28	66.4 Å²	66.4	29%	0.289	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	165.1	176.3	0	0	0	0	0	112.9	Q229 V238	Q229-G231 WeakPolarHBondContact CG-O 3.4Å; Q229-G231 PolarHBondContact NE2-O 3.11Å; G231-V238 PolarHBondContact N-O 3.02Å; G231-V238 PolarHBondContact O-N 2.91Å
232	K	86.3	Confident	90.4	Very high	157 Å²	157	71.4 Å²	71.4	68%	0.683	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.5	119.5	170.4	-172.6	170.6	-178.2	171.9	0	107.9	E237	K232-E237 HydrophobicContact CG-CG 4.4Å
233	G	73.9	Confident	90.7	Very high	40 Å²	40	63.5 Å²	63.5	41%	0.412	30%	0.301	S	S	.	.			trans	-104.6	-173.7	178.3	0	0	0	0	0	111.7	G236	G233-G236 PolarHBondContact N-O 2.72Å
234	R	74.2	Confident	90.6	Very high	182 Å²	182	64.2 Å²	64.2	69%	0.687	30%	0.3	S	S	*	.	S	Bend	trans	-62.9	-43.4	177.5	-179.8	176.2	173.4	-176.1	3.8	112.5
235	Y	81	Confident	90.2	Very high	17 Å²	17	66.5 Å²	66.5	7%	0.067	32%	0.324	C	S	.	.	S	Bend	trans	-99.2	-5.5	-169.3	-47.9	-64	0	0	0	113.9	F254 E257 L373	Y235-F254 PolarHBondContact O-N 2.79Å; Y235-E257 WeakPolarHBondContact CD1-OE2 3.24Å; Y235-L373 WeakPolarHBondContact OH-CD2 3.3Å
236	G	86.5	Confident	90	Very high	1 Å²	1	65 Å²	65	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.7	-166.3	-172.2	0	0	0	0	0	114.1	G233 V252	G233-G236 PolarHBondContact N-O 2.72Å; G236-V252 CarbonylContact C-O 3.57Å; G236-V252 WeakPolarHBondContact CA-O 3.21Å
237	E	92.8	Very high	90.1	Very high	49 Å²	49	66.3 Å²	66.3	23%	0.229	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.7	-176.7	-60.1	-174.5	156.4	0	0	110.5	Q229 K232 W239 K251 V252	Q229-E237 PolarHBondContact NE2-OE1 3.15Å; K232-E237 HydrophobicContact CG-CG 4.4Å; E237-W239 PolarHBondContact OE2-NE1 3.04Å; E237-K251 CarbonylContact O-C 3.59Å; E237-K251 WeakPolarHBondContact O-CA 3.27Å; E237-V252 PolarHBondContact N-O 2.82Å; E237-V252 PolarHBondContact O-N 3.3Å
238	V	95	Very high	90.2	Very high	39 Å²	39	63 Å²	63	24%	0.236	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.7	175.1	-168.5	0	0	0	0	108.3	I230 G231 A249 V250 K251	I230-V238 HydrophobicContact CD1-CG1 3.84Å; I230-V238 HydrophobicContact CG1-CB 4.06Å; I230-V238 HydrophobicContact CG1-CG1 3.75Å; I230-V238 WeakPolarHBondContact CG1-O 3.38Å; I230-V238 PolarHBondContact N-O 3.43Å; G231-V238 PolarHBondContact N-O 3.02Å; G231-V238 PolarHBondContact O-N 2.91Å; V238-A249 HydrophobicContact CG1-CB 4.48Å; V238-V250 WeakPolarHBondContact CA-O 3.5Å; V238-K251 HydrophobicContact CG2-CB 4.38Å; V238-K251 HydrophobicContact CG2-CG 4.17Å
239	W	96.5	Very high	90.2	Very high	68 Å²	68	57.3 Å²	57.3	26%	0.258	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.4	-177.8	-72.7	73.6	0	0	0	110.6	M226 R228 Q229 E237 A249 V250	M226-W239 HydrophobicContact CB-CE3 4.21Å; M226-W239 HydrophobicContact CE-CB 3.32Å; M226-W239 HydrophobicContact CE-CD2 3.89Å; M226-W239 HydrophobicContact CE-CE3 4.37Å; M226-W239 HydrophobicContact CE-CG 3.4Å; M226-W239 VanDerWaalsContact CE-CG 3.4Å; M226-W239 HydrophobicContact SD-CB 4.4Å; R228-W239 CarbonylContact O-C 3.55Å; R228-W239 WeakPolarHBondContact O-CA 3.23Å; Q229-W239 HydrophobicContact CB-CD2 4.16Å; Q229-W239 HydrophobicContact CB-CE3 4.42Å; Q229-W239 HydrophobicContact CB-CH2 4.38Å; Q229-W239 HydrophobicContact CB-CZ2 4.11Å; E237-W239 PolarHBondContact OE2-NE1 3.04Å; W239-A249 CarbonylContact O-C 3.46Å; W239-A249 WeakPolarHBondContact O-CA 3.4Å; W239-V250 PolarHBondContact N-O 3.38Å; W239-V250 PolarHBondContact O-N 3.38Å
240	L	97.3	Very high	90.3	Very high	13 Å²	13	53.6 Å²	53.6	7%	0.068	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	123	159.9	170.6	63	0	0	0	107.4	V227 R228 I230 K247 Y301	V227-L240 WeakPolarHBondContact CA-O 3.44Å; V227-L240 HydrophobicContact CB-CD2 4.41Å; V227-L240 HydrophobicContact CB-CG 4.18Å; V227-L240 VanDerWaalsContact CB-O 3.3Å; V227-L240 WeakPolarHBondContact CB-O 3.3Å; V227-L240 HydrophobicContact CG1-CD2 4.35Å; V227-L240 HydrophobicContact CG2-CG 4.49Å; V227-L240 PolarHBondContact N-O 3.39Å; R228-L240 HydrophobicContact CG-CB 4.2Å; R228-L240 HydrophobicContact CG-CD2 4.36Å; R228-L240 PolarHBondContact N-O 2.8Å; R228-L240 PolarHBondContact O-N 2.86Å; I230-L240 HydrophobicContact CG2-CB 3.62Å; L240-K247 HydrophobicContact CD1-CB 3.88Å; L240-K247 HydrophobicContact CD1-CD 4.26Å; L240-K247 HydrophobicContact CD1-CG 4.08Å; L240-Y301 HydrophobicContact CB-CE2 4.41Å; L240-Y301 HydrophobicContact CD1-CD1 4.03Å; L240-Y301 HydrophobicContact CD1-CD2 3.71Å; L240-Y301 HydrophobicContact CD1-CE1 4.15Å; L240-Y301 HydrophobicContact CD1-CE2 3.83Å; L240-Y301 HydrophobicContact CD1-CG 3.8Å
241	G	96.5	Very high	90.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	166.5	171.4	0	0	0	0	0	111.8	Q225 V248	Q225-G241 CarbonylContact O-C 3.6Å; Q225-G241 VanDerWaalsContact O-CA 3.22Å; Q225-G241 WeakPolarHBondContact O-CA 3.14Å; G241-V248 PolarHBondContact N-O 2.82Å; G241-V248 PolarHBondContact O-N 3.22Å
242	R	94.9	Very high	90.6	Very high	106 Å²	106	51.1 Å²	51.1	40%	0.4	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.8	165.1	-75.2	179.7	-177.5	-86.7	8.6	109.6	Q225 V227 G245 E246	Q225-R242 PolarHBondContact N-O 3.4Å; Q225-R242 PolarHBondContact O-N 2.58Å; V227-R242 HydrophobicContact CG2-CB 4.44Å; V227-R242 HydrophobicContact CG2-CG 3.88Å; R242-G245 PolarHBondContact NH1-O 2.82Å; R242-E246 VanDerWaalsContact CA-O 3.28Å; R242-E246 WeakPolarHBondContact CA-O 3.43Å
243	W	91.4	Very high	90.9	Very high	3 Å²	3	43.9 Å²	43.9	1%	0.011	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	116.9	171.3	-173	46.7	0	0	0	108.2	L196 L212 I220 I224 G245 E246 V248 I282	L196-W243 HydrophobicContact CD1-CE3 3.51Å; L196-W243 HydrophobicContact CD1-CH2 4.26Å; L196-W243 HydrophobicContact CD1-CZ3 3.15Å; L212-W243 HydrophobicContact CD1-CH2 3.52Å; L212-W243 HydrophobicContact CD1-CZ3 3.81Å; I220-W243 HydrophobicContact CD1-CH2 4.16Å; I220-W243 HydrophobicContact CD1-CZ2 4.35Å; I220-W243 HydrophobicContact CG1-CH2 4.35Å; I220-W243 HydrophobicContact CG1-CZ2 4.03Å; I220-W243 HydrophobicContact CG2-CD2 4.08Å; I220-W243 HydrophobicContact CG2-CE3 4.48Å; I220-W243 HydrophobicContact CG2-CG 4.37Å; I220-W243 HydrophobicContact CG2-CZ2 4.42Å; I224-W243 HydrophobicContact CG1-CB 4.03Å; I224-W243 HydrophobicContact CG1-CG 4.22Å; W243-G245 VanDerWaalsContact C-N 3.26Å; W243-G245 PolarHBondContact O-N 3.02Å; W243-E246 PolarHBondContact N-O 2.76Å; W243-E246 PolarHBondContact O-N 2.94Å; W243-V248 HydrophobicContact CB-CG1 4.27Å; W243-V248 HydrophobicContact CB-CG2 4.31Å; W243-I282 HydrophobicContact CZ3-CG2 4.09Å
244	R	86.4	Confident	91.4	Very high	112 Å²	112	45.6 Å²	45.6	42%	0.423	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	40.6	-178.9	-59.3	176.5	172	-171	-9.4	113.8	I190 L199 E246	I190-R244 VanDerWaalsContact CB-NH1 3.32Å; I190-R244 VanDerWaalsContact CD1-NH2 3.3Å; L199-R244 VanDerWaalsContact CD1-NH1 3.31Å; R244-E246 PolarHBondContact O-N 2.81Å
245	G	84	Confident	91.6	Very high	54 Å²	54	40.8 Å²	40.8	56%	0.557	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.4	-24.6	-178.5	0	0	0	0	0	114.8	R242 W243	R242-G245 PolarHBondContact NH1-O 2.82Å; W243-G245 VanDerWaalsContact C-N 3.26Å; W243-G245 PolarHBondContact O-N 3.02Å
246	E	91	Very high	91.7	Very high	100 Å²	100	49.5 Å²	49.5	47%	0.467	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	146.1	179.5	-69.2	-62.8	140.9	0	0	112.3	L196 R242 W243 R244	L196-E246 HydrophobicContact CB-CB 4.42Å; L196-E246 HydrophobicContact CB-CG 4.09Å; L196-E246 HydrophobicContact CD2-CB 4.26Å; R242-E246 VanDerWaalsContact CA-O 3.28Å; R242-E246 WeakPolarHBondContact CA-O 3.43Å; W243-E246 PolarHBondContact N-O 2.76Å; W243-E246 PolarHBondContact O-N 2.94Å; R244-E246 PolarHBondContact O-N 2.81Å
247	K	95.8	Very high	91.6	Very high	86 Å²	86	51.7 Å²	51.7	37%	0.374	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	129.3	176.4	-67.7	-179.5	-174	170.2	0	109.8	L240 Y301	L240-K247 HydrophobicContact CD1-CB 3.88Å; L240-K247 HydrophobicContact CD1-CD 4.26Å; L240-K247 HydrophobicContact CD1-CG 4.08Å; K247-Y301 HydrophobicContact CB-CD1 3.78Å; K247-Y301 HydrophobicContact CB-CG 4.16Å; K247-Y301 HydrophobicContact CD-CD1 3.86Å; K247-Y301 HydrophobicContact CD-CE1 3.93Å; K247-Y301 HydrophobicContact CG-CD1 4.47Å; K247-Y301 WeakPolarHBondContact O-CB 3.49Å
248	V	97	Very high	91.4	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	153.2	175.6	-63.9	0	0	0	0	110.3	L196 I224 G241 W243 V250 I282 I298	L196-V248 HydrophobicContact CD2-CG1 3.99Å; I224-V248 HydrophobicContact CD1-CG2 4.41Å; G241-V248 PolarHBondContact N-O 2.82Å; G241-V248 PolarHBondContact O-N 3.22Å; W243-V248 HydrophobicContact CB-CG1 4.27Å; W243-V248 HydrophobicContact CB-CG2 4.31Å; V248-V250 HydrophobicContact CG2-CG2 4.02Å; V248-I282 HydrophobicContact CB-CD1 4.43Å; V248-I282 HydrophobicContact CG1-CD1 3.76Å; V248-I298 HydrophobicContact CB-CG2 4.13Å; V248-I298 HydrophobicContact CG1-CG2 4.49Å; V248-I298 HydrophobicContact CG2-CG2 4.3Å
249	A	97.4	Very high	91.1	Very high	10 Å²	10	56.9 Å²	56.9	8%	0.083	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	134.2	168.9	0	0	0	0	0	108.8	I230 V238 W239 I298 T299 Y301	I230-A249 HydrophobicContact CD1-CB 4.43Å; V238-A249 HydrophobicContact CG1-CB 4.48Å; W239-A249 CarbonylContact O-C 3.46Å; W239-A249 WeakPolarHBondContact O-CA 3.4Å; A249-I298 WeakPolarHBondContact O-CA 3.46Å; A249-T299 PolarHBondContact N-O 2.84Å; A249-T299 PolarHBondContact O-N 2.96Å; A249-Y301 HydrophobicContact CB-CD2 4.41Å
250	V	96.4	Very high	90.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	106.9	-176.6	-172.9	0	0	0	0	108.3	I224 M226 V238 W239 V248 V252 F296 L297 I298	I224-V250 HydrophobicContact CD1-CG2 4.13Å; I224-V250 HydrophobicContact CG2-CG2 4.09Å; M226-V250 HydrophobicContact CE-CB 4.13Å; M226-V250 HydrophobicContact CE-CG1 4.04Å; M226-V250 HydrophobicContact SD-CB 4.17Å; M226-V250 HydrophobicContact SD-CG1 4.14Å; M226-V250 HydrophobicContact SD-CG2 4.21Å; V238-V250 WeakPolarHBondContact CA-O 3.5Å; W239-V250 PolarHBondContact N-O 3.38Å; W239-V250 PolarHBondContact O-N 3.38Å; V248-V250 HydrophobicContact CG2-CG2 4.02Å; V250-V252 HydrophobicContact CG1-CG2 4.03Å; V250-F296 HydrophobicContact CG1-CB 4.19Å; V250-F296 HydrophobicContact CG1-CD1 4.35Å; V250-F296 HydrophobicContact CG1-CD2 3.44Å; V250-F296 VanDerWaalsContact CG1-CD2 3.44Å; V250-F296 HydrophobicContact CG1-CE2 3.79Å; V250-F296 HydrophobicContact CG1-CG 3.75Å; V250-F296 HydrophobicContact CG1-CZ 4.38Å; V250-L297 WeakPolarHBondContact CA-O 3.46Å; V250-I298 HydrophobicContact CG1-CG1 4.36Å; V250-I298 HydrophobicContact CG2-CG1 4.48Å
251	K	95.6	Very high	90.5	Very high	23 Å²	23	55.4 Å²	55.4	10%	0.1	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	113.9	171.5	-171.2	177.3	-172.5	-174.6	0	108.1	E237 V238 F253 E264 F296 L297 D370	E237-K251 CarbonylContact O-C 3.59Å; E237-K251 WeakPolarHBondContact O-CA 3.27Å; V238-K251 HydrophobicContact CG2-CB 4.38Å; V238-K251 HydrophobicContact CG2-CG 4.17Å; K251-F253 HydrophobicContact CB-CE2 4.05Å; K251-F253 HydrophobicContact CD-CE1 4.3Å; K251-F253 HydrophobicContact CD-CE2 3.74Å; K251-F253 HydrophobicContact CD-CZ 3.51Å; K251-F253 HydrophobicContact CG-CD2 4.21Å; K251-F253 HydrophobicContact CG-CE2 3.62Å; K251-F253 HydrophobicContact CG-CZ 3.89Å; K251-E264 IonicContact NZ-OE1 2.73Å; K251-E264 PolarHBondContact NZ-OE1 2.64Å; K251-E264 IonicContact NZ-OE2 3.6Å; K251-E264 PolarHBondContact NZ-OE2 2.84Å; K251-F296 WeakPolarHBondContact O-CA 3.4Å; K251-L297 HydrophobicContact CB-CB 4.26Å; K251-L297 HydrophobicContact CD-CD2 4.4Å; K251-L297 PolarHBondContact N-O 3.24Å; K251-L297 PolarHBondContact O-N 3.39Å; K251-D370 IonicContact NZ-OD1 2.64Å; K251-D370 PolarHBondContact NZ-OD1 2.75Å
252	V	93.8	Very high	90.2	Very high	14 Å²	14	61.2 Å²	61.2	9%	0.085	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	112.9	179.7	-174	0	0	0	0	108.2	M226 G236 E237 V250 Q294 L295 F296	M226-V252 HydrophobicContact CE-CG2 3.68Å; G236-V252 CarbonylContact C-O 3.57Å; G236-V252 WeakPolarHBondContact CA-O 3.21Å; E237-V252 PolarHBondContact N-O 2.82Å; E237-V252 PolarHBondContact O-N 3.3Å; V250-V252 HydrophobicContact CG1-CG2 4.03Å; V252-Q294 HydrophobicContact CG1-CB 4.02Å; V252-Q294 HydrophobicContact CG1-CG 4.32Å; V252-L295 WeakPolarHBondContact CA-O 3.29Å; V252-F296 HydrophobicContact CB-CD1 4.42Å; V252-F296 HydrophobicContact CB-CE1 4.28Å; V252-F296 HydrophobicContact CG1-CD1 4.11Å; V252-F296 HydrophobicContact CG1-CE1 3.8Å; V252-F296 HydrophobicContact CG2-CD1 3.92Å; V252-F296 HydrophobicContact CG2-CE1 3.61Å; V252-F296 HydrophobicContact CG2-CZ 4.14Å
253	F	92.2	Very high	90	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.018	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	148.1	180	-63.2	-110.1	0	0	0	110.6	K251 W261 E264 L295 L297	K251-F253 HydrophobicContact CB-CE2 4.05Å; K251-F253 HydrophobicContact CD-CE1 4.3Å; K251-F253 HydrophobicContact CD-CE2 3.74Å; K251-F253 HydrophobicContact CD-CZ 3.51Å; K251-F253 HydrophobicContact CG-CD2 4.21Å; K251-F253 HydrophobicContact CG-CE2 3.62Å; K251-F253 HydrophobicContact CG-CZ 3.89Å; F253-W261 HydrophobicContact CB-CB 4.21Å; F253-W261 HydrophobicContact CD1-CB 3.9Å; F253-W261 HydrophobicContact CD2-CB 3.93Å; F253-W261 AromaticContact CD2-CD1 3.54Å; F253-W261 HydrophobicContact CD2-CG 4.1Å; F253-W261 HydrophobicContact CE1-CB 4.18Å; F253-W261 HydrophobicContact CE2-CB 4.22Å; F253-W261 AromaticContact CE2-CD1 3.63Å; F253-W261 HydrophobicContact CE2-CG 4.33Å; F253-W261 HydrophobicContact CG-CB 3.76Å; F253-W261 HydrophobicContact CG-CG 4.38Å; F253-W261 HydrophobicContact CZ-CB 4.32Å; F253-E264 VanDerWaalsContact CZ-OE2 3.25Å; F253-E264 WeakPolarHBondContact CZ-OE2 3.38Å; F253-L295 HydrophobicContact CB-CB 4.23Å; F253-L295 PolarHBondContact N-O 3.23Å; F253-L297 HydrophobicContact CE2-CB 3.78Å; F253-L297 HydrophobicContact CE2-CD2 4.44Å; F253-L297 HydrophobicContact CZ-CD2 4.46Å
254	F	83.4	Confident	90.2	Very high	77 Å²	77	59.3 Å²	59.3	34%	0.338	29%	0.294	S	S	.	.			trans	-67.8	145.7	166.9	-58.1	-60.1	0	0	0	109.6	Y235 R256 E257	Y235-F254 PolarHBondContact O-N 2.79Å; F254-R256 HydrophobicContact CB-CG 4.14Å; F254-R256 PolarHBondContact O-N 2.96Å; F254-R256 VanDerWaalsContact O-N 3.15Å; F254-E257 HydrophobicContact CB-CG 4.21Å; F254-E257 WeakPolarHBondContact O-CA 3.5Å; F254-E257 WeakPolarHBondContact O-CB 3.32Å; F254-E257 PolarHBondContact O-N 3.31Å
255	T	78.8	Confident	90.5	Very high	81 Å²	81	54.4 Å²	54.4	50%	0.497	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-54.7	-35.8	-179.2	43.8	0	0	0	0	113.5	E257 E258 T293	T255-E257 PolarHBondContact O-N 3.43Å; T255-E258 PolarHBondContact O-N 2.91Å; T255-T293 WeakPolarHBondContact CG2-O 3.22Å
256	R	82.7	Confident	91	Very high	199 Å²	199	55.7 Å²	55.7	75%	0.751	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-65.5	-15.6	175.8	69.1	-176.4	-179.9	-166.3	-4.5	114.5	F254	F254-R256 HydrophobicContact CB-CG 4.14Å; F254-R256 PolarHBondContact O-N 2.96Å; F254-R256 VanDerWaalsContact O-N 3.15Å
257	E	85.1	Confident	91.2	Very high	47 Å²	47	51 Å²	51	22%	0.22	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-101.9	24.6	-178.9	-54.8	-64.8	162.4	0	0	111.9	Y235 F254 T255 A259 S260 W261	Y235-E257 WeakPolarHBondContact CD1-OE2 3.24Å; F254-E257 HydrophobicContact CB-CG 4.21Å; F254-E257 WeakPolarHBondContact O-CA 3.5Å; F254-E257 WeakPolarHBondContact O-CB 3.32Å; F254-E257 PolarHBondContact O-N 3.31Å; T255-E257 PolarHBondContact O-N 3.43Å; E257-A259 VanDerWaalsContact C-N 3.26Å; E257-A259 PolarHBondContact O-N 2.92Å; E257-S260 WeakPolarHBondContact O-CB 3.21Å; E257-S260 PolarHBondContact O-N 3.39Å; E257-W261 PolarHBondContact O-N 3.49Å
258	E	88.4	Confident	91.2	Very high	118 Å²	118	47.1 Å²	47.1	55%	0.551	23%	0.229	S	C	*	.	H	α-helix	trans	-54.1	-41	179.6	-177.2	176.8	179.4	0	0	112.6	T255 S260 W261 F262 L295	T255-E258 PolarHBondContact O-N 2.91Å; E258-S260 VanDerWaalsContact C-N 3.28Å; E258-S260 PolarHBondContact O-N 3.46Å; E258-W261 PolarHBondContact O-N 2.91Å; E258-F262 WeakPolarHBondContact O-CB 3.48Å; E258-F262 PolarHBondContact O-N 3.23Å; E258-L295 HydrophobicContact CB-CD1 3.86Å; E258-L295 HydrophobicContact CG-CD1 3.98Å
259	A	88.3	Confident	91	Very high	79 Å²	79	50.1 Å²	50.1	65%	0.653	24%	0.243	S	C	*	.	H	α-helix	trans	-61.3	-36	177	0	0	0	0	0	112.7	E257 R263	E257-A259 VanDerWaalsContact C-N 3.26Å; E257-A259 PolarHBondContact O-N 2.92Å; A259-R263 VanDerWaalsContact O-CB 3.3Å; A259-R263 WeakPolarHBondContact O-CB 3.42Å; A259-R263 PolarHBondContact O-N 3.09Å
260	S	88.4	Confident	90.8	Very high	20 Å²	20	50.2 Å²	50.2	14%	0.14	24%	0.243	C	C	.	.	H	α-helix	trans	-71.9	-41	175.6	-63	0	0	0	0	111.9	E257 E258 E264	E257-S260 WeakPolarHBondContact O-CB 3.21Å; E257-S260 PolarHBondContact O-N 3.39Å; E258-S260 VanDerWaalsContact C-N 3.28Å; E258-S260 PolarHBondContact O-N 3.46Å; S260-E264 WeakPolarHBondContact O-CB 3.47Å; S260-E264 PolarHBondContact O-N 2.84Å
261	W	92.4	Very high	90.5	Very high	30 Å²	30	51.7 Å²	51.7	11%	0.114	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-45.2	174.3	170.9	77.9	0	0	0	111.9	F253 E257 E258 E264 T265 A284 I286 L295 F296	F253-W261 HydrophobicContact CB-CB 4.21Å; F253-W261 HydrophobicContact CD1-CB 3.9Å; F253-W261 HydrophobicContact CD2-CB 3.93Å; F253-W261 AromaticContact CD2-CD1 3.54Å; F253-W261 HydrophobicContact CD2-CG 4.1Å; F253-W261 HydrophobicContact CE1-CB 4.18Å; F253-W261 HydrophobicContact CE2-CB 4.22Å; F253-W261 AromaticContact CE2-CD1 3.63Å; F253-W261 HydrophobicContact CE2-CG 4.33Å; F253-W261 HydrophobicContact CG-CB 3.76Å; F253-W261 HydrophobicContact CG-CG 4.38Å; F253-W261 HydrophobicContact CZ-CB 4.32Å; E257-W261 PolarHBondContact O-N 3.49Å; E258-W261 PolarHBondContact O-N 2.91Å; W261-E264 PolarHBondContact O-N 2.83Å; W261-T265 VanDerWaalsContact O-CB 3.26Å; W261-T265 WeakPolarHBondContact O-CB 3.49Å; W261-T265 PolarHBondContact O-N 2.84Å; W261-T265 PolarHBondContact O-OG1 3.49Å; W261-A284 HydrophobicContact CZ2-CB 3.84Å; W261-I286 HydrophobicContact CH2-CD1 4.08Å; W261-I286 HydrophobicContact CH2-CG1 4.06Å; W261-I286 HydrophobicContact CZ2-CG1 4.26Å; W261-L295 HydrophobicContact CB-CB 4.26Å; W261-L295 HydrophobicContact CB-CD1 4.02Å; W261-L295 HydrophobicContact CD2-CB 3.86Å; W261-L295 HydrophobicContact CD2-CD1 4.15Å; W261-L295 HydrophobicContact CD2-CD2 4.45Å; W261-L295 HydrophobicContact CD2-CG 4.38Å; W261-L295 HydrophobicContact CE3-CD1 4.12Å; W261-L295 HydrophobicContact CE3-CD2 4.33Å; W261-L295 HydrophobicContact CG-CB 3.7Å; W261-L295 HydrophobicContact CG-CD1 4.12Å; W261-L295 HydrophobicContact CG-CG 4.48Å; W261-L295 HydrophobicContact CZ3-CD2 4.47Å; W261-F296 PolarHBondContact NE1-O 3.19Å
262	F	91.6	Very high	90.4	Very high	123 Å²	123	55 Å²	55	54%	0.539	27%	0.27	S	S	.	.	H	α-helix	trans	-61.2	-52	179	-175.3	-90.2	0	0	0	110.7	E258 E264 T265 E266	E258-F262 WeakPolarHBondContact O-CB 3.48Å; E258-F262 PolarHBondContact O-N 3.23Å; F262-E264 PolarHBondContact O-N 3.45Å; F262-T265 PolarHBondContact O-N 3Å; F262-E266 VanDerWaalsContact O-CB 3.3Å; F262-E266 WeakPolarHBondContact O-CB 3.41Å; F262-E266 PolarHBondContact O-N 3.19Å
263	R	90.6	Very high	90.4	Very high	65 Å²	65	54.4 Å²	54.4	25%	0.245	27%	0.266	C	S	.	.	H	α-helix	trans	-57	-48.9	178.3	176.6	174.7	-74.4	-131.6	-5.7	112.1	A259 T265 E266 I267 G372	A259-R263 VanDerWaalsContact O-CB 3.3Å; A259-R263 WeakPolarHBondContact O-CB 3.42Å; A259-R263 PolarHBondContact O-N 3.09Å; R263-T265 VanDerWaalsContact C-N 3.34Å; R263-T265 PolarHBondContact O-N 3.27Å; R263-E266 PolarHBondContact O-N 3.2Å; R263-I267 VanDerWaalsContact O-CG1 3.23Å; R263-I267 WeakPolarHBondContact O-CG1 3.25Å; R263-I267 PolarHBondContact O-N 2.97Å; R263-G372 WeakPolarHBondContact CD-O 3.05Å
264	E	94.1	Very high	90.4	Very high	3 Å²	3	58 Å²	58	1%	0.014	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-41.5	-178.5	-167.3	167.2	170.7	0	0	111.6	K251 F253 S260 W261 F262 I267 Y268 L297	K251-E264 IonicContact NZ-OE1 2.73Å; K251-E264 PolarHBondContact NZ-OE1 2.64Å; K251-E264 IonicContact NZ-OE2 3.6Å; K251-E264 PolarHBondContact NZ-OE2 2.84Å; F253-E264 VanDerWaalsContact CZ-OE2 3.25Å; F253-E264 WeakPolarHBondContact CZ-OE2 3.38Å; S260-E264 WeakPolarHBondContact O-CB 3.47Å; S260-E264 PolarHBondContact O-N 2.84Å; W261-E264 PolarHBondContact O-N 2.83Å; F262-E264 PolarHBondContact O-N 3.45Å; E264-I267 PolarHBondContact O-N 3.36Å; E264-Y268 HydrophobicContact CG-CD2 3.93Å; E264-Y268 HydrophobicContact CG-CE2 3.74Å; E264-Y268 WeakPolarHBondContact O-CD2 3.45Å; E264-Y268 PolarHBondContact O-N 2.75Å; E264-L297 HydrophobicContact CG-CD2 3.74Å; E264-L297 WeakPolarHBondContact OE1-CD2 3.32Å
265	T	94.2	Very high	91.1	Very high	10 Å²	10	57.1 Å²	57.1	6%	0.061	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-47	175.1	-61	0	0	0	0	111.4	W261 F262 R263 I267 Y268 Q269 A284	W261-T265 VanDerWaalsContact O-CB 3.26Å; W261-T265 WeakPolarHBondContact O-CB 3.49Å; W261-T265 PolarHBondContact O-N 2.84Å; W261-T265 PolarHBondContact O-OG1 3.49Å; F262-T265 PolarHBondContact O-N 3Å; R263-T265 VanDerWaalsContact C-N 3.34Å; R263-T265 PolarHBondContact O-N 3.27Å; T265-I267 VanDerWaalsContact C-N 3.32Å; T265-I267 PolarHBondContact O-N 2.95Å; T265-Y268 PolarHBondContact O-N 2.84Å; T265-Q269 HydrophobicContact CG2-CG 4.29Å; T265-Q269 WeakPolarHBondContact O-CB 3.48Å; T265-Q269 WeakPolarHBondContact O-CG 3.37Å; T265-Q269 PolarHBondContact O-N 2.84Å; T265-A284 HydrophobicContact CG2-CB 3.38Å
266	E	93.8	Very high	91.9	Very high	81 Å²	81	58.5 Å²	58.5	38%	0.379	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-37.4	179.8	-165.9	-146.5	138.7	0	0	112.3	F262 R263 T270 K376	F262-E266 VanDerWaalsContact O-CB 3.3Å; F262-E266 WeakPolarHBondContact O-CB 3.41Å; F262-E266 PolarHBondContact O-N 3.19Å; R263-E266 PolarHBondContact O-N 3.2Å; E266-T270 PolarHBondContact O-N 3.24Å; E266-T270 PolarHBondContact O-OG1 2.99Å; E266-K376 PolarHBondContact O-NZ 3.11Å; E266-K376 IonicContact OE1-NZ 2.67Å; E266-K376 PolarHBondContact OE1-NZ 3.33Å
267	I	94.6	Very high	92.7	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-49.5	174.3	-64.8	-80.4	0	0	0	109.8	R263 E264 T265 Q269 T270 L371 A374 K376	R263-I267 VanDerWaalsContact O-CG1 3.23Å; R263-I267 WeakPolarHBondContact O-CG1 3.25Å; R263-I267 PolarHBondContact O-N 2.97Å; E264-I267 PolarHBondContact O-N 3.36Å; T265-I267 VanDerWaalsContact C-N 3.32Å; T265-I267 PolarHBondContact O-N 2.95Å; I267-Q269 VanDerWaalsContact C-N 3.3Å; I267-Q269 PolarHBondContact O-N 2.91Å; I267-T270 WeakPolarHBondContact O-CB 3.42Å; I267-T270 PolarHBondContact O-N 3.12Å; I267-T270 VanDerWaalsContact O-N 3.15Å; I267-T270 PolarHBondContact O-OG1 2.81Å; I267-L371 HydrophobicContact CB-CB 4.29Å; I267-L371 HydrophobicContact CG2-CB 3.66Å; I267-L371 HydrophobicContact CG2-CD1 3.75Å; I267-L371 HydrophobicContact CG2-CG 4.31Å; I267-A374 HydrophobicContact CD1-CB 3.97Å; I267-A374 HydrophobicContact CG1-CB 4.26Å; I267-A374 HydrophobicContact CG2-CB 4.21Å; I267-K376 HydrophobicContact CD1-CD 4.16Å; I267-K376 VanDerWaalsContact CD1-CE 3.41Å; I267-K376 HydrophobicContact CD1-CG 3.76Å
268	Y	95.5	Very high	93.3	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-60.7	-37.5	178.6	-85.4	-62.3	0	0	0	113.1	S210 E264 T265 T270 L279 F281 L297 D370 L371	S210-Y268 PolarHBondContact OG-O 3.33Å; E264-Y268 HydrophobicContact CG-CD2 3.93Å; E264-Y268 HydrophobicContact CG-CE2 3.74Å; E264-Y268 WeakPolarHBondContact O-CD2 3.45Å; E264-Y268 PolarHBondContact O-N 2.75Å; T265-Y268 PolarHBondContact O-N 2.84Å; Y268-T270 PolarHBondContact O-N 2.83Å; Y268-L279 HydrophobicContact CE1-CB 4.32Å; Y268-F281 HydrophobicContact CD1-CB 3.84Å; Y268-F281 HydrophobicContact CG-CB 3.98Å; Y268-F281 HydrophobicContact CG-CD2 4.15Å; Y268-F281 HydrophobicContact CG-CG 4.29Å; Y268-L297 HydrophobicContact CD2-CD1 4.26Å; Y268-L297 HydrophobicContact CD2-CD2 4.06Å; Y268-L297 HydrophobicContact CE2-CD2 3.91Å; Y268-D370 PolarHBondContact OH-N 3.3Å; Y268-L371 HydrophobicContact CD1-CD1 3.86Å; Y268-L371 HydrophobicContact CE1-CD1 3.57Å; Y268-L371 HydrophobicContact CE1-CG 4.12Å; Y268-L371 HydrophobicContact CE2-CB 4.35Å; Y268-L371 HydrophobicContact CE2-CD1 4.37Å; Y268-L371 HydrophobicContact CE2-CG 4.31Å; Y268-L371 HydrophobicContact CG-CD1 4.38Å
269	Q	93.8	Very high	93.8	Very high	62 Å²	62	42.7 Å²	42.7	29%	0.29	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-5.9	179.6	-73.5	-179.2	-20.2	0	0	114.2	T265 I267 V271 F281	T265-Q269 HydrophobicContact CG2-CG 4.29Å; T265-Q269 WeakPolarHBondContact O-CB 3.48Å; T265-Q269 WeakPolarHBondContact O-CG 3.37Å; T265-Q269 PolarHBondContact O-N 2.84Å; I267-Q269 VanDerWaalsContact C-N 3.3Å; I267-Q269 PolarHBondContact O-N 2.91Å; Q269-V271 PolarHBondContact O-N 3.44Å; Q269-F281 HydrophobicContact CG-CD1 4.38Å; Q269-F281 HydrophobicContact CG-CE1 3.61Å; Q269-F281 HydrophobicContact CG-CZ 3.82Å
270	T	92.8	Very high	94.2	Very high	12 Å²	12	39.2 Å²	39.2	7%	0.074	19%	0.185	C	C	.	.	S	Bend	trans	-50.9	140	177.4	-57.6	0	0	0	0	111.3	E266 I267 Y268 M273 K345 P346 I348 K376	E266-T270 PolarHBondContact O-N 3.24Å; E266-T270 PolarHBondContact O-OG1 2.99Å; I267-T270 WeakPolarHBondContact O-CB 3.42Å; I267-T270 PolarHBondContact O-N 3.12Å; I267-T270 VanDerWaalsContact O-N 3.15Å; I267-T270 PolarHBondContact O-OG1 2.81Å; Y268-T270 PolarHBondContact O-N 2.83Å; T270-M273 WeakPolarHBondContact O-CB 3.47Å; T270-M273 PolarHBondContact O-N 3.41Å; T270-K345 HydrophobicContact CG2-CG 4.26Å; T270-P346 HydrophobicContact CG2-CG 4.06Å; T270-I348 HydrophobicContact CG2-CD1 4.35Å; T270-K376 VanDerWaalsContact OG1-CE 3.26Å; T270-K376 WeakPolarHBondContact OG1-CE 3.28Å; T270-K376 PolarHBondContact OG1-NZ 3.14Å
271	V	91	Very high	94.5	Very high	31 Å²	31	38.4 Å²	38.4	19%	0.188	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	140.1	-179.7	-175.9	0	0	0	0	110.3	Q269 M273 Q343 K345	Q269-V271 PolarHBondContact O-N 3.44Å; V271-M273 PolarHBondContact O-N 3.05Å; V271-M273 VanDerWaalsContact O-N 3.07Å; V271-Q343 HydrophobicContact CG1-CB 3.79Å; V271-Q343 WeakPolarHBondContact CG1-O 3.23Å; V271-Q343 HydrophobicContact CG2-CB 4.48Å; V271-K345 WeakPolarHBondContact O-CB 3.44Å; V271-K345 WeakPolarHBondContact O-CG 3.41Å
272	L	92.2	Very high	94.5	Very high	93 Å²	93	37 Å²	37	49%	0.487	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	21.2	-175.2	-54.5	168.7	0	0	0	114.7	R274 H334 I339 K345	L272-R274 VanDerWaalsContact C-N 3.34Å; L272-H334 PolarHBondContact O-CE1 3.01Å; L272-H334 PolarHBondContact O-NE2 3.03Å; L272-H334 VanDerWaalsContact O-NE2 3.11Å; L272-I339 HydrophobicContact CB-CD1 4.36Å; L272-I339 HydrophobicContact CD1-CB 4.33Å; L272-I339 HydrophobicContact CD1-CG2 3.86Å; L272-K345 HydrophobicContact CB-CB 4.15Å
273	M	94.3	Very high	94.6	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	15%	0.148	C	C	.	.			trans	-74.7	-21.6	177.2	-170.3	61.8	-117.1	0	0	113.6	T270 V271 H275 I278 H334 L335 I348	T270-M273 WeakPolarHBondContact O-CB 3.47Å; T270-M273 PolarHBondContact O-N 3.41Å; V271-M273 PolarHBondContact O-N 3.05Å; V271-M273 VanDerWaalsContact O-N 3.07Å; M273-H275 PolarHBondContact O-N 3.31Å; M273-I278 HydrophobicContact CE-CB 4.34Å; M273-I278 HydrophobicContact CE-CD1 4.08Å; M273-I278 HydrophobicContact CE-CG1 3.78Å; M273-I278 HydrophobicContact CE-CG2 3.8Å; M273-H334 PolarHBondContact O-NE2 2.9Å; M273-L335 HydrophobicContact CE-CD2 3.32Å; M273-L335 HydrophobicContact CE-CG 4Å; M273-L335 HydrophobicContact SD-CD2 4.09Å; M273-I348 HydrophobicContact SD-CD1 3.6Å; M273-I348 VanDerWaalsContact SD-CD1 3.6Å
274	R	93.4	Very high	94.7	Very high	80 Å²	80	28.5 Å²	28.5	30%	0.302	14%	0.14	S	C	.	.			trans	-71.1	123.7	-178.4	-168.6	168.8	-178.8	90.2	1.7	109.9	L272 F281	L272-R274 VanDerWaalsContact C-N 3.34Å; R274-F281 PolarHBondContact NH1-O 3.03Å
275	H	96.5	Very high	94.7	Very high	57 Å²	57	28.8 Å²	28.8	26%	0.264	14%	0.141	S	C	.	.			trans	-148.1	152.1	179	178.2	-94.9	0	0	0	108.9	M273 N277 I278 H334	M273-H275 PolarHBondContact O-N 3.31Å; H275-N277 PolarHBondContact CE1-OD1 3.15Å; H275-N277 PolarHBondContact ND1-N 2.9Å; H275-N277 PolarHBondContact O-N 3.21Å; H275-I278 HydrophobicContact CB-CB 4.3Å; H275-I278 HydrophobicContact CB-CG1 3.94Å; H275-I278 PolarHBondContact O-N 2.89Å; H275-I278 VanDerWaalsContact O-O 3.08Å; H275-H334 HydrophobicContact CB-CB 4.35Å; H275-H334 VanDerWaalsContact CB-CD2 3.48Å; H275-H334 WeakPolarHBondContact CB-CD2 3.45Å; H275-H334 AromaticContact CD2-CG 3.88Å; H275-H334 AromaticContact CD2-ND1 3.91Å; H275-H334 AromaticContact CG-CD2 4Å; H275-H334 AromaticContact CG-CG 3.71Å
276	E	96.9	Very high	94.4	Very high	110 Å²	110	32.5 Å²	32.5	51%	0.514	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-40.6	-177.5	-170.4	-175.7	163.9	0	0	111.2	I278 K361	E276-I278 VanDerWaalsContact C-N 3.32Å; E276-I278 PolarHBondContact O-N 3.4Å; E276-K361 VanDerWaalsContact O-CE 3.23Å; E276-K361 WeakPolarHBondContact O-CE 3.31Å; E276-K361 PolarHBondContact O-NZ 2.8Å
277	N	98.6	Very high	94	Very high	13 Å²	13	31.4 Å²	31.4	7%	0.07	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	22.7	-178.9	-49	113.5	0	0	0	114.4	H275 S327 C330 G331 C366 C367 I368	H275-N277 PolarHBondContact CE1-OD1 3.15Å; H275-N277 PolarHBondContact ND1-N 2.9Å; H275-N277 PolarHBondContact O-N 3.21Å; N277-S327 WeakPolarHBondContact CB-O 3.47Å; N277-S327 WeakPolarHBondContact ND2-CB 3.41Å; N277-C330 HydrophobicContact CB-CB 4.42Å; N277-C330 WeakPolarHBondContact OD1-CB 3.42Å; N277-G331 WeakPolarHBondContact O-CA 3.47Å; N277-C366 WeakPolarHBondContact CA-O 3.48Å; N277-C366 WeakPolarHBondContact CB-O 3.37Å; N277-C366 PolarHBondContact ND2-O 3.27Å; N277-C367 CarbonylContact O-C 3.53Å; N277-C367 VanDerWaalsContact O-CA 3.25Å; N277-C367 WeakPolarHBondContact O-CA 3.5Å; N277-I368 PolarHBondContact O-N 3.08Å
278	I	98.5	Very high	93.2	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.036	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-119.3	139.3	167.4	-60.3	-62.1	0	0	0	107.7	M273 H275 E276 G280 L335 I368	M273-I278 HydrophobicContact CE-CB 4.34Å; M273-I278 HydrophobicContact CE-CD1 4.08Å; M273-I278 HydrophobicContact CE-CG1 3.78Å; M273-I278 HydrophobicContact CE-CG2 3.8Å; H275-I278 HydrophobicContact CB-CB 4.3Å; H275-I278 HydrophobicContact CB-CG1 3.94Å; H275-I278 PolarHBondContact O-N 2.89Å; H275-I278 VanDerWaalsContact O-O 3.08Å; E276-I278 VanDerWaalsContact C-N 3.32Å; E276-I278 PolarHBondContact O-N 3.4Å; I278-G280 PolarHBondContact O-N 3.48Å; I278-L335 HydrophobicContact CD1-CD1 3.79Å; I278-L335 HydrophobicContact CD1-CD2 4.36Å; I278-L335 HydrophobicContact CD1-CG 3.73Å; I278-I368 HydrophobicContact CD1-CB 4.06Å
279	L	98.1	Very high	91.8	Very high	13 Å²	13	36.9 Å²	36.9	7%	0.068	20%	0.202	C	C	.	.			trans	-56.5	127.4	-179.2	179.2	56.5	0	0	0	110.5	Y268 F281 T299 D300 L359 I368 A369	Y268-L279 HydrophobicContact CE1-CB 4.32Å; L279-F281 PolarHBondContact O-N 3.22Å; L279-T299 HydrophobicContact CD2-CG2 3.96Å; L279-T299 HydrophobicContact CG-CG2 4.17Å; L279-D300 HydrophobicContact CD1-CB 4.35Å; L279-L359 HydrophobicContact CD1-CD1 3.86Å; L279-L359 HydrophobicContact CD2-CD1 4.06Å; L279-I368 WeakPolarHBondContact CB-O 3.37Å; L279-I368 PolarHBondContact N-O 3.06Å; L279-A369 HydrophobicContact CB-CB 4.08Å; L279-A369 HydrophobicContact CD2-CB 3.61Å; L279-A369 HydrophobicContact CG-CB 4.47Å
280	G	96.1	Very high	90.7	Very high	6 Å²	6	38.1 Å²	38.1	6%	0.062	23%	0.231	C	C	.	.			trans	-67.6	104	-178.2	0	0	0	0	0	111.4	I278 T299 D300	I278-G280 PolarHBondContact O-N 3.48Å; G280-T299 CarbonylContact O-C 3.57Å; G280-T299 VanDerWaalsContact O-CA 3.22Å; G280-T299 WeakPolarHBondContact O-CA 2.95Å; G280-T299 WeakPolarHBondContact O-CB 3.5Å; G280-D300 PolarHBondContact O-N 2.81Å
281	F	95.5	Very high	89.7	Confident	3 Å²	3	41.7 Å²	41.7	1%	0.013	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	137	167.3	174	-103.8	0	0	0	110.4	S210 Y268 Q269 R274 L279 A283 A284 L297	S210-F281 WeakPolarHBondContact O-CD1 3.39Å; S210-F281 WeakPolarHBondContact O-CE1 3.44Å; Y268-F281 HydrophobicContact CD1-CB 3.84Å; Y268-F281 HydrophobicContact CG-CB 3.98Å; Y268-F281 HydrophobicContact CG-CD2 4.15Å; Y268-F281 HydrophobicContact CG-CG 4.29Å; Q269-F281 HydrophobicContact CG-CD1 4.38Å; Q269-F281 HydrophobicContact CG-CE1 3.61Å; Q269-F281 HydrophobicContact CG-CZ 3.82Å; R274-F281 PolarHBondContact NH1-O 3.03Å; L279-F281 PolarHBondContact O-N 3.22Å; F281-A283 WeakPolarHBondContact CE2-O 3.18Å; F281-A283 VanDerWaalsContact CZ-CA 3.45Å; F281-A284 HydrophobicContact CE2-CB 4.17Å; F281-A284 HydrophobicContact CZ-CB 4.23Å; F281-L297 HydrophobicContact CD2-CD1 3.86Å; F281-L297 HydrophobicContact CE2-CD1 3.59Å
282	I	93.3	Very high	89.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-57	176.9	-58.8	169.9	0	0	0	109	L196 I200 G211 L212 W243 V248 I298 T299	L196-I282 HydrophobicContact CD1-CG2 4.22Å; L196-I282 HydrophobicContact CD2-CD1 3.84Å; I200-I282 HydrophobicContact CD1-CG1 3.98Å; I200-I282 HydrophobicContact CD1-CG2 4.33Å; G211-I282 WeakPolarHBondContact CA-O 3.41Å; L212-I282 HydrophobicContact CD1-CG2 4.04Å; L212-I282 PolarHBondContact N-O 3.42Å; W243-I282 HydrophobicContact CZ3-CG2 4.09Å; V248-I282 HydrophobicContact CB-CD1 4.43Å; V248-I282 HydrophobicContact CG1-CD1 3.76Å; I282-I298 HydrophobicContact CB-CG2 4.18Å; I282-I298 WeakPolarHBondContact CB-O 3.28Å; I282-I298 HydrophobicContact CD1-CG2 4.15Å; I282-I298 HydrophobicContact CG2-CG2 4.46Å; I282-I298 PolarHBondContact N-O 2.81Å; I282-T299 VanDerWaalsContact CD1-C 3.41Å; I282-T299 WeakPolarHBondContact CD1-O 3.45Å
283	A	93.1	Very high	88.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	161.7	-175.7	0	0	0	0	0	112.4	Q217 I220 F281 I298	Q217-A283 HydrophobicContact CB-CB 4.08Å; Q217-A283 HydrophobicContact CG-CB 3.77Å; I220-A283 HydrophobicContact CD1-CB 3.46Å; I220-A283 VanDerWaalsContact CD1-CB 3.46Å; F281-A283 WeakPolarHBondContact CE2-O 3.18Å; F281-A283 VanDerWaalsContact CZ-CA 3.45Å; A283-I298 HydrophobicContact CB-CD1 4.18Å; A283-I298 PolarHBondContact N-O 2.98Å; A283-I298 WeakPolarHBondContact O-CA 3.25Å; A283-I298 WeakPolarHBondContact O-CB 3.22Å; A283-I298 PolarHBondContact O-N 3.07Å
284	A	93.6	Very high	88.5	Confident	9 Å²	9	47.2 Å²	47.2	7%	0.074	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.8	162.7	0	0	0	0	0	108.3	W261 T265 F281 F296 L297	W261-A284 HydrophobicContact CZ2-CB 3.84Å; T265-A284 HydrophobicContact CG2-CB 3.38Å; F281-A284 HydrophobicContact CE2-CB 4.17Å; F281-A284 HydrophobicContact CZ-CB 4.23Å; A284-F296 VanDerWaalsContact CA-O 3.26Å; A284-F296 WeakPolarHBondContact CA-O 3.41Å; A284-L297 HydrophobicContact CB-CD1 4.35Å
285	D	92.3	Very high	88.5	Confident	9 Å²	9	43.8 Å²	43.8	5%	0.048	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	162.8	-173	-163.4	5.7	0	0	0	111	Q217 R218 T219 I220 A221 F296 I298	Q217-D285 WeakPolarHBondContact O-CB 3.44Å; Q217-D285 VanDerWaalsContact O-OD2 3.04Å; R218-D285 VanDerWaalsContact CA-OD1 3.28Å; R218-D285 WeakPolarHBondContact CA-OD1 3.34Å; T219-D285 PolarHBondContact N-OD2 3.27Å; I220-D285 PolarHBondContact N-OD2 3.49Å; I220-D285 VanDerWaalsContact N-OD2 3.08Å; A221-D285 HydrophobicContact CB-CB 3.86Å; A221-D285 VanDerWaalsContact CB-OD2 3.23Å; A221-D285 WeakPolarHBondContact CB-OD2 3.48Å; A221-D285 PolarHBondContact N-OD2 2.87Å; D285-F296 PolarHBondContact N-O 3.44Å; D285-F296 WeakPolarHBondContact O-CB 3.48Å; D285-F296 PolarHBondContact O-N 3.06Å; D285-I298 HydrophobicContact CB-CD1 4.49Å
286	I	88.8	Confident	88.4	Confident	88 Å²	88	41.1 Å²	41.1	45%	0.451	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121	-177.1	-56.9	-178.8	0	0	0	108.8	W261 T293 Q294 L295	W261-I286 HydrophobicContact CH2-CD1 4.08Å; W261-I286 HydrophobicContact CH2-CG1 4.06Å; W261-I286 HydrophobicContact CZ2-CG1 4.26Å; I286-T293 HydrophobicContact CG2-CG2 3.27Å; I286-Q294 WeakPolarHBondContact CA-O 3.5Å; I286-L295 HydrophobicContact CD1-CD2 3.97Å; I286-L295 HydrophobicContact CG1-CD2 3.79Å; I286-L295 HydrophobicContact CG2-CD2 4.16Å
287	K	84.7	Confident	88.3	Confident	59 Å²	59	36 Å²	36	26%	0.257	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.6	179	-168.8	174.1	-172.9	160.7	0	110.7	A221 Q294 F296	A221-K287 HydrophobicContact CB-CB 4.03Å; A221-K287 HydrophobicContact CB-CD 4.4Å; A221-K287 PolarHBondContact O-NZ 3.1Å; K287-Q294 PolarHBondContact N-O 3.34Å; K287-Q294 PolarHBondContact O-N 2.95Å; K287-F296 HydrophobicContact CB-CE1 4.44Å; K287-F296 HydrophobicContact CB-CZ 4.43Å; K287-F296 HydrophobicContact CD-CE2 4.21Å; K287-F296 HydrophobicContact CD-CZ 3.97Å
288	G	78.9	Confident	88.2	Confident	60 Å²	60	35.3 Å²	35.3	62%	0.619	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	125	168.7	0	0	0	0	0	110.9
289	S	66.5	Low	88.1	Confident	61 Å²	61	35.5 Å²	35.5	43%	0.427	24%	0.236	S	C	.	.			trans	-97.9	15	172.7	66	0	0	0	0	112.9	A291 F292	S289-A291 PolarHBondContact O-N 3.01Å; S289-A291 VanDerWaalsContact O-N 3.09Å; S289-F292 PolarHBondContact N-O 3.25Å; S289-F292 WeakPolarHBondContact OG-CD2 3.34Å; S289-F292 VanDerWaalsContact OG-CE2 3.25Å; S289-F292 WeakPolarHBondContact OG-CE2 3.38Å; S289-F292 WeakPolarHBondContact OG-CZ 3.46Å; S289-F292 PolarHBondContact OG-O 3.04Å; S289-F292 VanDerWaalsContact OG-O 3.07Å
290	G	70.3	Confident	88	Confident	87 Å²	87	36.7 Å²	36.7	90%	0.897	24%	0.242	S	C	*	.	S	Bend	trans	81.3	-42.6	-174.3	0	0	0	0	0	113.5
291	A	72	Confident	88.1	Confident	88 Å²	88	38.5 Å²	38.5	73%	0.727	25%	0.248	S	C	*	.	S	Bend	trans	-95	-26	179.6	0	0	0	0	0	114	S289	S289-A291 PolarHBondContact O-N 3.01Å; S289-A291 VanDerWaalsContact O-N 3.09Å
292	F	77.6	Confident	88.2	Confident	118 Å²	118	39.9 Å²	39.9	52%	0.518	25%	0.254	S	S	.	.			trans	-154.6	155.9	179.1	46.2	-90	0	0	0	111.2	S289 Q294	S289-F292 PolarHBondContact N-O 3.25Å; S289-F292 WeakPolarHBondContact OG-CD2 3.34Å; S289-F292 VanDerWaalsContact OG-CE2 3.25Å; S289-F292 WeakPolarHBondContact OG-CE2 3.38Å; S289-F292 WeakPolarHBondContact OG-CZ 3.46Å; S289-F292 PolarHBondContact OG-O 3.04Å; S289-F292 VanDerWaalsContact OG-O 3.07Å; F292-Q294 HydrophobicContact CD2-CG 3.79Å; F292-Q294 HydrophobicContact CE2-CG 3.9Å
293	T	85.3	Confident	88.3	Confident	67 Å²	67	44.5 Å²	44.5	41%	0.411	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	134	174.7	-58.7	0	0	0	0	109.1	T255 I286 L295	T255-T293 WeakPolarHBondContact CG2-O 3.22Å; I286-T293 HydrophobicContact CG2-CG2 3.27Å; T293-L295 HydrophobicContact CG2-CD2 4.33Å
294	Q	89.1	Confident	88.5	Confident	56 Å²	56	47.3 Å²	47.3	26%	0.262	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.9	173.6	-59.7	-175.5	-55.9	0	0	109.5	V252 I286 K287 F292 F296	V252-Q294 HydrophobicContact CG1-CB 4.02Å; V252-Q294 HydrophobicContact CG1-CG 4.32Å; I286-Q294 WeakPolarHBondContact CA-O 3.5Å; K287-Q294 PolarHBondContact N-O 3.34Å; K287-Q294 PolarHBondContact O-N 2.95Å; F292-Q294 HydrophobicContact CD2-CG 3.79Å; F292-Q294 HydrophobicContact CE2-CG 3.9Å; Q294-F296 HydrophobicContact CB-CD1 4.04Å; Q294-F296 HydrophobicContact CB-CE1 3.61Å
295	L	92.8	Very high	88.6	Confident	8 Å²	8	47.9 Å²	47.9	4%	0.042	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	118.9	177.5	-52.6	173.3	0	0	0	108.1	V252 F253 E258 W261 I286 T293	V252-L295 WeakPolarHBondContact CA-O 3.29Å; F253-L295 HydrophobicContact CB-CB 4.23Å; F253-L295 PolarHBondContact N-O 3.23Å; E258-L295 HydrophobicContact CB-CD1 3.86Å; E258-L295 HydrophobicContact CG-CD1 3.98Å; W261-L295 HydrophobicContact CB-CB 4.26Å; W261-L295 HydrophobicContact CB-CD1 4.02Å; W261-L295 HydrophobicContact CD2-CB 3.86Å; W261-L295 HydrophobicContact CD2-CD1 4.15Å; W261-L295 HydrophobicContact CD2-CD2 4.45Å; W261-L295 HydrophobicContact CD2-CG 4.38Å; W261-L295 HydrophobicContact CE3-CD1 4.12Å; W261-L295 HydrophobicContact CE3-CD2 4.33Å; W261-L295 HydrophobicContact CG-CB 3.7Å; W261-L295 HydrophobicContact CG-CD1 4.12Å; W261-L295 HydrophobicContact CG-CG 4.48Å; W261-L295 HydrophobicContact CZ3-CD2 4.47Å; I286-L295 HydrophobicContact CD1-CD2 3.97Å; I286-L295 HydrophobicContact CG1-CD2 3.79Å; I286-L295 HydrophobicContact CG2-CD2 4.16Å; T293-L295 HydrophobicContact CG2-CD2 4.33Å
296	F	94.8	Very high	88.9	Confident	1 Å²	1	47.9 Å²	47.9	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	134.6	-175.9	-78.1	21.7	0	0	0	109.8	A221 M226 V250 K251 V252 W261 A284 D285 K287 Q294 I298	A221-F296 HydrophobicContact CB-CD2 3.56Å; A221-F296 HydrophobicContact CB-CE2 3.96Å; A221-F296 HydrophobicContact CB-CG 4.22Å; M226-F296 HydrophobicContact CE-CZ 4.25Å; M226-F296 HydrophobicContact SD-CE2 4.08Å; M226-F296 HydrophobicContact SD-CZ 4.25Å; V250-F296 HydrophobicContact CG1-CB 4.19Å; V250-F296 HydrophobicContact CG1-CD1 4.35Å; V250-F296 HydrophobicContact CG1-CD2 3.44Å; V250-F296 VanDerWaalsContact CG1-CD2 3.44Å; V250-F296 HydrophobicContact CG1-CE2 3.79Å; V250-F296 HydrophobicContact CG1-CG 3.75Å; V250-F296 HydrophobicContact CG1-CZ 4.38Å; K251-F296 WeakPolarHBondContact O-CA 3.4Å; V252-F296 HydrophobicContact CB-CD1 4.42Å; V252-F296 HydrophobicContact CB-CE1 4.28Å; V252-F296 HydrophobicContact CG1-CD1 4.11Å; V252-F296 HydrophobicContact CG1-CE1 3.8Å; V252-F296 HydrophobicContact CG2-CD1 3.92Å; V252-F296 HydrophobicContact CG2-CE1 3.61Å; V252-F296 HydrophobicContact CG2-CZ 4.14Å; W261-F296 PolarHBondContact NE1-O 3.19Å; A284-F296 VanDerWaalsContact CA-O 3.26Å; A284-F296 WeakPolarHBondContact CA-O 3.41Å; D285-F296 PolarHBondContact N-O 3.44Å; D285-F296 WeakPolarHBondContact O-CB 3.48Å; D285-F296 PolarHBondContact O-N 3.06Å; K287-F296 HydrophobicContact CB-CE1 4.44Å; K287-F296 HydrophobicContact CB-CZ 4.43Å; K287-F296 HydrophobicContact CD-CE2 4.21Å; K287-F296 HydrophobicContact CD-CZ 3.97Å; Q294-F296 HydrophobicContact CB-CD1 4.04Å; Q294-F296 HydrophobicContact CB-CE1 3.61Å; F296-I298 HydrophobicContact CB-CD1 4.45Å; F296-I298 HydrophobicContact CB-CG1 4.3Å
297	L	95.3	Very high	89.4	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.7	162.2	-178.5	78.6	0	0	0	107.5	V250 K251 F253 E264 Y268 F281 A284 T299	V250-L297 WeakPolarHBondContact CA-O 3.46Å; K251-L297 HydrophobicContact CB-CB 4.26Å; K251-L297 HydrophobicContact CD-CD2 4.4Å; K251-L297 PolarHBondContact N-O 3.24Å; K251-L297 PolarHBondContact O-N 3.39Å; F253-L297 HydrophobicContact CE2-CB 3.78Å; F253-L297 HydrophobicContact CE2-CD2 4.44Å; F253-L297 HydrophobicContact CZ-CD2 4.46Å; E264-L297 HydrophobicContact CG-CD2 3.74Å; E264-L297 WeakPolarHBondContact OE1-CD2 3.32Å; Y268-L297 HydrophobicContact CD2-CD1 4.26Å; Y268-L297 HydrophobicContact CD2-CD2 4.06Å; Y268-L297 HydrophobicContact CE2-CD2 3.91Å; F281-L297 HydrophobicContact CD2-CD1 3.86Å; F281-L297 HydrophobicContact CE2-CD1 3.59Å; A284-L297 HydrophobicContact CB-CD1 4.35Å; L297-T299 HydrophobicContact CG-CG2 4.48Å
298	I	96.1	Very high	90	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.9	-170.1	-55.8	150.3	0	0	0	108.6	I220 I224 V248 A249 V250 I282 A283 D285 F296	I220-I298 HydrophobicContact CB-CD1 4.22Å; I220-I298 HydrophobicContact CG2-CD1 3.72Å; I224-I298 HydrophobicContact CD1-CB 4.49Å; I224-I298 HydrophobicContact CD1-CD1 3.48Å; I224-I298 VanDerWaalsContact CD1-CD1 3.48Å; I224-I298 HydrophobicContact CD1-CG1 3.68Å; I224-I298 HydrophobicContact CD1-CG2 3.95Å; V248-I298 HydrophobicContact CB-CG2 4.13Å; V248-I298 HydrophobicContact CG1-CG2 4.49Å; V248-I298 HydrophobicContact CG2-CG2 4.3Å; A249-I298 WeakPolarHBondContact O-CA 3.46Å; V250-I298 HydrophobicContact CG1-CG1 4.36Å; V250-I298 HydrophobicContact CG2-CG1 4.48Å; I282-I298 HydrophobicContact CB-CG2 4.18Å; I282-I298 WeakPolarHBondContact CB-O 3.28Å; I282-I298 HydrophobicContact CD1-CG2 4.15Å; I282-I298 HydrophobicContact CG2-CG2 4.46Å; I282-I298 PolarHBondContact N-O 2.81Å; A283-I298 HydrophobicContact CB-CD1 4.18Å; A283-I298 PolarHBondContact N-O 2.98Å; A283-I298 WeakPolarHBondContact O-CA 3.25Å; A283-I298 WeakPolarHBondContact O-CB 3.22Å; A283-I298 PolarHBondContact O-N 3.07Å; D285-I298 HydrophobicContact CB-CD1 4.49Å; F296-I298 HydrophobicContact CB-CD1 4.45Å; F296-I298 HydrophobicContact CB-CG1 4.3Å
299	T	96.8	Very high	90.9	Very high	11 Å²	11	43.7 Å²	43.7	7%	0.067	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	169.8	-177.1	69.4	0	0	0	0	111.6	A249 L279 G280 I282 L297	A249-T299 PolarHBondContact N-O 2.84Å; A249-T299 PolarHBondContact O-N 2.96Å; L279-T299 HydrophobicContact CD2-CG2 3.96Å; L279-T299 HydrophobicContact CG-CG2 4.17Å; G280-T299 CarbonylContact O-C 3.57Å; G280-T299 VanDerWaalsContact O-CA 3.22Å; G280-T299 WeakPolarHBondContact O-CA 2.95Å; G280-T299 WeakPolarHBondContact O-CB 3.5Å; I282-T299 VanDerWaalsContact CD1-C 3.41Å; I282-T299 WeakPolarHBondContact CD1-O 3.45Å; L297-T299 HydrophobicContact CG-CG2 4.48Å
300	D	96.3	Very high	92.4	Very high	37 Å²	37	42.3 Å²	42.3	20%	0.198	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	141.6	167.3	-69.7	-22.3	0	0	0	110.5	L279 G280	L279-D300 HydrophobicContact CD1-CB 4.35Å; G280-D300 PolarHBondContact O-N 2.81Å
301	Y	97.4	Very high	93.7	Very high	44 Å²	44	38.2 Å²	38.2	17%	0.173	21%	0.207	C	C	.	.			trans	-94	134.3	171.7	175.9	-102	0	0	0	110.7	I230 L240 K247 A249 E303	I230-Y301 HydrophobicContact CD1-CD2 3.97Å; I230-Y301 HydrophobicContact CD1-CE2 3.76Å; L240-Y301 HydrophobicContact CB-CE2 4.41Å; L240-Y301 HydrophobicContact CD1-CD1 4.03Å; L240-Y301 HydrophobicContact CD1-CD2 3.71Å; L240-Y301 HydrophobicContact CD1-CE1 4.15Å; L240-Y301 HydrophobicContact CD1-CE2 3.83Å; L240-Y301 HydrophobicContact CD1-CG 3.8Å; K247-Y301 HydrophobicContact CB-CD1 3.78Å; K247-Y301 HydrophobicContact CB-CG 4.16Å; K247-Y301 HydrophobicContact CD-CD1 3.86Å; K247-Y301 HydrophobicContact CD-CE1 3.93Å; K247-Y301 HydrophobicContact CG-CD1 4.47Å; K247-Y301 WeakPolarHBondContact O-CB 3.49Å; A249-Y301 HydrophobicContact CB-CD2 4.41Å; Y301-E303 HydrophobicContact CE1-CB 3.89Å
302	H	97.1	Very high	95	Very high	32 Å²	32	39 Å²	39	15%	0.148	19%	0.194	C	C	.	.			trans	-118.8	118.2	174.4	-66.4	-38.1	0	0	0	110.4	N304 G305 L359 C367	H302-N304 VanDerWaalsContact C-N 3.35Å; H302-N304 PolarHBondContact O-N 2.94Å; H302-G305 PolarHBondContact O-N 2.9Å; H302-G305 VanDerWaalsContact O-N 3.13Å; H302-L359 HydrophobicContact CB-CB 4.37Å; H302-C367 PolarHBondContact CD2-SG 2.95Å; H302-C367 PolarHBondContact NE2-SG 2.88Å
303	E	95.6	Very high	95.9	Very high	98 Å²	98	39 Å²	39	46%	0.458	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-27.7	-170.1	65	-168.9	163.8	0	0	114.5	Y301 G305 K362	Y301-E303 HydrophobicContact CE1-CB 3.89Å; E303-G305 PolarHBondContact O-N 3.29Å; E303-K362 WeakPolarHBondContact OE1-CD 3.5Å
304	N	96.6	Very high	96.5	Very high	58 Å²	58	38.7 Å²	38.7	31%	0.31	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-3.7	175	-66.2	-29.8	0	0	0	112.6	H302 F310 V360 K361	H302-N304 VanDerWaalsContact C-N 3.35Å; H302-N304 PolarHBondContact O-N 2.94Å; N304-F310 HydrophobicContact CB-CD2 3.96Å; N304-F310 HydrophobicContact CB-CE2 4.4Å; N304-V360 HydrophobicContact CB-CB 3.91Å; N304-V360 HydrophobicContact CB-CG1 4.12Å; N304-V360 WeakPolarHBondContact CB-O 3.36Å; N304-K361 PolarHBondContact ND2-O 2.88Å
305	G	96.6	Very high	96.9	Very high	22 Å²	22	39.6 Å²	39.6	23%	0.227	21%	0.209	C	C	.	.			trans	66.4	-150.6	176	0	0	0	0	0	113.1	H302 E303 L359 V360	H302-G305 PolarHBondContact O-N 2.9Å; H302-G305 VanDerWaalsContact O-N 3.13Å; E303-G305 PolarHBondContact O-N 3.29Å; G305-L359 WeakPolarHBondContact O-CA 3.36Å; G305-V360 PolarHBondContact O-N 3.02Å
306	S	98	Very high	97.2	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.063	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-75.2	155.9	177.3	73.6	0	0	0	0	111.7	Y308 D309 F310 K356 I358	S306-Y308 PolarHBondContact O-N 2.88Å; S306-Y308 WeakPolarHBondContact OG-CB 3.45Å; S306-D309 PolarHBondContact O-N 2.86Å; S306-D309 PolarHBondContact OG-N 2.85Å; S306-D309 VanDerWaalsContact OG-N 3.14Å; S306-D309 PolarHBondContact OG-OD2 3.37Å; S306-F310 WeakPolarHBondContact O-CB 3.22Å; S306-F310 PolarHBondContact O-N 3.27Å; S306-K356 WeakPolarHBondContact CB-O 3.09Å; S306-I358 CarbonylContact C-O 3.59Å; S306-I358 VanDerWaalsContact CA-O 3.32Å; S306-I358 WeakPolarHBondContact CA-O 3.28Å
307	L	98.8	Very high	97.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.9	-35.3	172.1	178.2	71.5	0	0	0	110.5	F310 L311 L324 S355 I358 V360 V426 M430	L307-F310 PolarHBondContact O-N 3.01Å; L307-L311 HydrophobicContact CD1-CD1 3.93Å; L307-L311 HydrophobicContact CD1-CD2 4.21Å; L307-L311 HydrophobicContact CD1-CG 3.83Å; L307-L311 HydrophobicContact CD2-CD1 4.31Å; L307-L311 HydrophobicContact CG-CD1 3.75Å; L307-L311 HydrophobicContact CG-CG 4.05Å; L307-L311 VanDerWaalsContact O-CB 3.31Å; L307-L311 WeakPolarHBondContact O-CB 3.42Å; L307-L311 WeakPolarHBondContact O-CG 3.46Å; L307-L311 PolarHBondContact O-N 3.33Å; L307-L324 HydrophobicContact CD1-CD1 4.22Å; L307-S355 WeakPolarHBondContact CB-O 3.11Å; L307-S355 PolarHBondContact N-O 2.89Å; L307-I358 HydrophobicContact CB-CB 4.18Å; L307-I358 HydrophobicContact CB-CG2 4.25Å; L307-I358 HydrophobicContact CD2-CB 4.47Å; L307-I358 HydrophobicContact CD2-CD1 4.48Å; L307-I358 HydrophobicContact CD2-CG2 4.39Å; L307-I358 PolarHBondContact N-O 3.13Å; L307-V360 HydrophobicContact CB-CG2 4.16Å; L307-V360 HydrophobicContact CD1-CG2 3.92Å; L307-V426 HydrophobicContact CD2-CG1 3.67Å; L307-M430 HydrophobicContact CD1-CE 4.11Å; L307-M430 HydrophobicContact CD1-CG 4.43Å; L307-M430 HydrophobicContact CD2-CE 3.26Å; L307-M430 HydrophobicContact CD2-CG 4.1Å; L307-M430 HydrophobicContact CG-CE 4.33Å
308	Y	98.2	Very high	97.3	Very high	35 Å²	35	44.8 Å²	44.8	14%	0.137	24%	0.239	C	C	.	.	H	α-helix	trans	-54.8	-51.9	170.8	171.6	-88	0	0	0	111.8	S306 K312 S355 K356 Y443 L445	S306-Y308 PolarHBondContact O-N 2.88Å; S306-Y308 WeakPolarHBondContact OG-CB 3.45Å; Y308-K312 HydrophobicContact CD1-CD 4.16Å; Y308-K312 HydrophobicContact CE1-CD 3.55Å; Y308-K312 HydrophobicContact CE2-CD 4.35Å; Y308-K312 WeakPolarHBondContact O-CG 3.48Å; Y308-K312 PolarHBondContact O-N 3.06Å; Y308-K312 PolarHBondContact OH-NZ 3.25Å; Y308-S355 PolarHBondContact N-O 3.22Å; Y308-K356 HydrophobicContact CD1-CG 4.1Å; Y308-K356 HydrophobicContact CD2-CG 4.02Å; Y308-K356 HydrophobicContact CG-CD 4.42Å; Y308-K356 HydrophobicContact CG-CG 3.63Å; Y308-Y443 AromaticContact CD2-CE1 3.93Å; Y308-Y443 HydrophobicContact CD2-CE1 3.93Å; Y308-Y443 AromaticContact CD2-CZ 3.7Å; Y308-Y443 WeakPolarHBondContact CD2-OH 3.47Å; Y308-Y443 AromaticContact CE2-CE1 3.61Å; Y308-Y443 HydrophobicContact CE2-CE1 3.61Å; Y308-Y443 AromaticContact CE2-CZ 3.86Å; Y308-Y443 WeakPolarHBondContact CE2-OH 3.32Å; Y308-L445 HydrophobicContact CD2-CD2 3.98Å; Y308-L445 HydrophobicContact CE2-CD1 4.31Å; Y308-L445 HydrophobicContact CE2-CD2 3.89Å; Y308-L445 HydrophobicContact CE2-CG 4.14Å
309	D	97.2	Very high	97.3	Very high	83 Å²	83	46.1 Å²	46.1	44%	0.444	25%	0.251	S	S	.	.	H	α-helix	trans	-67.8	-40	-179.6	-58.9	-51	0	0	0	111.3	S306 K312	S306-D309 PolarHBondContact O-N 2.86Å; S306-D309 PolarHBondContact OG-N 2.85Å; S306-D309 VanDerWaalsContact OG-N 3.14Å; S306-D309 PolarHBondContact OG-OD2 3.37Å; D309-K312 PolarHBondContact O-N 3.15Å
310	F	98.4	Very high	97.3	Very high	33 Å²	33	47 Å²	47	15%	0.145	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-47.9	179.5	-173.4	-95.7	0	0	0	112.1	N304 S306 L307 K312 V313 N314 L316 L324 V360	N304-F310 HydrophobicContact CB-CD2 3.96Å; N304-F310 HydrophobicContact CB-CE2 4.4Å; S306-F310 WeakPolarHBondContact O-CB 3.22Å; S306-F310 PolarHBondContact O-N 3.27Å; L307-F310 PolarHBondContact O-N 3.01Å; F310-K312 VanDerWaalsContact C-N 3.28Å; F310-K312 PolarHBondContact O-N 3.22Å; F310-V313 PolarHBondContact O-N 3.25Å; F310-N314 HydrophobicContact CD1-CB 4.3Å; F310-N314 WeakPolarHBondContact CD2-ND2 3.48Å; F310-N314 HydrophobicContact CE1-CB 3.97Å; F310-N314 WeakPolarHBondContact CE2-ND2 3.37Å; F310-N314 HydrophobicContact CZ-CB 4.09Å; F310-N314 WeakPolarHBondContact O-CB 3.25Å; F310-N314 PolarHBondContact O-N 2.85Å; F310-N314 PolarHBondContact O-ND2 2.58Å; F310-L316 HydrophobicContact CE1-CD2 3.9Å; F310-L324 HydrophobicContact CE1-CD1 4.22Å; F310-V360 HydrophobicContact CB-CB 4.44Å; F310-V360 HydrophobicContact CB-CG2 3.84Å; F310-V360 HydrophobicContact CD1-CG2 4.19Å; F310-V360 HydrophobicContact CD2-CB 4.25Å; F310-V360 HydrophobicContact CD2-CG1 4.04Å; F310-V360 HydrophobicContact CD2-CG2 4.38Å; F310-V360 HydrophobicContact CE2-CG1 4.09Å; F310-V360 HydrophobicContact CG-CB 4.26Å; F310-V360 HydrophobicContact CG-CG1 4.26Å; F310-V360 HydrophobicContact CG-CG2 3.88Å; F310-V360 HydrophobicContact CZ-CG1 4.37Å
311	L	98.6	Very high	97.4	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-69.7	-22.7	-177.3	-70.1	178	0	0	0	113.3	L307 V313 L316 E429 M430 R433 Y443	L307-L311 HydrophobicContact CD1-CD1 3.93Å; L307-L311 HydrophobicContact CD1-CD2 4.21Å; L307-L311 HydrophobicContact CD1-CG 3.83Å; L307-L311 HydrophobicContact CD2-CD1 4.31Å; L307-L311 HydrophobicContact CG-CD1 3.75Å; L307-L311 HydrophobicContact CG-CG 4.05Å; L307-L311 VanDerWaalsContact O-CB 3.31Å; L307-L311 WeakPolarHBondContact O-CB 3.42Å; L307-L311 WeakPolarHBondContact O-CG 3.46Å; L307-L311 PolarHBondContact O-N 3.33Å; L311-V313 VanDerWaalsContact C-N 3.34Å; L311-L316 HydrophobicContact CD2-CD1 3.81Å; L311-L316 HydrophobicContact CD2-CD2 4.4Å; L311-L316 HydrophobicContact CD2-CG 4.22Å; L311-E429 HydrophobicContact CD1-CB 4.05Å; L311-M430 HydrophobicContact CD1-CG 4.23Å; L311-R433 HydrophobicContact CB-CG 4.09Å; L311-R433 HydrophobicContact CD2-CB 4.03Å; L311-R433 HydrophobicContact CD2-CG 4.03Å; L311-R433 PolarHBondContact O-NE 3.2Å; L311-Y443 HydrophobicContact CB-CD2 3.55Å; L311-Y443 HydrophobicContact CB-CE2 3.82Å; L311-Y443 HydrophobicContact CD1-CE2 4.19Å
312	K	97.6	Very high	97.5	Very high	105 Å²	105	43.2 Å²	43.2	46%	0.457	24%	0.241	S	C	.	.	H	α-helix	trans	-67.4	-33.6	175.8	-77.8	177.2	87.7	176.5	0	113.4	Y308 D309 F310 Y443	Y308-K312 HydrophobicContact CD1-CD 4.16Å; Y308-K312 HydrophobicContact CE1-CD 3.55Å; Y308-K312 HydrophobicContact CE2-CD 4.35Å; Y308-K312 WeakPolarHBondContact O-CG 3.48Å; Y308-K312 PolarHBondContact O-N 3.06Å; Y308-K312 PolarHBondContact OH-NZ 3.25Å; D309-K312 PolarHBondContact O-N 3.15Å; F310-K312 VanDerWaalsContact C-N 3.28Å; F310-K312 PolarHBondContact O-N 3.22Å; K312-Y443 HydrophobicContact CB-CD1 4.46Å; K312-Y443 HydrophobicContact CD-CD1 4.07Å; K312-Y443 HydrophobicContact CD-CE1 4.14Å; K312-Y443 HydrophobicContact CG-CD1 3.26Å; K312-Y443 HydrophobicContact CG-CD2 4.49Å; K312-Y443 HydrophobicContact CG-CE1 3.7Å; K312-Y443 HydrophobicContact CG-CG 3.7Å
313	V	97.3	Very high	97.6	Very high	118 Å²	118	47.6 Å²	47.6	72%	0.715	26%	0.257	S	S	*	.	H	α-helix	trans	-112.5	-15.1	-173.5	-56.4	0	0	0	0	113.3	F310 L311	F310-V313 PolarHBondContact O-N 3.25Å; L311-V313 VanDerWaalsContact C-N 3.34Å
314	N	97.9	Very high	97.7	Very high	60 Å²	60	43 Å²	43	32%	0.321	24%	0.236	S	C	.	.			trans	-111.7	150.4	178.7	-59.9	-78.4	0	0	0	111.8	F310 R433	F310-N314 HydrophobicContact CD1-CB 4.3Å; F310-N314 WeakPolarHBondContact CD2-ND2 3.48Å; F310-N314 HydrophobicContact CE1-CB 3.97Å; F310-N314 WeakPolarHBondContact CE2-ND2 3.37Å; F310-N314 HydrophobicContact CZ-CB 4.09Å; F310-N314 WeakPolarHBondContact O-CB 3.25Å; F310-N314 PolarHBondContact O-N 2.85Å; F310-N314 PolarHBondContact O-ND2 2.58Å; N314-R433 PolarHBondContact O-NE 3.33Å; N314-R433 VanDerWaalsContact O-NE 3.14Å; N314-R433 PolarHBondContact O-NH2 3.26Å
315	T	97.9	Very high	97.8	Very high	75 Å²	75	40.3 Å²	40.3	46%	0.46	22%	0.221	S	C	.	.			trans	-102.5	159	161.4	54	0	0	0	0	109	R433 V435 V440	T315-R433 CarbonylContact C-O 3.59Å; T315-R433 WeakPolarHBondContact CA-O 3.23Å; T315-V435 HydrophobicContact CG2-CG2 4.24Å; T315-V440 HydrophobicContact CG2-CG1 4.01Å; T315-V440 HydrophobicContact CG2-CG2 4.1Å
316	L	98	Very high	97.9	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.026	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-115.1	148	179.7	-51.8	179.5	0	0	0	109.9	F310 L311 A320 L321 L324 M430 R433 C434 V435	F310-L316 HydrophobicContact CE1-CD2 3.9Å; L311-L316 HydrophobicContact CD2-CD1 3.81Å; L311-L316 HydrophobicContact CD2-CD2 4.4Å; L311-L316 HydrophobicContact CD2-CG 4.22Å; L316-A320 HydrophobicContact CB-CB 4.25Å; L316-A320 HydrophobicContact CD2-CB 4.15Å; L316-L321 HydrophobicContact CB-CB 4.49Å; L316-L321 HydrophobicContact CD1-CB 4.33Å; L316-L321 HydrophobicContact CD1-CD1 4.41Å; L316-L324 HydrophobicContact CD1-CD1 3.84Å; L316-L324 HydrophobicContact CD2-CD1 3.68Å; L316-L324 HydrophobicContact CG-CD1 4.44Å; L316-M430 HydrophobicContact CD1-CB 4.34Å; L316-R433 HydrophobicContact CD1-CB 4.48Å; L316-R433 HydrophobicContact CG-CB 4.27Å; L316-R433 PolarHBondContact N-O 3.41Å; L316-C434 CarbonylContact O-C 3.58Å; L316-C434 VanDerWaalsContact O-CA 3.29Å; L316-C434 WeakPolarHBondContact O-CA 3.37Å; L316-V435 PolarHBondContact O-N 3.01Å
317	D	96.3	Very high	97.9	Very high	93 Å²	93	42.5 Å²	42.5	50%	0.497	22%	0.222	S	C	.	.			trans	-89.8	178	155.2	62.3	6.9	0	0	0	109.9	A319 A320 L321	D317-A319 VanDerWaalsContact C-N 3.3Å; D317-A319 PolarHBondContact O-N 3Å; D317-A319 PolarHBondContact OD1-N 3.04Å; D317-A320 PolarHBondContact O-N 3.19Å; D317-A320 WeakPolarHBondContact OD1-CB 3.45Å; D317-A320 PolarHBondContact OD1-N 3.33Å; D317-L321 WeakPolarHBondContact O-CB 3.35Å; D317-L321 PolarHBondContact O-N 3.16Å
318	A	96.4	Very high	98	Very high	22 Å²	22	42.5 Å²	42.5	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-60.1	-40.3	179.5	0	0	0	0	0	112	L321 L322 C482	A318-L321 PolarHBondContact O-N 3.01Å; A318-L322 VanDerWaalsContact O-CG 3.28Å; A318-L322 WeakPolarHBondContact O-CG 3.47Å; A318-L322 PolarHBondContact O-N 3.25Å; A318-C482 HydrophobicContact CB-CB 4.19Å
319	A	96.4	Very high	98	Very high	29 Å²	29	40.9 Å²	40.9	24%	0.24	22%	0.216	C	C	.	.	H	α-helix	trans	-64.8	-44.6	-180	0	0	0	0	0	112	D317 L322 R323	D317-A319 VanDerWaalsContact C-N 3.3Å; D317-A319 PolarHBondContact O-N 3Å; D317-A319 PolarHBondContact OD1-N 3.04Å; A319-L322 PolarHBondContact O-N 3.03Å; A319-R323 VanDerWaalsContact O-CB 3.24Å; A319-R323 WeakPolarHBondContact O-CB 3.24Å; A319-R323 PolarHBondContact O-N 3.46Å
320	A	97.6	Very high	98.1	Very high	28 Å²	28	37.3 Å²	37.3	23%	0.231	20%	0.197	C	C	.	.	H	α-helix	trans	-66.3	-41.5	176	0	0	0	0	0	111.7	L316 D317 L322 R323 L324	L316-A320 HydrophobicContact CB-CB 4.25Å; L316-A320 HydrophobicContact CD2-CB 4.15Å; D317-A320 PolarHBondContact O-N 3.19Å; D317-A320 WeakPolarHBondContact OD1-CB 3.45Å; D317-A320 PolarHBondContact OD1-N 3.33Å; A320-L322 PolarHBondContact O-N 3.08Å; A320-R323 PolarHBondContact O-N 3.13Å; A320-L324 WeakPolarHBondContact O-CB 3.14Å; A320-L324 VanDerWaalsContact O-CG 3.28Å; A320-L324 WeakPolarHBondContact O-CG 3.47Å; A320-L324 PolarHBondContact O-N 2.8Å
321	L	98.5	Very high	98.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-55	-52.3	173.4	170.4	61.1	0	0	0	111.2	L316 D317 A318 L324 A325 M430 C434 L483 M486	L316-L321 HydrophobicContact CB-CB 4.49Å; L316-L321 HydrophobicContact CD1-CB 4.33Å; L316-L321 HydrophobicContact CD1-CD1 4.41Å; D317-L321 WeakPolarHBondContact O-CB 3.35Å; D317-L321 PolarHBondContact O-N 3.16Å; A318-L321 PolarHBondContact O-N 3.01Å; L321-L324 PolarHBondContact O-N 3.02Å; L321-A325 WeakPolarHBondContact O-CB 3.47Å; L321-A325 PolarHBondContact O-N 2.95Å; L321-M430 HydrophobicContact CD1-CB 3.46Å; L321-M430 VanDerWaalsContact CD1-CB 3.46Å; L321-C434 HydrophobicContact CD2-CB 3.91Å; L321-L483 HydrophobicContact CD2-CD2 3.78Å; L321-M486 HydrophobicContact CD1-CE 3.93Å; L321-M486 HydrophobicContact CD2-CE 4.38Å; L321-M486 HydrophobicContact CD2-CG 4.08Å; L321-M486 HydrophobicContact CG-CE 4.08Å
322	L	98.4	Very high	98.1	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-67	-38.7	-178.9	-64.8	176.4	0	0	0	112	A318 A319 A320 A325 Y326 M486 L511 M514 V515 Q518	A318-L322 VanDerWaalsContact O-CG 3.28Å; A318-L322 WeakPolarHBondContact O-CG 3.47Å; A318-L322 PolarHBondContact O-N 3.25Å; A319-L322 PolarHBondContact O-N 3.03Å; A320-L322 PolarHBondContact O-N 3.08Å; L322-A325 PolarHBondContact O-N 3.5Å; L322-Y326 WeakPolarHBondContact O-CA 3.08Å; L322-Y326 WeakPolarHBondContact O-CB 3.22Å; L322-Y326 PolarHBondContact O-N 3.31Å; L322-M486 HydrophobicContact CD2-SD 3.95Å; L322-L511 HydrophobicContact CD2-CD2 4.09Å; L322-M514 HydrophobicContact CD1-CB 4.06Å; L322-M514 WeakPolarHBondContact CD1-O 3.08Å; L322-M514 HydrophobicContact CD2-CB 4.04Å; L322-M514 HydrophobicContact CD2-CE 3.7Å; L322-M514 HydrophobicContact CD2-SD 4.49Å; L322-V515 HydrophobicContact CB-CG2 3.73Å; L322-V515 HydrophobicContact CD1-CG2 4.47Å; L322-Q518 HydrophobicContact CD1-CB 4.47Å; L322-Q518 HydrophobicContact CD1-CG 3.59Å
323	R	98.4	Very high	98.1	Very high	124 Å²	124	31.1 Å²	31.1	47%	0.468	17%	0.171	S	C	.	.	H	α-helix	trans	-60.7	-46.6	176.4	-169.3	-174.2	-50.2	-105.1	-5	111.7	A319 A320 S327 G364 T365	A319-R323 VanDerWaalsContact O-CB 3.24Å; A319-R323 WeakPolarHBondContact O-CB 3.24Å; A319-R323 PolarHBondContact O-N 3.46Å; A320-R323 PolarHBondContact O-N 3.13Å; R323-S327 VanDerWaalsContact O-CB 3.28Å; R323-S327 WeakPolarHBondContact O-CB 3.34Å; R323-S327 PolarHBondContact O-N 3.43Å; R323-S327 PolarHBondContact O-OG 2.99Å; R323-G364 WeakPolarHBondContact CD-O 3.31Å; R323-T365 HydrophobicContact CG-CG2 4.12Å
324	L	98.8	Very high	98.2	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-66.7	-46.1	178.5	-68.5	172.7	0	0	0	111.7	L307 F310 L316 A320 L321 S327 A328 V360 G364 C366 M430	L307-L324 HydrophobicContact CD1-CD1 4.22Å; F310-L324 HydrophobicContact CE1-CD1 4.22Å; L316-L324 HydrophobicContact CD1-CD1 3.84Å; L316-L324 HydrophobicContact CD2-CD1 3.68Å; L316-L324 HydrophobicContact CG-CD1 4.44Å; A320-L324 WeakPolarHBondContact O-CB 3.14Å; A320-L324 VanDerWaalsContact O-CG 3.28Å; A320-L324 WeakPolarHBondContact O-CG 3.47Å; A320-L324 PolarHBondContact O-N 2.8Å; L321-L324 PolarHBondContact O-N 3.02Å; L324-S327 PolarHBondContact O-OG 2.97Å; L324-S327 VanDerWaalsContact O-OG 3.1Å; L324-A328 WeakPolarHBondContact O-CB 3.45Å; L324-A328 PolarHBondContact O-N 3.31Å; L324-A328 VanDerWaalsContact O-N 3.09Å; L324-V360 HydrophobicContact CD2-CG1 4.03Å; L324-V360 HydrophobicContact CD2-CG2 4.24Å; L324-G364 VanDerWaalsContact CD2-O 3.31Å; L324-G364 WeakPolarHBondContact CD2-O 3.28Å; L324-C366 WeakPolarHBondContact CD2-SG 3.43Å; L324-C366 PolarHBondContact O-SG 2.78Å; L324-C366 VanDerWaalsContact O-SG 3.35Å; L324-M430 HydrophobicContact CB-CE 4.05Å; L324-M430 HydrophobicContact CB-SD 4.02Å
325	A	98.8	Very high	98.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.4	-49	178.3	0	0	0	0	0	111.4	L321 L322 S327 A328 A329 Y423 M430 M486 L511	L321-A325 WeakPolarHBondContact O-CB 3.47Å; L321-A325 PolarHBondContact O-N 2.95Å; L322-A325 PolarHBondContact O-N 3.5Å; A325-S327 PolarHBondContact O-N 3.45Å; A325-A328 PolarHBondContact O-N 2.88Å; A325-A329 WeakPolarHBondContact O-CB 3.47Å; A325-A329 PolarHBondContact O-N 3.04Å; A325-Y423 PolarHBondContact O-OH 2.82Å; A325-M430 HydrophobicContact CB-SD 3.95Å; A325-M486 HydrophobicContact CB-CE 3.82Å; A325-L511 HydrophobicContact CB-CD1 4.08Å; A325-L511 HydrophobicContact CB-CD2 4.16Å
326	Y	98.8	Very high	98.2	Very high	74 Å²	74	21 Å²	21	29%	0.29	11%	0.109	S	C	.	.	H	α-helix	trans	-61	-47	-179.1	177.6	-113.1	0	0	0	112	L322 A329 C330 K508 L511 A512	L322-Y326 WeakPolarHBondContact O-CA 3.08Å; L322-Y326 WeakPolarHBondContact O-CB 3.22Å; L322-Y326 PolarHBondContact O-N 3.31Å; Y326-A329 CarbonylContact O-C 3.53Å; Y326-A329 WeakPolarHBondContact O-CB 3.42Å; Y326-A329 PolarHBondContact O-N 3.12Å; Y326-C330 PolarHBondContact O-N 3.23Å; Y326-C330 PolarHBondContact O-SG 3.39Å; Y326-C330 VanDerWaalsContact O-SG 3.33Å; Y326-K508 HydrophobicContact CD2-CG 4.38Å; Y326-K508 HydrophobicContact CE2-CG 3.7Å; Y326-K508 WeakPolarHBondContact CE2-O 3.13Å; Y326-L511 HydrophobicContact CD2-CB 3.85Å; Y326-L511 HydrophobicContact CG-CB 4.47Å; Y326-A512 HydrophobicContact CD2-CB 4.36Å; Y326-A512 HydrophobicContact CE2-CB 3.7Å
327	S	98.8	Very high	98.2	Very high	4 Å²	4	23.9 Å²	23.9	3%	0.028	13%	0.127	C	C	.	.	H	α-helix	trans	-64.8	-40.4	178.7	53.9	0	0	0	0	112.5	N277 R323 L324 A325 A329 C330 G331 C366	N277-S327 WeakPolarHBondContact CB-O 3.47Å; N277-S327 WeakPolarHBondContact ND2-CB 3.41Å; R323-S327 VanDerWaalsContact O-CB 3.28Å; R323-S327 WeakPolarHBondContact O-CB 3.34Å; R323-S327 PolarHBondContact O-N 3.43Å; R323-S327 PolarHBondContact O-OG 2.99Å; L324-S327 PolarHBondContact O-OG 2.97Å; L324-S327 VanDerWaalsContact O-OG 3.1Å; A325-S327 PolarHBondContact O-N 3.45Å; S327-A329 VanDerWaalsContact C-N 3.34Å; S327-A329 PolarHBondContact O-N 3.18Å; S327-C330 WeakPolarHBondContact O-CB 3.49Å; S327-C330 PolarHBondContact O-N 3.49Å; S327-G331 PolarHBondContact O-N 3.03Å; S327-G331 VanDerWaalsContact O-N 3.11Å; S327-C366 WeakPolarHBondContact OG-CB 3.34Å; S327-C366 PolarHBondContact OG-N 3.45Å
328	A	98.8	Very high	98.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.3	-42.6	171.8	0	0	0	0	0	111.7	L324 A325 C330 G331 L332 C366 Y423 M430	L324-A328 WeakPolarHBondContact O-CB 3.45Å; L324-A328 PolarHBondContact O-N 3.31Å; L324-A328 VanDerWaalsContact O-N 3.09Å; A325-A328 PolarHBondContact O-N 2.88Å; A328-C330 VanDerWaalsContact C-N 3.34Å; A328-C330 PolarHBondContact O-N 2.95Å; A328-G331 PolarHBondContact O-N 3.44Å; A328-L332 PolarHBondContact O-N 3.26Å; A328-C366 HydrophobicContact CB-CB 4.09Å; A328-Y423 HydrophobicContact CB-CE2 4.12Å; A328-M430 HydrophobicContact CB-CE 4.4Å
329	A	98.8	Very high	98	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.4	-36.8	175.2	0	0	0	0	0	112.9	A325 Y326 S327 L332 C333 Y423 I504 V507 K508 L511	A325-A329 WeakPolarHBondContact O-CB 3.47Å; A325-A329 PolarHBondContact O-N 3.04Å; Y326-A329 CarbonylContact O-C 3.53Å; Y326-A329 WeakPolarHBondContact O-CB 3.42Å; Y326-A329 PolarHBondContact O-N 3.12Å; S327-A329 VanDerWaalsContact C-N 3.34Å; S327-A329 PolarHBondContact O-N 3.18Å; A329-L332 PolarHBondContact O-N 3.5Å; A329-C333 WeakPolarHBondContact O-CB 3.4Å; A329-C333 PolarHBondContact O-N 3.25Å; A329-Y423 HydrophobicContact CB-CE2 4.27Å; A329-I504 HydrophobicContact CB-CD1 3.95Å; A329-V507 HydrophobicContact CB-CG1 4.09Å; A329-K508 HydrophobicContact CB-CB 4.42Å; A329-L511 HydrophobicContact CB-CD1 4Å
330	C	98.8	Very high	97.5	Very high	8 Å²	8	30.4 Å²	30.4	5%	0.054	14%	0.14	C	C	.	.	H	α-helix	trans	-62	-42.6	174.1	-74.7	0	0	0	0	111.8	N277 Y326 S327 A328 H334 K508	N277-C330 HydrophobicContact CB-CB 4.42Å; N277-C330 WeakPolarHBondContact OD1-CB 3.42Å; Y326-C330 PolarHBondContact O-N 3.23Å; Y326-C330 PolarHBondContact O-SG 3.39Å; Y326-C330 VanDerWaalsContact O-SG 3.33Å; S327-C330 WeakPolarHBondContact O-CB 3.49Å; S327-C330 PolarHBondContact O-N 3.49Å; A328-C330 VanDerWaalsContact C-N 3.34Å; A328-C330 PolarHBondContact O-N 2.95Å; C330-H334 WeakPolarHBondContact O-CB 3.3Å; C330-H334 PolarHBondContact O-N 3.15Å; C330-K508 VanDerWaalsContact SG-CE 3.54Å
331	G	98.8	Very high	96.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-49.6	175.2	0	0	0	0	0	112	N277 S327 A328 C333 H334 L335	N277-G331 WeakPolarHBondContact O-CA 3.47Å; S327-G331 PolarHBondContact O-N 3.03Å; S327-G331 VanDerWaalsContact O-N 3.11Å; A328-G331 PolarHBondContact O-N 3.44Å; G331-C333 VanDerWaalsContact C-N 3.32Å; G331-C333 PolarHBondContact O-N 3.1Å; G331-H334 WeakPolarHBondContact O-CB 3.12Å; G331-H334 PolarHBondContact O-N 3.11Å; G331-H334 VanDerWaalsContact O-N 3.13Å; G331-L335 PolarHBondContact O-N 2.93Å
332	L	98.8	Very high	95.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-37.6	-179.4	-171.5	61.3	0	0	0	111.6	A328 A329 H334 L335 H336 L353 I368 D419 M420 Y423 I504	A328-L332 PolarHBondContact O-N 3.26Å; A329-L332 PolarHBondContact O-N 3.5Å; L332-H334 VanDerWaalsContact C-N 3.32Å; L332-H334 PolarHBondContact O-N 3.25Å; L332-L335 HydrophobicContact CD1-CD1 4.38Å; L332-L335 WeakPolarHBondContact O-CB 3.44Å; L332-L335 PolarHBondContact O-N 3.14Å; L332-H336 WeakPolarHBondContact CD1-NE2 3.46Å; L332-H336 WeakPolarHBondContact O-CB 3.47Å; L332-H336 PolarHBondContact O-N 3.05Å; L332-L353 HydrophobicContact CD1-CD2 4.36Å; L332-L353 HydrophobicContact CD2-CD2 3.73Å; L332-I368 HydrophobicContact CB-CD1 3.76Å; L332-I368 HydrophobicContact CD1-CD1 4.37Å; L332-I368 VanDerWaalsContact N-CD1 3.27Å; L332-D419 HydrophobicContact CD1-CB 4.3Å; L332-D419 HydrophobicContact CD2-CB 4.49Å; L332-M420 HydrophobicContact CD2-SD 4.3Å; L332-Y423 HydrophobicContact CD2-CD2 4.1Å; L332-Y423 HydrophobicContact CD2-CG 4.23Å; L332-I504 HydrophobicContact CB-CD1 4.05Å; L332-I504 HydrophobicContact CB-CG1 3.87Å; L332-I504 HydrophobicContact CD2-CD1 3.78Å; L332-I504 HydrophobicContact CD2-CG1 4.1Å; L332-I504 HydrophobicContact CG-CD1 4.15Å; L332-I504 HydrophobicContact CG-CG1 3.94Å
333	C	98.8	Very high	95.1	Very high	8 Å²	8	44.5 Å²	44.5	5%	0.054	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-40.9	172.8	-172.7	0	0	0	0	111.8	A329 G331 H336 T337 I504 K508	A329-C333 WeakPolarHBondContact O-CB 3.4Å; A329-C333 PolarHBondContact O-N 3.25Å; G331-C333 VanDerWaalsContact C-N 3.32Å; G331-C333 PolarHBondContact O-N 3.1Å; C333-H336 PolarHBondContact O-N 2.86Å; C333-T337 VanDerWaalsContact O-CB 3.3Å; C333-T337 WeakPolarHBondContact O-CB 3.39Å; C333-T337 PolarHBondContact O-N 3.09Å; C333-T337 PolarHBondContact O-OG1 3.03Å; C333-I504 HydrophobicContact CB-CG1 3.95Å; C333-I504 HydrophobicContact CB-CG2 3.95Å; C333-K508 HydrophobicContact CB-CD 4.24Å
334	H	98.6	Very high	94.5	Very high	27 Å²	27	40.1 Å²	40.1	13%	0.125	22%	0.22	C	C	.	.	H	α-helix	trans	-65.5	-39.9	176.2	178.6	74.6	0	0	0	112	L272 M273 H275 C330 G331 L332 K345	L272-H334 PolarHBondContact O-CE1 3.01Å; L272-H334 PolarHBondContact O-NE2 3.03Å; L272-H334 VanDerWaalsContact O-NE2 3.11Å; M273-H334 PolarHBondContact O-NE2 2.9Å; H275-H334 HydrophobicContact CB-CB 4.35Å; H275-H334 VanDerWaalsContact CB-CD2 3.48Å; H275-H334 WeakPolarHBondContact CB-CD2 3.45Å; H275-H334 AromaticContact CD2-CG 3.88Å; H275-H334 AromaticContact CD2-ND1 3.91Å; H275-H334 AromaticContact CG-CD2 4Å; H275-H334 AromaticContact CG-CG 3.71Å; C330-H334 WeakPolarHBondContact O-CB 3.3Å; C330-H334 PolarHBondContact O-N 3.15Å; G331-H334 WeakPolarHBondContact O-CB 3.12Å; G331-H334 PolarHBondContact O-N 3.11Å; G331-H334 VanDerWaalsContact O-N 3.13Å; L332-H334 VanDerWaalsContact C-N 3.32Å; L332-H334 PolarHBondContact O-N 3.25Å; H334-K345 WeakPolarHBondContact O-CE 3.37Å; H334-K345 PolarHBondContact O-NZ 3.34Å
335	L	98.3	Very high	94.3	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-53.8	173.4	-79	164.9	0	0	0	111.3	M273 I278 G331 L332 T337 K345 I348 I368 L371	M273-L335 HydrophobicContact CE-CD2 3.32Å; M273-L335 HydrophobicContact CE-CG 4Å; M273-L335 HydrophobicContact SD-CD2 4.09Å; I278-L335 HydrophobicContact CD1-CD1 3.79Å; I278-L335 HydrophobicContact CD1-CD2 4.36Å; I278-L335 HydrophobicContact CD1-CG 3.73Å; G331-L335 PolarHBondContact O-N 2.93Å; L332-L335 HydrophobicContact CD1-CD1 4.38Å; L332-L335 WeakPolarHBondContact O-CB 3.44Å; L332-L335 PolarHBondContact O-N 3.14Å; L335-T337 VanDerWaalsContact C-N 3.31Å; L335-T337 PolarHBondContact O-N 2.82Å; L335-K345 PolarHBondContact O-NZ 2.83Å; L335-I348 CarbonylContact C-O 3.56Å; L335-I348 VanDerWaalsContact C-O 3.24Å; L335-I348 HydrophobicContact CD2-CB 4.03Å; L335-I348 HydrophobicContact CD2-CG2 3.83Å; L335-I348 PolarHBondContact O-N 3.5Å; L335-I368 HydrophobicContact CD1-CD1 4.11Å; L335-I368 HydrophobicContact CD1-CG2 4.2Å; L335-L371 HydrophobicContact CD1-CD2 4.32Å; L335-L371 HydrophobicContact CD2-CD2 4.36Å
336	H	98.2	Very high	94.1	Very high	14 Å²	14	41.5 Å²	41.5	7%	0.065	23%	0.229	C	C	.	.	H	α-helix	trans	-68.7	-24.5	-174.5	-68	-179.6	0	0	0	114.3	L332 C333 A347 I348 I416 D419 I504	L332-H336 WeakPolarHBondContact CD1-NE2 3.46Å; L332-H336 WeakPolarHBondContact O-CB 3.47Å; L332-H336 PolarHBondContact O-N 3.05Å; C333-H336 PolarHBondContact O-N 2.86Å; H336-A347 VanDerWaalsContact O-CB 3.31Å; H336-A347 WeakPolarHBondContact O-CB 3.2Å; H336-I348 PolarHBondContact CD2-O 2.95Å; H336-I348 VanDerWaalsContact CD2-O 3.31Å; H336-I416 HydrophobicContact CB-CD1 3.99Å; H336-I416 HydrophobicContact CB-CG1 4.36Å; H336-D419 IonicContact CD2-OD2 3.44Å; H336-D419 IonicContact CE1-OD2 3.67Å; H336-D419 IonicContact NE2-OD2 2.65Å; H336-D419 PolarHBondContact NE2-OD2 3.18Å; H336-I504 HydrophobicContact CB-CG2 3.96Å; H336-I504 WeakPolarHBondContact ND1-CG2 3.46Å
337	T	96.9	Very high	94	Very high	66 Å²	66	38.2 Å²	38.2	41%	0.405	22%	0.217	S	C	.	.			trans	-83.6	125.5	-178.4	-63.9	0	0	0	0	111.3	C333 L335 K345	C333-T337 VanDerWaalsContact O-CB 3.3Å; C333-T337 WeakPolarHBondContact O-CB 3.39Å; C333-T337 PolarHBondContact O-N 3.09Å; C333-T337 PolarHBondContact O-OG1 3.03Å; L335-T337 VanDerWaalsContact C-N 3.31Å; L335-T337 PolarHBondContact O-N 2.82Å; T337-K345 PolarHBondContact O-NZ 2.77Å
338	E	94.9	Very high	93.9	Very high	41 Å²	41	38 Å²	38	19%	0.192	22%	0.216	C	C	.	.			trans	-72.8	138.1	164.9	-175.1	176.8	-154.5	0	0	110.2	Y340 K345 A347 S379	E338-Y340 HydrophobicContact CG-CE1 4.39Å; E338-Y340 HydrophobicContact CG-CE2 4.49Å; E338-Y340 VanDerWaalsContact OE2-CZ 3.27Å; E338-Y340 PolarHBondContact OE2-OH 3Å; E338-K345 CarbonylContact C-O 3.54Å; E338-K345 WeakPolarHBondContact CA-O 3.5Å; E338-K345 WeakPolarHBondContact CG-O 3.33Å; E338-A347 HydrophobicContact CB-CB 4.21Å; E338-S379 WeakPolarHBondContact OE1-CB 3.15Å; E338-S379 PolarHBondContact OE1-OG 2.96Å
339	I	92.9	Very high	93.8	Very high	56 Å²	56	38 Å²	38	29%	0.287	22%	0.216	S	C	.	.	B	Isolated β-bridge	trans	-117.9	114	176.1	-52.6	176.2	0	0	0	108.1	L272 G344 K345	L272-I339 HydrophobicContact CB-CD1 4.36Å; L272-I339 HydrophobicContact CD1-CB 4.33Å; L272-I339 HydrophobicContact CD1-CG2 3.86Å; I339-G344 CarbonylContact O-C 3.55Å; I339-G344 WeakPolarHBondContact O-CA 3.26Å; I339-K345 HydrophobicContact CB-CB 3.93Å; I339-K345 HydrophobicContact CD1-CB 4.2Å; I339-K345 HydrophobicContact CD1-CD 3.96Å; I339-K345 HydrophobicContact CG1-CB 4.13Å; I339-K345 HydrophobicContact CG1-CD 4.35Å; I339-K345 PolarHBondContact N-O 2.94Å; I339-K345 PolarHBondContact O-N 3.25Å
340	Y	87.9	Confident	93.8	Very high	183 Å²	183	38 Å²	38	72%	0.718	22%	0.216	S	C	*	.			trans	-76.3	144.3	178.3	-59.9	-84.6	0	0	0	111.6	E338	E338-Y340 HydrophobicContact CG-CE1 4.39Å; E338-Y340 HydrophobicContact CG-CE2 4.49Å; E338-Y340 VanDerWaalsContact OE2-CZ 3.27Å; E338-Y340 PolarHBondContact OE2-OH 3Å
341	G	82.1	Confident	93.6	Very high	57 Å²	57	38.9 Å²	38.9	59%	0.588	22%	0.218	S	C	*	.	S	Bend	trans	166.9	176.4	177.7	0	0	0	0	0	111.5	Q343 G344	G341-Q343 PolarHBondContact O-N 2.78Å; G341-G344 PolarHBondContact O-N 2.8Å
342	T	78.5	Confident	93.5	Very high	147 Å²	147	39.6 Å²	39.6	90%	0.902	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-31.4	175.1	46.5	0	0	0	0	112.7
343	Q	81.9	Confident	93.5	Very high	123 Å²	123	39.6 Å²	39.6	58%	0.575	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.5	79	167.7	-65.8	-70.1	-38.5	0	0	107.2	V271 G341	V271-Q343 HydrophobicContact CG1-CB 3.79Å; V271-Q343 WeakPolarHBondContact CG1-O 3.23Å; V271-Q343 HydrophobicContact CG2-CB 4.48Å; G341-Q343 PolarHBondContact O-N 2.78Å
344	G	87.2	Confident	93.5	Very high	31 Å²	31	40.5 Å²	40.5	32%	0.32	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-70.8	163.3	-178.9	0	0	0	0	0	113.3	I339 G341	I339-G344 CarbonylContact O-C 3.55Å; I339-G344 WeakPolarHBondContact O-CA 3.26Å; G341-G344 PolarHBondContact O-N 2.8Å
345	K	93.8	Very high	93.5	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.009	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-102	121.6	168.5	-175	-163.7	149.6	-65.7	0	108.7	T270 V271 L272 H334 L335 T337 E338 I339	T270-K345 HydrophobicContact CG2-CG 4.26Å; V271-K345 WeakPolarHBondContact O-CB 3.44Å; V271-K345 WeakPolarHBondContact O-CG 3.41Å; L272-K345 HydrophobicContact CB-CB 4.15Å; H334-K345 WeakPolarHBondContact O-CE 3.37Å; H334-K345 PolarHBondContact O-NZ 3.34Å; L335-K345 PolarHBondContact O-NZ 2.83Å; T337-K345 PolarHBondContact O-NZ 2.77Å; E338-K345 CarbonylContact C-O 3.54Å; E338-K345 WeakPolarHBondContact CA-O 3.5Å; E338-K345 WeakPolarHBondContact CG-O 3.33Å; I339-K345 HydrophobicContact CB-CB 3.93Å; I339-K345 HydrophobicContact CD1-CB 4.2Å; I339-K345 HydrophobicContact CD1-CD 3.96Å; I339-K345 HydrophobicContact CG1-CB 4.13Å; I339-K345 HydrophobicContact CG1-CD 4.35Å; I339-K345 PolarHBondContact N-O 2.94Å; I339-K345 PolarHBondContact O-N 3.25Å
346	P	94.8	Very high	93.4	Very high	30 Å²	30	44.7 Å²	44.7	20%	0.195	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-64.8	156.9	172.4	28	-34.4	0	0	0	111	T270 K376 F377	T270-P346 HydrophobicContact CG2-CG 4.06Å; P346-K376 HydrophobicContact CB-CB 4.34Å; P346-K376 HydrophobicContact CG-CB 4.23Å; P346-K376 HydrophobicContact CG-CD 4.18Å; P346-K376 HydrophobicContact CG-CG 4.2Å; P346-F377 WeakPolarHBondContact CB-O 3.26Å
347	A	96.1	Very high	93.4	Very high	6 Å²	6	44.6 Å²	44.6	5%	0.05	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-67.3	138.7	166.4	0	0	0	0	0	109.7	H336 E338 K376 F377 F412	H336-A347 VanDerWaalsContact O-CB 3.31Å; H336-A347 WeakPolarHBondContact O-CB 3.2Å; E338-A347 HydrophobicContact CB-CB 4.21Å; A347-K376 WeakPolarHBondContact O-CA 3.37Å; A347-F377 HydrophobicContact CB-CB 4.21Å; A347-F377 PolarHBondContact O-N 2.61Å; A347-F412 VanDerWaalsContact C-CZ 3.47Å; A347-F412 HydrophobicContact CB-CD1 4.3Å; A347-F412 HydrophobicContact CB-CE1 3.44Å; A347-F412 VanDerWaalsContact CB-CE1 3.44Å; A347-F412 HydrophobicContact CB-CZ 3.97Å; A347-F412 VanDerWaalsContact O-CZ 3.26Å; A347-F412 WeakPolarHBondContact O-CZ 3.3Å
348	I	97	Very high	93.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	127.9	-174.8	-61.6	169.5	0	0	0	109.3	T270 M273 L335 H336 A374 V375 K376	T270-I348 HydrophobicContact CG2-CD1 4.35Å; M273-I348 HydrophobicContact SD-CD1 3.6Å; M273-I348 VanDerWaalsContact SD-CD1 3.6Å; L335-I348 CarbonylContact C-O 3.56Å; L335-I348 VanDerWaalsContact C-O 3.24Å; L335-I348 HydrophobicContact CD2-CB 4.03Å; L335-I348 HydrophobicContact CD2-CG2 3.83Å; L335-I348 PolarHBondContact O-N 3.5Å; H336-I348 PolarHBondContact CD2-O 2.95Å; H336-I348 VanDerWaalsContact CD2-O 3.31Å; I348-A374 HydrophobicContact CG2-CB 3.83Å; I348-V375 CarbonylContact C-O 3.57Å; I348-V375 VanDerWaalsContact CA-O 3.28Å; I348-V375 WeakPolarHBondContact CA-O 3.42Å; I348-K376 HydrophobicContact CG1-CG 4.13Å
349	A	97.1	Very high	93.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	138.7	170.8	0	0	0	0	0	110.2	A374 V375 F412 Y415 I416 D419	A349-A374 CarbonylContact O-C 3.57Å; A349-A374 WeakPolarHBondContact O-CA 3.48Å; A349-A374 WeakPolarHBondContact O-CB 3.36Å; A349-V375 HydrophobicContact CB-CG2 3.92Å; A349-V375 PolarHBondContact N-O 3.28Å; A349-V375 PolarHBondContact O-N 3.33Å; A349-F412 HydrophobicContact CB-CE2 4.1Å; A349-F412 HydrophobicContact CB-CZ 4.03Å; A349-Y415 VanDerWaalsContact CB-CB 3.46Å; A349-I416 HydrophobicContact CB-CG1 4.35Å; A349-D419 WeakPolarHBondContact CA-OD2 3.24Å
350	H	97.6	Very high	93.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.209	C	C	.	.			trans	-80.3	-43.2	-169.6	-174.3	-76.6	0	0	0	113.3	D352 L353 I368 A369 D370 L371 D419	H350-D352 PolarHBondContact CE1-O 2.85Å; H350-D352 VanDerWaalsContact CE1-O 3.24Å; H350-D352 PolarHBondContact ND1-N 3.42Å; H350-D352 VanDerWaalsContact ND1-N 3.19Å; H350-D352 PolarHBondContact O-N 3.05Å; H350-L353 PolarHBondContact ND1-N 3.03Å; H350-L353 VanDerWaalsContact ND1-N 3.11Å; H350-I368 VanDerWaalsContact CD2-CG2 3.41Å; H350-I368 WeakPolarHBondContact CD2-CG2 3.34Å; H350-I368 WeakPolarHBondContact NE2-CG2 3.42Å; H350-A369 PolarHBondContact NE2-O 3.31Å; H350-A369 VanDerWaalsContact NE2-O 3.09Å; H350-D370 PolarHBondContact NE2-O 3Å; H350-L371 VanDerWaalsContact CD2-CD2 3.47Å; H350-L371 WeakPolarHBondContact CD2-CD2 3.39Å; H350-D419 PolarHBondContact N-OD2 3.07Å
351	R	95.9	Very high	94.4	Very high	26 Å²	26	31.4 Å²	31.4	10%	0.098	18%	0.182	C	C	.	.	S	Bend	trans	66.4	-12.2	176.8	-57.8	-178.1	60.4	-168.8	5.8	117.9	L373 V375 S389 T390 V392 Y415 D419	R351-L373 WeakPolarHBondContact CD-O 3.18Å; R351-V375 HydrophobicContact CG-CG2 4.29Å; R351-S389 PolarHBondContact NH2-O 3.07Å; R351-T390 PolarHBondContact NH2-O 3.1Å; R351-T390 VanDerWaalsContact NH2-O 3.12Å; R351-V392 VanDerWaalsContact CZ-CG2 3.45Å; R351-Y415 HydrophobicContact CG-CD1 4.16Å; R351-D419 PolarHBondContact N-OD1 3.03Å
352	D	96.5	Very high	95.1	Very high	14 Å²	14	36.9 Å²	36.9	8%	0.075	19%	0.19	C	C	.	.			trans	-132.6	43.1	171.7	-166.1	29.5	0	0	0	113	H350 K354 N357 L373 G393 T394	H350-D352 PolarHBondContact CE1-O 2.85Å; H350-D352 VanDerWaalsContact CE1-O 3.24Å; H350-D352 PolarHBondContact ND1-N 3.42Å; H350-D352 VanDerWaalsContact ND1-N 3.19Å; H350-D352 PolarHBondContact O-N 3.05Å; D352-K354 PolarHBondContact O-N 3.29Å; D352-K354 IonicContact OD1-NZ 2.63Å; D352-K354 PolarHBondContact OD1-NZ 3.41Å; D352-K354 IonicContact OD2-NZ 3.37Å; D352-K354 PolarHBondContact OD2-NZ 2.97Å; D352-N357 PolarHBondContact O-ND2 3.38Å; D352-N357 PolarHBondContact OD2-ND2 3.28Å; D352-L373 HydrophobicContact CB-CD1 3.88Å; D352-G393 WeakPolarHBondContact OD1-CA 3.41Å; D352-T394 VanDerWaalsContact OD1-CB 3.31Å; D352-T394 WeakPolarHBondContact OD1-CB 3.48Å; D352-T394 PolarHBondContact OD1-N 2.77Å; D352-T394 PolarHBondContact OD1-OG1 3.43Å
353	L	98.4	Very high	95.9	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.17	C	C	.	.			trans	-73.1	123.4	-177.3	-169.9	72.4	0	0	0	110.3	L332 H350 I358 I368 S422 Y423	L332-L353 HydrophobicContact CD1-CD2 4.36Å; L332-L353 HydrophobicContact CD2-CD2 3.73Å; H350-L353 PolarHBondContact ND1-N 3.03Å; H350-L353 VanDerWaalsContact ND1-N 3.11Å; L353-I358 HydrophobicContact CD1-CD1 4.17Å; L353-I358 HydrophobicContact CD1-CG1 4.28Å; L353-I368 HydrophobicContact CD1-CD1 4.24Å; L353-I368 HydrophobicContact CD1-CG2 4.22Å; L353-S422 WeakPolarHBondContact O-CB 3.3Å; L353-Y423 HydrophobicContact CD2-CD2 4.3Å
354	K	98.4	Very high	96.6	Very high	27 Å²	27	29.4 Å²	29.4	12%	0.117	15%	0.154	C	C	.	.	S	Bend	trans	-161.6	163.5	-178.7	62.4	-163.1	179.4	-155.6	0	110.2	D352 K356 N357 I358 T394 Y397	D352-K354 PolarHBondContact O-N 3.29Å; D352-K354 IonicContact OD1-NZ 2.63Å; D352-K354 PolarHBondContact OD1-NZ 3.41Å; D352-K354 IonicContact OD2-NZ 3.37Å; D352-K354 PolarHBondContact OD2-NZ 2.97Å; K354-K356 HydrophobicContact CG-CB 4.25Å; K354-K356 PolarHBondContact O-N 3.35Å; K354-K356 VanDerWaalsContact O-N 3.15Å; K354-N357 WeakPolarHBondContact CE-ND2 3.2Å; K354-N357 WeakPolarHBondContact CE-OD1 3.37Å; K354-N357 HydrophobicContact CG-CB 4.05Å; K354-N357 PolarHBondContact O-N 2.77Å; K354-I358 PolarHBondContact O-N 3.24Å; K354-T394 HydrophobicContact CD-CG2 4.21Å; K354-T394 WeakPolarHBondContact CD-OG1 3.23Å; K354-T394 WeakPolarHBondContact CE-OG1 3.48Å; K354-T394 PolarHBondContact NZ-OG1 3.42Å; K354-Y397 HydrophobicContact CB-CD1 3.95Å; K354-Y397 HydrophobicContact CB-CD2 3.75Å; K354-Y397 HydrophobicContact CB-CE1 3.89Å; K354-Y397 HydrophobicContact CB-CE2 3.69Å; K354-Y397 HydrophobicContact CB-CG 3.88Å
355	S	98.5	Very high	97.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-59.9	-26.4	-179.3	55.9	0	0	0	0	114.2	L307 Y308 N357 Y397 E429	L307-S355 WeakPolarHBondContact CB-O 3.11Å; L307-S355 PolarHBondContact N-O 2.89Å; Y308-S355 PolarHBondContact N-O 3.22Å; S355-N357 VanDerWaalsContact C-N 3.33Å; S355-Y397 PolarHBondContact OG-OH 3.35Å; S355-E429 VanDerWaalsContact CB-OE2 3.28Å; S355-E429 WeakPolarHBondContact CB-OE2 3.41Å; S355-E429 PolarHBondContact OG-OE1 3.47Å; S355-E429 PolarHBondContact OG-OE2 3.15Å
356	K	97.2	Very high	97.3	Very high	115 Å²	115	28.8 Å²	28.8	50%	0.5	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-71.1	-23.3	172.9	-71.3	-174.3	176.5	-176.3	0	114.3	S306 Y308 K354	S306-K356 WeakPolarHBondContact CB-O 3.09Å; Y308-K356 HydrophobicContact CD1-CG 4.1Å; Y308-K356 HydrophobicContact CD2-CG 4.02Å; Y308-K356 HydrophobicContact CG-CD 4.42Å; Y308-K356 HydrophobicContact CG-CG 3.63Å; K354-K356 HydrophobicContact CG-CB 4.25Å; K354-K356 PolarHBondContact O-N 3.35Å; K354-K356 VanDerWaalsContact O-N 3.15Å
357	N	97.9	Very high	97.5	Very high	12 Å²	12	27.3 Å²	27.3	6%	0.064	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-102.7	13.1	-178.1	-71.7	13	0	0	0	112.2	D352 K354 S355 A369 D370	D352-N357 PolarHBondContact O-ND2 3.38Å; D352-N357 PolarHBondContact OD2-ND2 3.28Å; K354-N357 WeakPolarHBondContact CE-ND2 3.2Å; K354-N357 WeakPolarHBondContact CE-OD1 3.37Å; K354-N357 HydrophobicContact CG-CB 4.05Å; K354-N357 PolarHBondContact O-N 2.77Å; S355-N357 VanDerWaalsContact C-N 3.33Å; N357-A369 PolarHBondContact O-N 3.39Å; N357-D370 HydrophobicContact CB-CB 4.25Å; N357-D370 WeakPolarHBondContact ND2-CB 3.4Å; N357-D370 PolarHBondContact ND2-OD2 3.26Å; N357-D370 PolarHBondContact OD1-OD2 3.11Å
358	I	98.8	Very high	97.7	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.2	171.4	-62.4	168.6	0	0	0	106.2	S306 L307 L353 K354 C366 C367 I368 V426	S306-I358 CarbonylContact C-O 3.59Å; S306-I358 VanDerWaalsContact CA-O 3.32Å; S306-I358 WeakPolarHBondContact CA-O 3.28Å; L307-I358 HydrophobicContact CB-CB 4.18Å; L307-I358 HydrophobicContact CB-CG2 4.25Å; L307-I358 HydrophobicContact CD2-CB 4.47Å; L307-I358 HydrophobicContact CD2-CD1 4.48Å; L307-I358 HydrophobicContact CD2-CG2 4.39Å; L307-I358 PolarHBondContact N-O 3.13Å; L353-I358 HydrophobicContact CD1-CD1 4.17Å; L353-I358 HydrophobicContact CD1-CG1 4.28Å; K354-I358 PolarHBondContact O-N 3.24Å; I358-C366 HydrophobicContact CG2-CB 3.66Å; I358-C367 CarbonylContact C-O 3.41Å; I358-C367 WeakPolarHBondContact CA-O 3.48Å; I358-I368 HydrophobicContact CG1-CG1 4.48Å; I358-V426 HydrophobicContact CD1-CG1 3.81Å; I358-V426 HydrophobicContact CD1-CG2 4.36Å
359	L	98.6	Very high	97.7	Very high	32 Å²	32	27.5 Å²	27.5	17%	0.168	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	145.6	178.9	-57	-179.7	0	0	0	110.4	L279 H302 G305 C366 C367 A369	L279-L359 HydrophobicContact CD1-CD1 3.86Å; L279-L359 HydrophobicContact CD2-CD1 4.06Å; H302-L359 HydrophobicContact CB-CB 4.37Å; G305-L359 WeakPolarHBondContact O-CA 3.36Å; L359-C366 CarbonylContact O-C 3.6Å; L359-C366 VanDerWaalsContact O-CA 3.24Å; L359-C366 WeakPolarHBondContact O-CA 3.26Å; L359-C367 PolarHBondContact N-O 2.78Å; L359-C367 PolarHBondContact O-N 2.74Å; L359-A369 HydrophobicContact CD1-CB 4.18Å; L359-A369 HydrophobicContact CG-CB 4.1Å
360	V	98.8	Very high	97.5	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.6	175.4	-176.5	0	0	0	0	109	N304 G305 L307 F310 L324	N304-V360 HydrophobicContact CB-CB 3.91Å; N304-V360 HydrophobicContact CB-CG1 4.12Å; N304-V360 WeakPolarHBondContact CB-O 3.36Å; G305-V360 PolarHBondContact O-N 3.02Å; L307-V360 HydrophobicContact CB-CG2 4.16Å; L307-V360 HydrophobicContact CD1-CG2 3.92Å; F310-V360 HydrophobicContact CB-CB 4.44Å; F310-V360 HydrophobicContact CB-CG2 3.84Å; F310-V360 HydrophobicContact CD1-CG2 4.19Å; F310-V360 HydrophobicContact CD2-CB 4.25Å; F310-V360 HydrophobicContact CD2-CG1 4.04Å; F310-V360 HydrophobicContact CD2-CG2 4.38Å; F310-V360 HydrophobicContact CE2-CG1 4.09Å; F310-V360 HydrophobicContact CG-CB 4.26Å; F310-V360 HydrophobicContact CG-CG1 4.26Å; F310-V360 HydrophobicContact CG-CG2 3.88Å; F310-V360 HydrophobicContact CZ-CG1 4.37Å; L324-V360 HydrophobicContact CD2-CG1 4.03Å; L324-V360 HydrophobicContact CD2-CG2 4.24Å
361	K	98.3	Very high	97.4	Very high	34 Å²	34	29.2 Å²	29.2	15%	0.148	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-86.2	166.6	177.6	-61.9	-170.5	-177.6	-168.8	0	111.4	E276 N304 N363 G364 T365	E276-K361 VanDerWaalsContact O-CE 3.23Å; E276-K361 WeakPolarHBondContact O-CE 3.31Å; E276-K361 PolarHBondContact O-NZ 2.8Å; N304-K361 PolarHBondContact ND2-O 2.88Å; K361-N363 WeakPolarHBondContact CB-OD1 3.42Å; K361-N363 PolarHBondContact O-N 3.2Å; K361-G364 PolarHBondContact O-N 2.84Å; K361-G364 VanDerWaalsContact O-N 3.08Å; K361-T365 WeakPolarHBondContact CB-O 3.36Å; K361-T365 WeakPolarHBondContact CG-O 3.39Å; K361-T365 PolarHBondContact N-O 3.47Å
362	K	96.4	Very high	97.2	Very high	173 Å²	173	28.1 Å²	28.1	75%	0.752	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-31	177.1	-172.3	175.3	-176.2	172.1	0	113.6	E303 G364	E303-K362 WeakPolarHBondContact OE1-CD 3.5Å; K362-G364 PolarHBondContact O-N 2.89Å
363	N	95.4	Very high	97	Very high	89 Å²	89	28.5 Å²	28.5	48%	0.476	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	8.4	177.3	66.8	-12.1	0	0	0	113.7	K361 T365	K361-N363 WeakPolarHBondContact CB-OD1 3.42Å; K361-N363 PolarHBondContact O-N 3.2Å; N363-T365 VanDerWaalsContact C-N 3.31Å; N363-T365 PolarHBondContact O-N 3.02Å; N363-T365 PolarHBondContact OD1-N 3.35Å; N363-T365 PolarHBondContact OD1-OG1 2.94Å
364	G	95.6	Very high	96.8	Very high	24 Å²	24	28.4 Å²	28.4	25%	0.247	14%	0.143	C	C	.	.	S	Bend	trans	75.5	13.6	178.9	0	0	0	0	0	114.8	R323 L324 K361 K362	R323-G364 WeakPolarHBondContact CD-O 3.31Å; L324-G364 VanDerWaalsContact CD2-O 3.31Å; L324-G364 WeakPolarHBondContact CD2-O 3.28Å; K361-G364 PolarHBondContact O-N 2.84Å; K361-G364 VanDerWaalsContact O-N 3.08Å; K362-G364 PolarHBondContact O-N 2.89Å
365	T	98.5	Very high	96.5	Very high	19 Å²	19	27.1 Å²	27.1	12%	0.117	14%	0.138	C	C	.	.			trans	-99	162.7	170.1	70.3	0	0	0	0	111.2	R323 K361 N363	R323-T365 HydrophobicContact CG-CG2 4.12Å; K361-T365 WeakPolarHBondContact CB-O 3.36Å; K361-T365 WeakPolarHBondContact CG-O 3.39Å; K361-T365 PolarHBondContact N-O 3.47Å; N363-T365 VanDerWaalsContact C-N 3.31Å; N363-T365 PolarHBondContact O-N 3.02Å; N363-T365 PolarHBondContact OD1-N 3.35Å; N363-T365 PolarHBondContact OD1-OG1 2.94Å
366	C	98.6	Very high	96.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	157	179.1	-66.8	0	0	0	0	112.2	N277 L324 S327 A328 I358 L359	N277-C366 WeakPolarHBondContact CA-O 3.48Å; N277-C366 WeakPolarHBondContact CB-O 3.37Å; N277-C366 PolarHBondContact ND2-O 3.27Å; L324-C366 WeakPolarHBondContact CD2-SG 3.43Å; L324-C366 PolarHBondContact O-SG 2.78Å; L324-C366 VanDerWaalsContact O-SG 3.35Å; S327-C366 WeakPolarHBondContact OG-CB 3.34Å; S327-C366 PolarHBondContact OG-N 3.45Å; A328-C366 HydrophobicContact CB-CB 4.09Å; I358-C366 HydrophobicContact CG2-CB 3.66Å; L359-C366 CarbonylContact O-C 3.6Å; L359-C366 VanDerWaalsContact O-CA 3.24Å; L359-C366 WeakPolarHBondContact O-CA 3.26Å
367	C	98.6	Very high	96	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	146	156.3	60.6	0	0	0	0	111.5	N277 H302 I358 L359	N277-C367 CarbonylContact O-C 3.53Å; N277-C367 VanDerWaalsContact O-CA 3.25Å; N277-C367 WeakPolarHBondContact O-CA 3.5Å; H302-C367 PolarHBondContact CD2-SG 2.95Å; H302-C367 PolarHBondContact NE2-SG 2.88Å; I358-C367 CarbonylContact C-O 3.41Å; I358-C367 WeakPolarHBondContact CA-O 3.48Å; L359-C367 PolarHBondContact N-O 2.78Å; L359-C367 PolarHBondContact O-N 2.74Å
368	I	98.8	Very high	95.4	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	136.6	178.9	-57.8	178.3	0	0	0	109.7	N277 I278 L279 L332 L335 H350 L353 I358 L371	N277-I368 PolarHBondContact O-N 3.08Å; I278-I368 HydrophobicContact CD1-CB 4.06Å; L279-I368 WeakPolarHBondContact CB-O 3.37Å; L279-I368 PolarHBondContact N-O 3.06Å; L332-I368 HydrophobicContact CB-CD1 3.76Å; L332-I368 HydrophobicContact CD1-CD1 4.37Å; L332-I368 VanDerWaalsContact N-CD1 3.27Å; L335-I368 HydrophobicContact CD1-CD1 4.11Å; L335-I368 HydrophobicContact CD1-CG2 4.2Å; H350-I368 VanDerWaalsContact CD2-CG2 3.41Å; H350-I368 WeakPolarHBondContact CD2-CG2 3.34Å; H350-I368 WeakPolarHBondContact NE2-CG2 3.42Å; L353-I368 HydrophobicContact CD1-CD1 4.24Å; L353-I368 HydrophobicContact CD1-CG2 4.22Å; I358-I368 HydrophobicContact CG1-CG1 4.48Å; I368-L371 HydrophobicContact CG2-CD2 4.36Å
369	A	97.1	Very high	94.6	Very high	9 Å²	9	30.3 Å²	30.3	7%	0.074	16%	0.16	C	C	.	.			trans	-129.1	173.3	-177.2	0	0	0	0	0	111.4	L279 H350 N357 L359	L279-A369 HydrophobicContact CB-CB 4.08Å; L279-A369 HydrophobicContact CD2-CB 3.61Å; L279-A369 HydrophobicContact CG-CB 4.47Å; H350-A369 PolarHBondContact NE2-O 3.31Å; H350-A369 VanDerWaalsContact NE2-O 3.09Å; N357-A369 PolarHBondContact O-N 3.39Å; L359-A369 HydrophobicContact CD1-CB 4.18Å; L359-A369 HydrophobicContact CG-CB 4.1Å
370	D	94.2	Very high	93.7	Very high	36 Å²	36	36.1 Å²	36.1	19%	0.193	19%	0.191	C	C	.	.			trans	61.3	66.9	174.5	-166	27.2	0	0	0	113.4	K251 Y268 H350 N357 G372	K251-D370 IonicContact NZ-OD1 2.64Å; K251-D370 PolarHBondContact NZ-OD1 2.75Å; Y268-D370 PolarHBondContact OH-N 3.3Å; H350-D370 PolarHBondContact NE2-O 3Å; N357-D370 HydrophobicContact CB-CB 4.25Å; N357-D370 WeakPolarHBondContact ND2-CB 3.4Å; N357-D370 PolarHBondContact ND2-OD2 3.26Å; N357-D370 PolarHBondContact OD1-OD2 3.11Å; D370-G372 VanDerWaalsContact C-N 3.26Å; D370-G372 PolarHBondContact O-N 3.21Å
371	L	94.6	Very high	92.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.211	C	C	.	.			trans	-87.6	14.1	-177.8	-54	179.6	0	0	0	113.3	I267 Y268 L335 H350 I368 L373 A374	I267-L371 HydrophobicContact CB-CB 4.29Å; I267-L371 HydrophobicContact CG2-CB 3.66Å; I267-L371 HydrophobicContact CG2-CD1 3.75Å; I267-L371 HydrophobicContact CG2-CG 4.31Å; Y268-L371 HydrophobicContact CD1-CD1 3.86Å; Y268-L371 HydrophobicContact CE1-CD1 3.57Å; Y268-L371 HydrophobicContact CE1-CG 4.12Å; Y268-L371 HydrophobicContact CE2-CB 4.35Å; Y268-L371 HydrophobicContact CE2-CD1 4.37Å; Y268-L371 HydrophobicContact CE2-CG 4.31Å; Y268-L371 HydrophobicContact CG-CD1 4.38Å; L335-L371 HydrophobicContact CD1-CD2 4.32Å; L335-L371 HydrophobicContact CD2-CD2 4.36Å; H350-L371 VanDerWaalsContact CD2-CD2 3.47Å; H350-L371 WeakPolarHBondContact CD2-CD2 3.39Å; I368-L371 HydrophobicContact CG2-CD2 4.36Å; L371-L373 PolarHBondContact O-N 3.26Å; L371-L373 VanDerWaalsContact O-N 3.16Å; L371-A374 HydrophobicContact CB-CB 4.35Å; L371-A374 VanDerWaalsContact O-CB 3.24Å; L371-A374 WeakPolarHBondContact O-CB 3.27Å; L371-A374 PolarHBondContact O-N 3.47Å; L371-A374 VanDerWaalsContact O-N 3.08Å
372	G	91.6	Very high	92	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.021	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.4	-173.3	0	0	0	0	0	115.1	R263 D370	R263-G372 WeakPolarHBondContact CD-O 3.05Å; D370-G372 VanDerWaalsContact C-N 3.26Å; D370-G372 PolarHBondContact O-N 3.21Å
373	L	91.9	Very high	91.4	Very high	22 Å²	22	39.4 Å²	39.4	12%	0.115	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	1.9	174.7	-70.3	177.8	0	0	0	113.5	Y235 R351 D352 L371 V392	Y235-L373 WeakPolarHBondContact OH-CD2 3.3Å; R351-L373 WeakPolarHBondContact CD-O 3.18Å; D352-L373 HydrophobicContact CB-CD1 3.88Å; L371-L373 PolarHBondContact O-N 3.26Å; L371-L373 VanDerWaalsContact O-N 3.16Å; L373-V392 HydrophobicContact CD1-CB 4.32Å; L373-V392 HydrophobicContact CD1-CG2 4.29Å; L373-V392 HydrophobicContact CD2-CB 4.17Å; L373-V392 HydrophobicContact CD2-CG2 4.13Å
374	A	94.4	Very high	90.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.205	C	C	.	.			trans	-65.1	157.4	-177.3	0	0	0	0	0	112.1	I267 I348 A349 L371	I267-A374 HydrophobicContact CD1-CB 3.97Å; I267-A374 HydrophobicContact CG1-CB 4.26Å; I267-A374 HydrophobicContact CG2-CB 4.21Å; I348-A374 HydrophobicContact CG2-CB 3.83Å; A349-A374 CarbonylContact O-C 3.57Å; A349-A374 WeakPolarHBondContact O-CA 3.48Å; A349-A374 WeakPolarHBondContact O-CB 3.36Å; L371-A374 HydrophobicContact CB-CB 4.35Å; L371-A374 VanDerWaalsContact O-CB 3.24Å; L371-A374 WeakPolarHBondContact O-CB 3.27Å; L371-A374 PolarHBondContact O-N 3.47Å; L371-A374 VanDerWaalsContact O-N 3.08Å
375	V	93.3	Very high	89.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	138.8	176.9	-69.1	0	0	0	0	109.8	I348 A349 R351 V384 D385 P387 F412 Y415	I348-V375 CarbonylContact C-O 3.57Å; I348-V375 VanDerWaalsContact CA-O 3.28Å; I348-V375 WeakPolarHBondContact CA-O 3.42Å; A349-V375 HydrophobicContact CB-CG2 3.92Å; A349-V375 PolarHBondContact N-O 3.28Å; A349-V375 PolarHBondContact O-N 3.33Å; R351-V375 HydrophobicContact CG-CG2 4.29Å; V375-V384 HydrophobicContact CB-CG1 4.02Å; V375-V384 HydrophobicContact CG2-CG1 4.27Å; V375-D385 VanDerWaalsContact C-OD1 3.31Å; V375-D385 WeakPolarHBondContact CA-OD1 3.37Å; V375-D385 WeakPolarHBondContact CB-OD1 3.26Å; V375-P387 HydrophobicContact CG1-CG 4.41Å; V375-F412 HydrophobicContact CG2-CE2 4.09Å; V375-Y415 HydrophobicContact CG2-CD1 4.37Å; V375-Y415 HydrophobicContact CG2-CD2 4.32Å; V375-Y415 HydrophobicContact CG2-CG 4.1Å
376	K	93.1	Very high	88.4	Confident	32 Å²	32	40 Å²	40	14%	0.139	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	141.6	175.6	-59.9	174.1	-174.9	176.1	0	110.2	E266 I267 T270 P346 A347 I348 D385	E266-K376 PolarHBondContact O-NZ 3.11Å; E266-K376 IonicContact OE1-NZ 2.67Å; E266-K376 PolarHBondContact OE1-NZ 3.33Å; I267-K376 HydrophobicContact CD1-CD 4.16Å; I267-K376 VanDerWaalsContact CD1-CE 3.41Å; I267-K376 HydrophobicContact CD1-CG 3.76Å; T270-K376 VanDerWaalsContact OG1-CE 3.26Å; T270-K376 WeakPolarHBondContact OG1-CE 3.28Å; T270-K376 PolarHBondContact OG1-NZ 3.14Å; P346-K376 HydrophobicContact CB-CB 4.34Å; P346-K376 HydrophobicContact CG-CB 4.23Å; P346-K376 HydrophobicContact CG-CD 4.18Å; P346-K376 HydrophobicContact CG-CG 4.2Å; A347-K376 WeakPolarHBondContact O-CA 3.37Å; I348-K376 HydrophobicContact CG1-CG 4.13Å; K376-D385 WeakPolarHBondContact CB-OD2 3.23Å; K376-D385 PolarHBondContact N-OD1 2.88Å; K376-D385 PolarHBondContact N-OD2 3.19Å; K376-D385 PolarHBondContact O-N 3.02Å
377	F	91.8	Very high	86.7	Confident	47 Å²	47	41.4 Å²	41.4	21%	0.206	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.9	165.7	-177	-121.5	0	0	0	110.1	P346 A347 V384 F412	P346-F377 WeakPolarHBondContact CB-O 3.26Å; A347-F377 HydrophobicContact CB-CB 4.21Å; A347-F377 PolarHBondContact O-N 2.61Å; F377-V384 HydrophobicContact CD2-CG2 4.27Å; F377-F412 HydrophobicContact CB-CB 4.3Å; F377-F412 HydrophobicContact CB-CD1 3.71Å; F377-F412 HydrophobicContact CB-CD2 3.72Å; F377-F412 HydrophobicContact CB-CE1 3.86Å; F377-F412 HydrophobicContact CB-CE2 3.86Å; F377-F412 HydrophobicContact CB-CG 3.63Å; F377-F412 HydrophobicContact CB-CZ 3.94Å; F377-F412 HydrophobicContact CD2-CB 3.59Å; F377-F412 HydrophobicContact CD2-CD1 4.43Å; F377-F412 HydrophobicContact CD2-CD2 4.39Å; F377-F412 AromaticContact CD2-CG 3.91Å; F377-F412 HydrophobicContact CD2-CG 3.91Å; F377-F412 HydrophobicContact CE2-CB 4.19Å; F377-F412 HydrophobicContact CG-CB 4.09Å; F377-F412 HydrophobicContact CG-CD1 4.06Å; F377-F412 HydrophobicContact CG-CD2 4.42Å; F377-F412 AromaticContact CG-CG 3.93Å; F377-F412 HydrophobicContact CG-CG 3.93Å
378	N	85.8	Confident	85	Confident	71 Å²	71	50.5 Å²	50.5	38%	0.38	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	105.8	168.1	-173.6	-17.9	0	0	0	108.6	D380 T381 S382 E383	N378-D380 VanDerWaalsContact C-N 3.32Å; N378-D380 WeakPolarHBondContact OD1-CB 3.37Å; N378-D380 PolarHBondContact OD1-N 3.19Å; N378-T381 VanDerWaalsContact CG-OG1 3.3Å; N378-T381 PolarHBondContact ND2-OG1 2.94Å; N378-T381 PolarHBondContact OD1-N 3.33Å; N378-S382 VanDerWaalsContact O-CA 3.23Å; N378-S382 WeakPolarHBondContact O-CA 3.33Å; N378-S382 PolarHBondContact O-N 2.69Å; N378-E383 PolarHBondContact N-O 3.19Å; N378-E383 PolarHBondContact O-N 3.05Å
379	S	80.8	Confident	83.9	Confident	45 Å²	45	53 Å²	53	32%	0.315	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-28.3	180	43.3	0	0	0	0	113.3	E338	E338-S379 WeakPolarHBondContact OE1-CB 3.15Å; E338-S379 PolarHBondContact OE1-OG 2.96Å
380	D	80.6	Confident	83	Confident	153 Å²	153	52.9 Å²	52.9	82%	0.818	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-41.1	179.4	-64.2	-34.9	0	0	0	111.8	N378	N378-D380 VanDerWaalsContact C-N 3.32Å; N378-D380 WeakPolarHBondContact OD1-CB 3.37Å; N378-D380 PolarHBondContact OD1-N 3.19Å
381	T	81.4	Confident	82.6	Confident	69 Å²	69	56.5 Å²	56.5	42%	0.423	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-8.6	178.5	63.4	0	0	0	0	113.2	N378 E383	N378-T381 VanDerWaalsContact CG-OG1 3.3Å; N378-T381 PolarHBondContact ND2-OG1 2.94Å; N378-T381 PolarHBondContact OD1-N 3.33Å; T381-E383 PolarHBondContact O-N 3.28Å; T381-E383 WeakPolarHBondContact OG1-CB 3.48Å; T381-E383 PolarHBondContact OG1-N 2.6Å; T381-E383 PolarHBondContact OG1-OE2 3.36Å
382	S	80.4	Confident	82.2	Confident	85 Å²	85	57.8 Å²	57.8	59%	0.594	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	28.9	-168.9	-63.3	0	0	0	0	113.3	N378	N378-S382 VanDerWaalsContact O-CA 3.23Å; N378-S382 WeakPolarHBondContact O-CA 3.33Å; N378-S382 PolarHBondContact O-N 2.69Å
383	E	83.4	Confident	82.2	Confident	123 Å²	123	58.6 Å²	58.6	58%	0.575	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	158.8	-179.8	-64.9	173.2	155.1	0	0	111.4	N378 T381	N378-E383 PolarHBondContact N-O 3.19Å; N378-E383 PolarHBondContact O-N 3.05Å; T381-E383 PolarHBondContact O-N 3.28Å; T381-E383 WeakPolarHBondContact OG1-CB 3.48Å; T381-E383 PolarHBondContact OG1-N 2.6Å; T381-E383 PolarHBondContact OG1-OE2 3.36Å
384	V	80.5	Confident	82.3	Confident	15 Å²	15	59.7 Å²	59.7	9%	0.091	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	144	170.7	-179.9	0	0	0	0	107.4	V375 F377 I386 F412 Y415	V375-V384 HydrophobicContact CB-CG1 4.02Å; V375-V384 HydrophobicContact CG2-CG1 4.27Å; F377-V384 HydrophobicContact CD2-CG2 4.27Å; V384-I386 HydrophobicContact CB-CD1 4.17Å; V384-I386 HydrophobicContact CB-CG1 3.58Å; V384-I386 HydrophobicContact CG1-CG1 3.75Å; V384-I386 WeakPolarHBondContact O-CG1 3.09Å; V384-I386 PolarHBondContact O-N 3.33Å; V384-F412 HydrophobicContact CG1-CD2 4.16Å; V384-F412 HydrophobicContact CG2-CB 3.67Å; V384-F412 HydrophobicContact CG2-CD2 3.79Å; V384-F412 HydrophobicContact CG2-CG 4.21Å; V384-Y415 HydrophobicContact CG1-CD2 4.49Å; V384-Y415 HydrophobicContact CG1-CE2 4.02Å; V384-Y415 HydrophobicContact CG2-CE2 4.47Å
385	D	79.3	Confident	82.4	Confident	59 Å²	59	65.7 Å²	65.7	32%	0.316	35%	0.35	S	S	.	.			trans	-73.1	53.6	173.7	66.6	-8.2	0	0	0	112.3	V375 K376 P387	V375-D385 VanDerWaalsContact C-OD1 3.31Å; V375-D385 WeakPolarHBondContact CA-OD1 3.37Å; V375-D385 WeakPolarHBondContact CB-OD1 3.26Å; K376-D385 WeakPolarHBondContact CB-OD2 3.23Å; K376-D385 PolarHBondContact N-OD1 2.88Å; K376-D385 PolarHBondContact N-OD2 3.19Å; K376-D385 PolarHBondContact O-N 3.02Å; D385-P387 WeakPolarHBondContact O-CD 3.49Å
386	I	67.1	Low	82.6	Confident	72 Å²	72	66.2 Å²	66.2	37%	0.369	35%	0.352	S	S	.	.			trans	-61.1	122.8	-164.8	-60.1	164	0	0	0	110.7	V384 K409	V384-I386 HydrophobicContact CB-CD1 4.17Å; V384-I386 HydrophobicContact CB-CG1 3.58Å; V384-I386 HydrophobicContact CG1-CG1 3.75Å; V384-I386 WeakPolarHBondContact O-CG1 3.09Å; V384-I386 PolarHBondContact O-N 3.33Å; I386-K409 HydrophobicContact CD1-CB 4.49Å; I386-K409 WeakPolarHBondContact CD1-O 3.3Å
387	P	61.9	Low	82.9	Confident	28 Å²	28	65.2 Å²	65.2	18%	0.182	35%	0.348	C	S	.	.			trans	-73.5	154.8	160.7	30	-30.9	0	0	0	110.6	V375 D385 S389	V375-P387 HydrophobicContact CG1-CG 4.41Å; D385-P387 WeakPolarHBondContact O-CD 3.49Å; P387-S389 PolarHBondContact O-N 3.48Å
388	L	62.6	Low	83.2	Confident	192 Å²	192	63.5 Å²	63.5	100%	1.005	34%	0.341	S	S	*	.	S	Bend	trans	-48.7	-16.7	-177	-72.6	133.1	0	0	0	116.8
389	S	75.7	Confident	83.8	Confident	54 Å²	54	60.1 Å²	60.1	38%	0.378	32%	0.322	S	S	.	.			trans	-134.8	139.7	-178.4	-178.6	0	0	0	0	114.1	R351 P387 R391	R351-S389 PolarHBondContact NH2-O 3.07Å; P387-S389 PolarHBondContact O-N 3.48Å; S389-R391 PolarHBondContact OG-N 2.99Å
390	T	79.1	Confident	84.6	Confident	6 Å²	6	58.1 Å²	58.1	4%	0.037	31%	0.308	C	S	.	.	S	Bend	trans	-80.1	-37.5	172.8	23.8	0	0	0	0	113.1	R351 V392 D405 L407 K409	R351-T390 PolarHBondContact NH2-O 3.1Å; R351-T390 VanDerWaalsContact NH2-O 3.12Å; T390-V392 PolarHBondContact O-N 3.14Å; T390-D405 PolarHBondContact OG1-OD1 2.98Å; T390-L407 HydrophobicContact CG2-CD2 3.9Å; T390-K409 HydrophobicContact CG2-CB 4.45Å; T390-K409 HydrophobicContact CG2-CD 3.46Å; T390-K409 VanDerWaalsContact CG2-CD 3.46Å; T390-K409 HydrophobicContact CG2-CG 3.45Å; T390-K409 VanDerWaalsContact CG2-CG 3.45Å; T390-K409 WeakPolarHBondContact OG1-CE 3.45Å; T390-K409 PolarHBondContact OG1-NZ 2.93Å
391	R	84.5	Confident	85.4	Confident	111 Å²	111	51.3 Å²	51.3	42%	0.419	27%	0.272	S	S	.	.			trans	-79.8	62.9	-175.2	-62.4	178.4	-178.4	-162.2	-8.6	111.7	S389 D405 Y457	S389-R391 PolarHBondContact OG-N 2.99Å; R391-D405 IonicContact NE-OD1 2.84Å; R391-D405 VanDerWaalsContact NH2-CB 3.29Å; R391-Y457 HydrophobicContact CB-CE2 4.4Å; R391-Y457 VanDerWaalsContact CD-OH 3.23Å; R391-Y457 WeakPolarHBondContact CD-OH 3.44Å; R391-Y457 HydrophobicContact CG-CE2 4.09Å; R391-Y457 VanDerWaalsContact CZ-CZ 3.49Å; R391-Y457 PolarHBondContact NE-OH 2.7Å; R391-Y457 PolarHBondContact NH2-OH 2.84Å
392	V	87.3	Confident	86.2	Confident	28 Å²	28	48.6 Å²	48.6	17%	0.17	26%	0.255	C	S	.	.			trans	-119	160.1	175.6	-53.3	0	0	0	0	110.3	R351 L373 T390 M398	R351-V392 VanDerWaalsContact CZ-CG2 3.45Å; L373-V392 HydrophobicContact CD1-CB 4.32Å; L373-V392 HydrophobicContact CD1-CG2 4.29Å; L373-V392 HydrophobicContact CD2-CB 4.17Å; L373-V392 HydrophobicContact CD2-CG2 4.13Å; T390-V392 PolarHBondContact O-N 3.14Å; V392-M398 WeakPolarHBondContact O-CE 3.39Å
393	G	90.9	Very high	87	Confident	18 Å²	18	44.6 Å²	44.6	19%	0.186	23%	0.227	C	C	.	.	S	Bend	trans	98.9	-170	-176	0	0	0	0	0	112.5	D352 M398	D352-G393 WeakPolarHBondContact OD1-CA 3.41Å; G393-M398 WeakPolarHBondContact O-CE 3.28Å
394	T	94.6	Very high	87.5	Confident	45 Å²	45	41.9 Å²	41.9	28%	0.276	22%	0.216	S	C	.	.			trans	-87.7	114.7	-173.8	-55	0	0	0	0	110.7	D352 K354 R396 Y397 M398	D352-T394 VanDerWaalsContact OD1-CB 3.31Å; D352-T394 WeakPolarHBondContact OD1-CB 3.48Å; D352-T394 PolarHBondContact OD1-N 2.77Å; D352-T394 PolarHBondContact OD1-OG1 3.43Å; K354-T394 HydrophobicContact CD-CG2 4.21Å; K354-T394 WeakPolarHBondContact CD-OG1 3.23Å; K354-T394 WeakPolarHBondContact CE-OG1 3.48Å; K354-T394 PolarHBondContact NZ-OG1 3.42Å; T394-R396 VanDerWaalsContact C-N 3.25Å; T394-R396 PolarHBondContact O-N 3.38Å; T394-Y397 HydrophobicContact CG2-CD2 3.94Å; T394-Y397 HydrophobicContact CG2-CE2 4.46Å; T394-Y397 PolarHBondContact O-N 3.25Å; T394-M398 PolarHBondContact O-N 3.49Å
395	R	96.6	Very high	88.1	Confident	127 Å²	127	44.1 Å²	44.1	48%	0.479	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-47.3	-43	-173.9	-57.6	-174	-166.5	101.8	2.3	114.3	Y397 M398 P455 M460	R395-Y397 PolarHBondContact O-N 2.86Å; R395-Y397 VanDerWaalsContact O-N 3.13Å; R395-M398 HydrophobicContact CB-SD 4.49Å; R395-M398 HydrophobicContact CG-CE 4.23Å; R395-M398 HydrophobicContact CG-SD 4.42Å; R395-M398 WeakPolarHBondContact O-CB 3.48Å; R395-M398 PolarHBondContact O-N 3.24Å; R395-M398 VanDerWaalsContact O-N 3.14Å; R395-P455 WeakPolarHBondContact CD-O 2.99Å; R395-M460 HydrophobicContact CB-CG 4.23Å
396	R	98.2	Very high	88.8	Confident	11 Å²	11	45 Å²	45	4%	0.042	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-56	-29.2	178.9	-176	-178.5	-64.8	-73.7	-2.4	114.3	T394 P446 Y447 T452 S453 P455 M460	T394-R396 VanDerWaalsContact C-N 3.25Å; T394-R396 PolarHBondContact O-N 3.38Å; R396-P446 VanDerWaalsContact CD-O 3.23Å; R396-P446 WeakPolarHBondContact CD-O 3.42Å; R396-P446 WeakPolarHBondContact CG-O 3.16Å; R396-P446 PolarHBondContact NH1-O 3.13Å; R396-Y447 HydrophobicContact CG-CD2 4.35Å; R396-T452 PolarHBondContact NH2-O 2.77Å; R396-S453 VanDerWaalsContact NH2-C 3.32Å; R396-S453 PolarHBondContact NH2-O 3.34Å; R396-P455 HydrophobicContact CB-CG 4.22Å; R396-M460 WeakPolarHBondContact O-CE 3.24Å
397	Y	98.5	Very high	90.1	Very high	10 Å²	10	42 Å²	42	4%	0.039	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-104.5	-2.7	-176	-66.2	-96.9	0	0	0	112.8	K354 S355 T394 R395 A399 Y421 S422 L425 V426 E429 L445 P446	K354-Y397 HydrophobicContact CB-CD1 3.95Å; K354-Y397 HydrophobicContact CB-CD2 3.75Å; K354-Y397 HydrophobicContact CB-CE1 3.89Å; K354-Y397 HydrophobicContact CB-CE2 3.69Å; K354-Y397 HydrophobicContact CB-CG 3.88Å; S355-Y397 PolarHBondContact OG-OH 3.35Å; T394-Y397 HydrophobicContact CG2-CD2 3.94Å; T394-Y397 HydrophobicContact CG2-CE2 4.46Å; T394-Y397 PolarHBondContact O-N 3.25Å; R395-Y397 PolarHBondContact O-N 2.86Å; R395-Y397 VanDerWaalsContact O-N 3.13Å; Y397-A399 PolarHBondContact O-N 2.94Å; Y397-Y421 WeakPolarHBondContact O-CD1 3.03Å; Y397-S422 PolarHBondContact O-OG 3.21Å; Y397-L425 HydrophobicContact CD1-CB 4.04Å; Y397-L425 HydrophobicContact CD1-CD1 4.02Å; Y397-L425 HydrophobicContact CE1-CB 4.21Å; Y397-L425 HydrophobicContact CG-CD1 4.46Å; Y397-V426 HydrophobicContact CE1-CG2 4.21Å; Y397-E429 VanDerWaalsContact CE1-OE1 3.28Å; Y397-E429 WeakPolarHBondContact CE1-OE1 3.06Å; Y397-E429 VanDerWaalsContact OH-CD 3.31Å; Y397-E429 PolarHBondContact OH-OE1 2.86Å; Y397-E429 PolarHBondContact OH-OE2 3.36Å; Y397-L445 WeakPolarHBondContact OH-CD2 3.38Å; Y397-P446 HydrophobicContact CE1-CG 3.86Å; Y397-P446 WeakPolarHBondContact OH-CD 3.46Å
398	M	98.3	Very high	91.4	Very high	12 Å²	12	45 Å²	45	6%	0.059	24%	0.238	C	C	.	.			trans	-64.6	133.9	-178.7	-71.6	-179.2	178.3	0	0	111.1	V392 G393 T394 R395 V402 L403 Y421 Y457	V392-M398 WeakPolarHBondContact O-CE 3.39Å; G393-M398 WeakPolarHBondContact O-CE 3.28Å; T394-M398 PolarHBondContact O-N 3.49Å; R395-M398 HydrophobicContact CB-SD 4.49Å; R395-M398 HydrophobicContact CG-CE 4.23Å; R395-M398 HydrophobicContact CG-SD 4.42Å; R395-M398 WeakPolarHBondContact O-CB 3.48Å; R395-M398 PolarHBondContact O-N 3.24Å; R395-M398 VanDerWaalsContact O-N 3.14Å; M398-V402 HydrophobicContact CB-CB 4.23Å; M398-V402 HydrophobicContact CB-CG1 4.18Å; M398-V402 HydrophobicContact CG-CG1 4.01Å; M398-V402 HydrophobicContact SD-CG1 3.99Å; M398-L403 HydrophobicContact CB-CD1 4.33Å; M398-L403 HydrophobicContact CB-CD2 3.77Å; M398-L403 HydrophobicContact CB-CG 3.7Å; M398-L403 HydrophobicContact CG-CD2 4.46Å; M398-L403 WeakPolarHBondContact O-CD1 3.36Å; M398-L403 HydrophobicContact SD-CD2 3.94Å; M398-Y421 WeakPolarHBondContact O-CE1 3.44Å; M398-Y457 HydrophobicContact SD-CE2 4.26Å
399	A	98.3	Very high	92.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.			trans	-67	156.1	173.6	0	0	0	0	0	111.4	Y397 E401 V402 L403 A418 Y421	Y397-A399 PolarHBondContact O-N 2.94Å; A399-E401 VanDerWaalsContact C-N 3.28Å; A399-E401 WeakPolarHBondContact CB-OE1 3.44Å; A399-E401 VanDerWaalsContact CB-OE2 3.31Å; A399-E401 WeakPolarHBondContact CB-OE2 3.39Å; A399-E401 PolarHBondContact O-N 2.89Å; A399-V402 HydrophobicContact CB-CG2 4.22Å; A399-V402 WeakPolarHBondContact O-CA 3.01Å; A399-V402 WeakPolarHBondContact O-CB 2.98Å; A399-V402 PolarHBondContact O-N 3.19Å; A399-L403 PolarHBondContact O-N 3.28Å; A399-A418 HydrophobicContact CB-CB 4.02Å; A399-Y421 VanDerWaalsContact CA-CD1 3.44Å; A399-Y421 HydrophobicContact CB-CD1 3.82Å; A399-Y421 HydrophobicContact CB-CD2 4.41Å; A399-Y421 HydrophobicContact CB-CG 3.75Å
400	P	98.3	Very high	93	Very high	2 Å²	2	43 Å²	43	1%	0.013	22%	0.221	C	C	.	.	H	α-helix	trans	-50	-45.7	-179.5	-24.4	29	0	0	0	113.6	V402 L403 D404 Y421 V464 C465	P400-V402 PolarHBondContact O-N 2.82Å; P400-L403 CarbonylContact O-C 3.58Å; P400-L403 WeakPolarHBondContact O-CA 3.43Å; P400-L403 WeakPolarHBondContact O-CB 3.25Å; P400-L403 PolarHBondContact O-N 3.4Å; P400-D404 VanDerWaalsContact O-CG 3.28Å; P400-D404 PolarHBondContact O-N 2.88Å; P400-Y421 HydrophobicContact CG-CE2 4.23Å; P400-V464 HydrophobicContact CB-CG1 4.31Å; P400-V464 HydrophobicContact CG-CG1 3.78Å; P400-C465 VanDerWaalsContact CA-SG 3.57Å; P400-C465 PolarHBondContact O-SG 2.9Å
401	E	97.5	Very high	93.5	Very high	11 Å²	11	47.5 Å²	47.5	5%	0.051	24%	0.241	C	C	.	.	H	α-helix	trans	-67.9	-20.5	-179.4	70.4	-81.4	-164.9	0	0	113.8	A399 D404 D405 S406 L407 P498 R501	A399-E401 VanDerWaalsContact C-N 3.28Å; A399-E401 WeakPolarHBondContact CB-OE1 3.44Å; A399-E401 VanDerWaalsContact CB-OE2 3.31Å; A399-E401 WeakPolarHBondContact CB-OE2 3.39Å; A399-E401 PolarHBondContact O-N 2.89Å; E401-D404 VanDerWaalsContact CA-OD1 3.23Å; E401-D404 WeakPolarHBondContact CA-OD1 3.42Å; E401-D405 PolarHBondContact O-N 3.23Å; E401-S406 WeakPolarHBondContact CA-OG 3.43Å; E401-S406 WeakPolarHBondContact CB-OG 3.36Å; E401-S406 PolarHBondContact O-N 2.62Å; E401-S406 VanDerWaalsContact O-N 3.11Å; E401-L407 HydrophobicContact CB-CB 4.37Å; E401-L407 HydrophobicContact CG-CB 4.08Å; E401-L407 HydrophobicContact CG-CD1 4.17Å; E401-L407 HydrophobicContact CG-CG 4.34Å; E401-L407 WeakPolarHBondContact O-CB 3.41Å; E401-L407 PolarHBondContact O-N 2.59Å; E401-P498 HydrophobicContact CB-CG 4.34Å; E401-P498 HydrophobicContact CG-CG 4.04Å; E401-R501 IonicContact OE1-CZ 3.72Å; E401-R501 IonicContact OE1-NH1 3.56Å; E401-R501 PolarHBondContact OE1-NH1 3.48Å; E401-R501 IonicContact OE1-NH2 3.73Å; E401-R501 IonicContact OE2-CZ 3.83Å; E401-R501 IonicContact OE2-NH1 3.35Å; E401-R501 PolarHBondContact OE2-NH1 3.03Å; E401-R501 IonicContact OE2-NH2 2.77Å; E401-R501 PolarHBondContact OE2-NH2 2.71Å
402	V	96.7	Very high	93.9	Very high	12 Å²	12	42.6 Å²	42.6	7%	0.073	22%	0.223	C	C	.	.	H	α-helix	trans	-82.2	-36.9	172.1	-177.2	0	0	0	0	109.9	M398 A399 P400 L407 A418 Y457	M398-V402 HydrophobicContact CB-CB 4.23Å; M398-V402 HydrophobicContact CB-CG1 4.18Å; M398-V402 HydrophobicContact CG-CG1 4.01Å; M398-V402 HydrophobicContact SD-CG1 3.99Å; A399-V402 HydrophobicContact CB-CG2 4.22Å; A399-V402 WeakPolarHBondContact O-CA 3.01Å; A399-V402 WeakPolarHBondContact O-CB 2.98Å; A399-V402 PolarHBondContact O-N 3.19Å; P400-V402 PolarHBondContact O-N 2.82Å; V402-L407 HydrophobicContact CG2-CD1 3.68Å; V402-A418 HydrophobicContact CG2-CB 4.03Å; V402-Y457 PolarHBondContact O-OH 3.38Å
403	L	97	Very high	94.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-76.1	-26.5	179.9	-72.2	170.7	0	0	0	113.7	M398 A399 P400 Y457 M460 L461 V464	M398-L403 HydrophobicContact CB-CD1 4.33Å; M398-L403 HydrophobicContact CB-CD2 3.77Å; M398-L403 HydrophobicContact CB-CG 3.7Å; M398-L403 HydrophobicContact CG-CD2 4.46Å; M398-L403 WeakPolarHBondContact O-CD1 3.36Å; M398-L403 HydrophobicContact SD-CD2 3.94Å; A399-L403 PolarHBondContact O-N 3.28Å; P400-L403 CarbonylContact O-C 3.58Å; P400-L403 WeakPolarHBondContact O-CA 3.43Å; P400-L403 WeakPolarHBondContact O-CB 3.25Å; P400-L403 PolarHBondContact O-N 3.4Å; L403-Y457 VanDerWaalsContact CA-OH 3.22Å; L403-Y457 WeakPolarHBondContact CA-OH 3.32Å; L403-Y457 HydrophobicContact CD2-CD2 4.23Å; L403-Y457 HydrophobicContact CD2-CE2 4.05Å; L403-Y457 WeakPolarHBondContact O-CE1 3.1Å; L403-Y457 PolarHBondContact O-OH 2.75Å; L403-M460 HydrophobicContact CD1-CB 3.98Å; L403-M460 HydrophobicContact CD2-CB 3.72Å; L403-L461 HydrophobicContact CB-CD1 4.4Å; L403-L461 VanDerWaalsContact O-CD1 3.3Å; L403-L461 WeakPolarHBondContact O-CD1 3.03Å; L403-V464 HydrophobicContact CD1-CB 3.83Å; L403-V464 HydrophobicContact CD1-CG1 3.98Å; L403-V464 HydrophobicContact CD1-CG2 4.22Å
404	D	94.7	Very high	94.4	Very high	66 Å²	66	45.2 Å²	45.2	35%	0.353	23%	0.23	S	C	.	.	S	Bend	trans	-100	-1.8	173	64.8	14.4	0	0	0	113	P400 E401 S406 L461	P400-D404 VanDerWaalsContact O-CG 3.28Å; P400-D404 PolarHBondContact O-N 2.88Å; E401-D404 VanDerWaalsContact CA-OD1 3.23Å; E401-D404 WeakPolarHBondContact CA-OD1 3.42Å; D404-S406 VanDerWaalsContact CG-OG 3.29Å; D404-S406 PolarHBondContact O-N 3.18Å; D404-S406 WeakPolarHBondContact OD1-CB 3.33Å; D404-S406 PolarHBondContact OD1-N 3.41Å; D404-S406 PolarHBondContact OD1-OG 3.23Å; D404-S406 PolarHBondContact OD2-OG 2.91Å; D404-L461 HydrophobicContact CB-CD1 4.1Å
405	D	93	Very high	94.5	Very high	63 Å²	63	43.3 Å²	43.3	34%	0.337	22%	0.217	S	C	.	.	S	Bend	trans	60.6	24.2	-174.6	-155	39.1	0	0	0	114.7	T390 R391 E401 L407 K409	T390-D405 PolarHBondContact OG1-OD1 2.98Å; R391-D405 IonicContact NE-OD1 2.84Å; R391-D405 VanDerWaalsContact NH2-CB 3.29Å; E401-D405 PolarHBondContact O-N 3.23Å; D405-L407 VanDerWaalsContact C-N 3.28Å; D405-K409 IonicContact OD1-NZ 3.77Å
406	S	94.6	Very high	94.5	Very high	77 Å²	77	38 Å²	38	54%	0.538	20%	0.198	S	C	.	.			trans	-81.1	-4.1	171.9	68.1	0	0	0	0	113.8	E401 D404 N408	E401-S406 WeakPolarHBondContact CA-OG 3.43Å; E401-S406 WeakPolarHBondContact CB-OG 3.36Å; E401-S406 PolarHBondContact O-N 2.62Å; E401-S406 VanDerWaalsContact O-N 3.11Å; D404-S406 VanDerWaalsContact CG-OG 3.29Å; D404-S406 PolarHBondContact O-N 3.18Å; D404-S406 WeakPolarHBondContact OD1-CB 3.33Å; D404-S406 PolarHBondContact OD1-N 3.41Å; D404-S406 PolarHBondContact OD1-OG 3.23Å; D404-S406 PolarHBondContact OD2-OG 2.91Å; S406-N408 PolarHBondContact O-N 3.3Å
407	L	93.5	Very high	94.5	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.047	21%	0.206	C	C	.	.			trans	-57.3	122.5	177.9	-172.3	149.6	0	0	0	111.5	T390 E401 V402 D405 K409 A414 Y415 A418	T390-L407 HydrophobicContact CG2-CD2 3.9Å; E401-L407 HydrophobicContact CB-CB 4.37Å; E401-L407 HydrophobicContact CG-CB 4.08Å; E401-L407 HydrophobicContact CG-CD1 4.17Å; E401-L407 HydrophobicContact CG-CG 4.34Å; E401-L407 WeakPolarHBondContact O-CB 3.41Å; E401-L407 PolarHBondContact O-N 2.59Å; V402-L407 HydrophobicContact CG2-CD1 3.68Å; D405-L407 VanDerWaalsContact C-N 3.28Å; L407-K409 PolarHBondContact O-N 3.21Å; L407-A414 HydrophobicContact CD1-CB 4.46Å; L407-A414 HydrophobicContact CD2-CB 4.08Å; L407-A414 HydrophobicContact CG-CB 3.93Å; L407-Y415 HydrophobicContact CD1-CD1 4.35Å; L407-Y415 HydrophobicContact CD2-CD1 4.2Å; L407-Y415 HydrophobicContact CD2-CE1 3.77Å; L407-Y415 HydrophobicContact CD2-CE2 4.4Å; L407-A418 HydrophobicContact CD1-CB 4.37Å
408	N	90.4	Very high	94.5	Very high	91 Å²	91	39.5 Å²	39.5	49%	0.487	21%	0.208	S	C	.	.			trans	-73.5	99.8	175.7	-174.3	-11.6	0	0	0	111.2	S406 N410 H411	S406-N408 PolarHBondContact O-N 3.3Å; N408-N410 PolarHBondContact O-N 2.86Å; N408-N410 PolarHBondContact OD1-N 3.21Å; N408-H411 HydrophobicContact CB-CB 4.32Å; N408-H411 PolarHBondContact O-N 3.43Å; N408-H411 VanDerWaalsContact O-N 3.1Å
409	K	87.7	Confident	94.5	Very high	71 Å²	71	39 Å²	39	31%	0.309	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.1	-174.6	-46	-169.4	-174.1	-169.3	0	113.5	I386 T390 D405 L407 H411 Y415	I386-K409 HydrophobicContact CD1-CB 4.49Å; I386-K409 WeakPolarHBondContact CD1-O 3.3Å; T390-K409 HydrophobicContact CG2-CB 4.45Å; T390-K409 HydrophobicContact CG2-CD 3.46Å; T390-K409 VanDerWaalsContact CG2-CD 3.46Å; T390-K409 HydrophobicContact CG2-CG 3.45Å; T390-K409 VanDerWaalsContact CG2-CG 3.45Å; T390-K409 WeakPolarHBondContact OG1-CE 3.45Å; T390-K409 PolarHBondContact OG1-NZ 2.93Å; D405-K409 IonicContact OD1-NZ 3.77Å; L407-K409 PolarHBondContact O-N 3.21Å; K409-H411 VanDerWaalsContact C-N 3.26Å; K409-H411 PolarHBondContact O-N 2.93Å; K409-Y415 WeakPolarHBondContact CA-OH 3.45Å; K409-Y415 PolarHBondContact O-OH 3.49Å
410	N	84.1	Confident	94.6	Very high	134 Å²	134	39 Å²	39	72%	0.717	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-8.3	-178.1	-59.1	-21.2	0	0	0	112.1	N408	N408-N410 PolarHBondContact O-N 2.86Å; N408-N410 PolarHBondContact OD1-N 3.21Å
411	H	88.9	Confident	94.6	Very high	100 Å²	100	39 Å²	39	46%	0.463	21%	0.206	S	C	.	.			trans	-115	107.7	-177.8	-163.8	64.8	0	0	0	111	N408 K409 Q413 A414	N408-H411 HydrophobicContact CB-CB 4.32Å; N408-H411 PolarHBondContact O-N 3.43Å; N408-H411 VanDerWaalsContact O-N 3.1Å; K409-H411 VanDerWaalsContact C-N 3.26Å; K409-H411 PolarHBondContact O-N 2.93Å; H411-Q413 WeakPolarHBondContact NE2-CB 3.36Å; H411-Q413 PolarHBondContact O-N 3.15Å; H411-Q413 VanDerWaalsContact O-N 3.15Å; H411-A414 WeakPolarHBondContact O-CB 3.27Å; H411-A414 PolarHBondContact O-N 3.02Å
412	F	92.6	Very high	94.7	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.035	21%	0.206	C	C	.	.	H	α-helix	trans	-56.3	-36.1	-175.9	-176.1	-107.5	0	0	0	113.8	A347 A349 V375 F377 V384 A414 Y415 I416	A347-F412 VanDerWaalsContact C-CZ 3.47Å; A347-F412 HydrophobicContact CB-CD1 4.3Å; A347-F412 HydrophobicContact CB-CE1 3.44Å; A347-F412 VanDerWaalsContact CB-CE1 3.44Å; A347-F412 HydrophobicContact CB-CZ 3.97Å; A347-F412 VanDerWaalsContact O-CZ 3.26Å; A347-F412 WeakPolarHBondContact O-CZ 3.3Å; A349-F412 HydrophobicContact CB-CE2 4.1Å; A349-F412 HydrophobicContact CB-CZ 4.03Å; V375-F412 HydrophobicContact CG2-CE2 4.09Å; F377-F412 HydrophobicContact CB-CB 4.3Å; F377-F412 HydrophobicContact CB-CD1 3.71Å; F377-F412 HydrophobicContact CB-CD2 3.72Å; F377-F412 HydrophobicContact CB-CE1 3.86Å; F377-F412 HydrophobicContact CB-CE2 3.86Å; F377-F412 HydrophobicContact CB-CG 3.63Å; F377-F412 HydrophobicContact CB-CZ 3.94Å; F377-F412 HydrophobicContact CD2-CB 3.59Å; F377-F412 HydrophobicContact CD2-CD1 4.43Å; F377-F412 HydrophobicContact CD2-CD2 4.39Å; F377-F412 AromaticContact CD2-CG 3.91Å; F377-F412 HydrophobicContact CD2-CG 3.91Å; F377-F412 HydrophobicContact CE2-CB 4.19Å; F377-F412 HydrophobicContact CG-CB 4.09Å; F377-F412 HydrophobicContact CG-CD1 4.06Å; F377-F412 HydrophobicContact CG-CD2 4.42Å; F377-F412 AromaticContact CG-CG 3.93Å; F377-F412 HydrophobicContact CG-CG 3.93Å; V384-F412 HydrophobicContact CG1-CD2 4.16Å; V384-F412 HydrophobicContact CG2-CB 3.67Å; V384-F412 HydrophobicContact CG2-CD2 3.79Å; V384-F412 HydrophobicContact CG2-CG 4.21Å; F412-A414 PolarHBondContact O-N 3.06Å; F412-A414 VanDerWaalsContact O-N 3.12Å; F412-Y415 HydrophobicContact CD2-CD2 4.37Å; F412-Y415 PolarHBondContact O-N 3.45Å; F412-I416 HydrophobicContact CD1-CD1 3.91Å; F412-I416 HydrophobicContact CD1-CG1 4.35Å; F412-I416 HydrophobicContact CE1-CD1 3.45Å; F412-I416 VanDerWaalsContact CE1-CD1 3.45Å; F412-I416 HydrophobicContact CE1-CG1 3.85Å; F412-I416 HydrophobicContact CZ-CD1 4.37Å; F412-I416 HydrophobicContact CZ-CG1 4.39Å; F412-I416 PolarHBondContact O-N 3.34Å
413	Q	94.6	Very high	94.8	Very high	92 Å²	92	38.3 Å²	38.3	43%	0.43	20%	0.203	S	C	.	.	H	α-helix	trans	-61	-24.3	178.6	-61.1	-64.3	-35.6	0	0	112.7	H411 Y415 I416 M417	H411-Q413 WeakPolarHBondContact NE2-CB 3.36Å; H411-Q413 PolarHBondContact O-N 3.15Å; H411-Q413 VanDerWaalsContact O-N 3.15Å; Q413-Y415 VanDerWaalsContact C-N 3.27Å; Q413-Y415 PolarHBondContact O-N 3.16Å; Q413-I416 PolarHBondContact O-N 3.27Å; Q413-M417 HydrophobicContact CB-CE 4.42Å; Q413-M417 WeakPolarHBondContact O-CB 3.28Å; Q413-M417 WeakPolarHBondContact O-CE 3.24Å; Q413-M417 VanDerWaalsContact O-CG 3.29Å; Q413-M417 WeakPolarHBondContact O-CG 3.38Å; Q413-M417 PolarHBondContact O-N 3.01Å
414	A	95.1	Very high	94.8	Very high	9 Å²	9	38.3 Å²	38.3	7%	0.074	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-38.5	175.6	0	0	0	0	0	111.5	L407 H411 F412 M417 A418	L407-A414 HydrophobicContact CD1-CB 4.46Å; L407-A414 HydrophobicContact CD2-CB 4.08Å; L407-A414 HydrophobicContact CG-CB 3.93Å; H411-A414 WeakPolarHBondContact O-CB 3.27Å; H411-A414 PolarHBondContact O-N 3.02Å; F412-A414 PolarHBondContact O-N 3.06Å; F412-A414 VanDerWaalsContact O-N 3.12Å; A414-M417 PolarHBondContact O-N 3.31Å; A414-A418 PolarHBondContact O-N 3.06Å
415	Y	95.9	Very high	95	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-69.9	-40.4	175.5	-58	-79.4	0	0	0	112.2	A349 R351 V375 V384 L407 K409 F412 Q413 M417 A418 D419	A349-Y415 VanDerWaalsContact CB-CB 3.46Å; R351-Y415 HydrophobicContact CG-CD1 4.16Å; V375-Y415 HydrophobicContact CG2-CD1 4.37Å; V375-Y415 HydrophobicContact CG2-CD2 4.32Å; V375-Y415 HydrophobicContact CG2-CG 4.1Å; V384-Y415 HydrophobicContact CG1-CD2 4.49Å; V384-Y415 HydrophobicContact CG1-CE2 4.02Å; V384-Y415 HydrophobicContact CG2-CE2 4.47Å; L407-Y415 HydrophobicContact CD1-CD1 4.35Å; L407-Y415 HydrophobicContact CD2-CD1 4.2Å; L407-Y415 HydrophobicContact CD2-CE1 3.77Å; L407-Y415 HydrophobicContact CD2-CE2 4.4Å; K409-Y415 WeakPolarHBondContact CA-OH 3.45Å; K409-Y415 PolarHBondContact O-OH 3.49Å; F412-Y415 HydrophobicContact CD2-CD2 4.37Å; F412-Y415 PolarHBondContact O-N 3.45Å; Q413-Y415 VanDerWaalsContact C-N 3.27Å; Q413-Y415 PolarHBondContact O-N 3.16Å; Y415-M417 VanDerWaalsContact C-N 3.34Å; Y415-M417 PolarHBondContact O-N 3.1Å; Y415-A418 PolarHBondContact O-N 3.4Å; Y415-D419 PolarHBondContact O-N 3.32Å
416	I	97.3	Very high	95.3	Very high	15 Å²	15	32.2 Å²	32.2	8%	0.077	17%	0.17	C	C	.	.	H	α-helix	trans	-59.7	-45.6	174	-76	-179.3	0	0	0	110.7	H336 A349 F412 Q413 A418 D419 M420	H336-I416 HydrophobicContact CB-CD1 3.99Å; H336-I416 HydrophobicContact CB-CG1 4.36Å; A349-I416 HydrophobicContact CB-CG1 4.35Å; F412-I416 HydrophobicContact CD1-CD1 3.91Å; F412-I416 HydrophobicContact CD1-CG1 4.35Å; F412-I416 HydrophobicContact CE1-CD1 3.45Å; F412-I416 VanDerWaalsContact CE1-CD1 3.45Å; F412-I416 HydrophobicContact CE1-CG1 3.85Å; F412-I416 HydrophobicContact CZ-CD1 4.37Å; F412-I416 HydrophobicContact CZ-CG1 4.39Å; F412-I416 PolarHBondContact O-N 3.34Å; Q413-I416 PolarHBondContact O-N 3.27Å; I416-A418 VanDerWaalsContact C-N 3.3Å; I416-A418 PolarHBondContact O-N 2.04Å; I416-D419 WeakPolarHBondContact O-CB 3.3Å; I416-D419 PolarHBondContact O-N 3.36Å; I416-M420 WeakPolarHBondContact O-CG 3.3Å; I416-M420 PolarHBondContact O-N 3.45Å; I416-M420 VanDerWaalsContact O-N 3.1Å
417	M	98.4	Very high	95.5	Very high	44 Å²	44	28.5 Å²	28.5	22%	0.217	14%	0.144	C	C	.	.	H	α-helix	trans	-66.3	-32.7	179.3	-68.5	-177.1	-64.6	0	0	111.9	Q413 A414 Y415 M420 Y421 P498 R501	Q413-M417 HydrophobicContact CB-CE 4.42Å; Q413-M417 WeakPolarHBondContact O-CB 3.28Å; Q413-M417 WeakPolarHBondContact O-CE 3.24Å; Q413-M417 VanDerWaalsContact O-CG 3.29Å; Q413-M417 WeakPolarHBondContact O-CG 3.38Å; Q413-M417 PolarHBondContact O-N 3.01Å; A414-M417 PolarHBondContact O-N 3.31Å; Y415-M417 VanDerWaalsContact C-N 3.34Å; Y415-M417 PolarHBondContact O-N 3.1Å; M417-M420 WeakPolarHBondContact O-CB 3.5Å; M417-M420 PolarHBondContact O-N 2.96Å; M417-Y421 PolarHBondContact O-N 2.91Å; M417-P498 HydrophobicContact CB-CB 3.87Å; M417-P498 HydrophobicContact CE-CB 3.77Å; M417-P498 HydrophobicContact CG-CB 4.41Å; M417-P498 HydrophobicContact SD-CB 3.75Å; M417-R501 VanDerWaalsContact C-NH1 3.33Å; M417-R501 VanDerWaalsContact O-CD 3.32Å; M417-R501 WeakPolarHBondContact O-CD 3.28Å; M417-R501 PolarHBondContact O-NH1 3.09Å
418	A	98.3	Very high	95.8	Very high	10 Å²	10	28.1 Å²	28.1	8%	0.083	14%	0.142	C	C	.	.	H	α-helix	trans	-67.1	-38.3	172.7	0	0	0	0	0	112.5	A399 V402 L407 A414 Y415 I416 M420 Y421 S422	A399-A418 HydrophobicContact CB-CB 4.02Å; V402-A418 HydrophobicContact CG2-CB 4.03Å; L407-A418 HydrophobicContact CD1-CB 4.37Å; A414-A418 PolarHBondContact O-N 3.06Å; Y415-A418 PolarHBondContact O-N 3.4Å; I416-A418 VanDerWaalsContact C-N 3.3Å; I416-A418 PolarHBondContact O-N 2.04Å; A418-M420 VanDerWaalsContact C-N 3.27Å; A418-M420 PolarHBondContact O-N 3.24Å; A418-Y421 PolarHBondContact O-N 3.27Å; A418-S422 PolarHBondContact O-N 3.03Å; A418-S422 PolarHBondContact O-OG 2.03Å; A418-S422 VanDerWaalsContact O-OG 3.09Å
419	D	98.7	Very high	96.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.1	-37.7	171.4	-75.6	-18.8	0	0	0	111.5	L332 H336 A349 H350 R351 Y415 I416 Y421 S422 Y423	L332-D419 HydrophobicContact CD1-CB 4.3Å; L332-D419 HydrophobicContact CD2-CB 4.49Å; H336-D419 IonicContact CD2-OD2 3.44Å; H336-D419 IonicContact CE1-OD2 3.67Å; H336-D419 IonicContact NE2-OD2 2.65Å; H336-D419 PolarHBondContact NE2-OD2 3.18Å; A349-D419 WeakPolarHBondContact CA-OD2 3.24Å; H350-D419 PolarHBondContact N-OD2 3.07Å; R351-D419 PolarHBondContact N-OD1 3.03Å; Y415-D419 PolarHBondContact O-N 3.32Å; I416-D419 WeakPolarHBondContact O-CB 3.3Å; I416-D419 PolarHBondContact O-N 3.36Å; D419-Y421 PolarHBondContact O-N 3.13Å; D419-S422 WeakPolarHBondContact O-CB 2.91Å; D419-S422 PolarHBondContact O-N 3.2Å; D419-Y423 WeakPolarHBondContact O-CB 3.2Å; D419-Y423 PolarHBondContact O-N 3.12Å
420	M	98.8	Very high	96.7	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-63.3	-39.7	178.4	-67.2	-50.8	-53.7	0	0	112.8	L332 I416 M417 A418 S422 Y423 G424 C493 R501 L502 I504 V507	L332-M420 HydrophobicContact CD2-SD 4.3Å; I416-M420 WeakPolarHBondContact O-CG 3.3Å; I416-M420 PolarHBondContact O-N 3.45Å; I416-M420 VanDerWaalsContact O-N 3.1Å; M417-M420 WeakPolarHBondContact O-CB 3.5Å; M417-M420 PolarHBondContact O-N 2.96Å; A418-M420 VanDerWaalsContact C-N 3.27Å; A418-M420 PolarHBondContact O-N 3.24Å; M420-S422 VanDerWaalsContact C-N 3.34Å; M420-Y423 HydrophobicContact CE-CD1 4.37Å; M420-Y423 PolarHBondContact O-N 3.27Å; M420-G424 PolarHBondContact O-N 2.88Å; M420-C493 CarbonylContact C-O 3.53Å; M420-C493 WeakPolarHBondContact O-CB 3.31Å; M420-R501 HydrophobicContact CB-CB 4.37Å; M420-L502 WeakPolarHBondContact CE-O 3.29Å; M420-L502 WeakPolarHBondContact CG-O 3.48Å; M420-I504 HydrophobicContact CE-CB 4.26Å; M420-I504 HydrophobicContact CE-CD1 3.94Å; M420-I504 HydrophobicContact SD-CB 3.57Å; M420-I504 VanDerWaalsContact SD-CB 3.57Å; M420-I504 HydrophobicContact SD-CD1 3.95Å; M420-I504 HydrophobicContact SD-CG1 4.26Å; M420-V507 HydrophobicContact CE-CB 4.46Å; M420-V507 HydrophobicContact CE-CG2 3.73Å
421	Y	98.9	Very high	97.4	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-59.1	-48.7	172.5	173.3	-86.2	0	0	0	111.1	Y397 M398 A399 P400 M417 A418 D419 Y423 G424 L425 Y447 V464 C493 W494	Y397-Y421 WeakPolarHBondContact O-CD1 3.03Å; M398-Y421 WeakPolarHBondContact O-CE1 3.44Å; A399-Y421 VanDerWaalsContact CA-CD1 3.44Å; A399-Y421 HydrophobicContact CB-CD1 3.82Å; A399-Y421 HydrophobicContact CB-CD2 4.41Å; A399-Y421 HydrophobicContact CB-CG 3.75Å; P400-Y421 HydrophobicContact CG-CE2 4.23Å; M417-Y421 PolarHBondContact O-N 2.91Å; A418-Y421 PolarHBondContact O-N 3.27Å; D419-Y421 PolarHBondContact O-N 3.13Å; Y421-Y423 VanDerWaalsContact C-N 3.32Å; Y421-Y423 PolarHBondContact O-N 3.31Å; Y421-G424 PolarHBondContact O-N 3.04Å; Y421-G424 VanDerWaalsContact O-N 3.15Å; Y421-L425 HydrophobicContact CD1-CD1 4.1Å; Y421-L425 HydrophobicContact CE1-CD1 3.51Å; Y421-L425 HydrophobicContact CE1-CG 4.19Å; Y421-L425 PolarHBondContact O-N 3Å; Y421-Y447 PolarHBondContact OH-OH 2.75Å; Y421-V464 WeakPolarHBondContact OH-CG1 3.38Å; Y421-C493 WeakPolarHBondContact CA-O 3Å; Y421-C493 PolarHBondContact N-O 3.49Å; Y421-W494 HydrophobicContact CD2-CB 3.77Å; Y421-W494 HydrophobicContact CE2-CB 3.98Å
422	S	98.8	Very high	97.8	Very high	9 Å²	9	10.3 Å²	10.3	6%	0.063	5%	0.052	C	C	.	.	H	α-helix	trans	-61.3	-40.7	179.7	-53.3	0	0	0	0	111.7	L353 Y397 A418 D419 M420 G424 L425 V426	L353-S422 WeakPolarHBondContact O-CB 3.3Å; Y397-S422 PolarHBondContact O-OG 3.21Å; A418-S422 PolarHBondContact O-N 3.03Å; A418-S422 PolarHBondContact O-OG 2.03Å; A418-S422 VanDerWaalsContact O-OG 3.09Å; D419-S422 WeakPolarHBondContact O-CB 2.91Å; D419-S422 PolarHBondContact O-N 3.2Å; M420-S422 VanDerWaalsContact C-N 3.34Å; S422-G424 PolarHBondContact O-N 2.99Å; S422-L425 WeakPolarHBondContact O-CB 3.23Å; S422-L425 PolarHBondContact O-N 2.6Å; S422-V426 PolarHBondContact O-N 3.36Å; S422-V426 VanDerWaalsContact O-N 3.15Å
423	Y	98.9	Very high	98.1	Very high	1 Å²	1	10.9 Å²	10.9	0%	0.004	5%	0.054	C	C	.	.	H	α-helix	trans	-61.4	-41.4	175.3	179.3	-93.8	0	0	0	111.9	A325 A328 A329 L332 L353 D419 M420 Y421 L425 V426 V427 L489 V507 L511	A325-Y423 PolarHBondContact O-OH 2.82Å; A328-Y423 HydrophobicContact CB-CE2 4.12Å; A329-Y423 HydrophobicContact CB-CE2 4.27Å; L332-Y423 HydrophobicContact CD2-CD2 4.1Å; L332-Y423 HydrophobicContact CD2-CG 4.23Å; L353-Y423 HydrophobicContact CD2-CD2 4.3Å; D419-Y423 WeakPolarHBondContact O-CB 3.2Å; D419-Y423 PolarHBondContact O-N 3.12Å; M420-Y423 HydrophobicContact CE-CD1 4.37Å; M420-Y423 PolarHBondContact O-N 3.27Å; Y421-Y423 VanDerWaalsContact C-N 3.32Å; Y421-Y423 PolarHBondContact O-N 3.31Å; Y423-L425 VanDerWaalsContact C-N 3.28Å; Y423-L425 PolarHBondContact O-N 3.16Å; Y423-V426 PolarHBondContact O-N 2.8Å; Y423-V426 VanDerWaalsContact O-N 3.14Å; Y423-V427 HydrophobicContact CD1-CG2 3.93Å; Y423-V427 HydrophobicContact CE1-CG2 3.35Å; Y423-V427 HydrophobicContact CE2-CG2 4.33Å; Y423-V427 WeakPolarHBondContact O-CG2 3.46Å; Y423-V427 PolarHBondContact O-N 3.34Å; Y423-L489 HydrophobicContact CE1-CD2 4.37Å; Y423-V507 HydrophobicContact CD1-CG1 4.4Å; Y423-V507 HydrophobicContact CE1-CG1 3.56Å; Y423-L511 WeakPolarHBondContact OH-CD1 3.01Å
424	G	98.8	Very high	98.2	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-57.4	-40.2	174.7	0	0	0	0	0	112.9	M420 Y421 S422 V427 W428	M420-G424 PolarHBondContact O-N 2.88Å; Y421-G424 PolarHBondContact O-N 3.04Å; Y421-G424 VanDerWaalsContact O-N 3.15Å; S422-G424 PolarHBondContact O-N 2.99Å; G424-V427 PolarHBondContact O-N 3.04Å; G424-W428 PolarHBondContact O-N 2.92Å; G424-W428 VanDerWaalsContact O-N 3.12Å
425	L	98.9	Very high	98.3	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-66.3	-39.6	175.4	-60.1	176.5	0	0	0	112.5	Y397 Y421 S422 Y423 W428 E429 P446 Y447 P471 W494	Y397-L425 HydrophobicContact CD1-CB 4.04Å; Y397-L425 HydrophobicContact CD1-CD1 4.02Å; Y397-L425 HydrophobicContact CE1-CB 4.21Å; Y397-L425 HydrophobicContact CG-CD1 4.46Å; Y421-L425 HydrophobicContact CD1-CD1 4.1Å; Y421-L425 HydrophobicContact CE1-CD1 3.51Å; Y421-L425 HydrophobicContact CE1-CG 4.19Å; Y421-L425 PolarHBondContact O-N 3Å; S422-L425 WeakPolarHBondContact O-CB 3.23Å; S422-L425 PolarHBondContact O-N 2.6Å; Y423-L425 VanDerWaalsContact C-N 3.28Å; Y423-L425 PolarHBondContact O-N 3.16Å; L425-W428 WeakPolarHBondContact O-CB 3.01Å; L425-W428 PolarHBondContact O-N 2.85Å; L425-E429 PolarHBondContact O-N 2.84Å; L425-P446 HydrophobicContact CB-CB 4.19Å; L425-P446 HydrophobicContact CB-CG 3.87Å; L425-P446 HydrophobicContact CD1-CB 4.49Å; L425-P446 HydrophobicContact CD2-CB 4.09Å; L425-Y447 HydrophobicContact CD1-CE2 3.97Å; L425-Y447 HydrophobicContact CD2-CE2 3.76Å; L425-P471 HydrophobicContact CD2-CG 3.62Å; L425-W494 HydrophobicContact CD2-CE3 3.69Å; L425-W494 HydrophobicContact CD2-CZ3 4.08Å; L425-W494 HydrophobicContact CG-CE3 4.48Å
426	V	98.9	Very high	98.1	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-64.1	-41.1	175.3	171.7	0	0	0	0	111.2	L307 I358 Y397 S422 Y423 W428 E429 M430	L307-V426 HydrophobicContact CD2-CG1 3.67Å; I358-V426 HydrophobicContact CD1-CG1 3.81Å; I358-V426 HydrophobicContact CD1-CG2 4.36Å; Y397-V426 HydrophobicContact CE1-CG2 4.21Å; S422-V426 PolarHBondContact O-N 3.36Å; S422-V426 VanDerWaalsContact O-N 3.15Å; Y423-V426 PolarHBondContact O-N 2.8Å; Y423-V426 VanDerWaalsContact O-N 3.14Å; V426-W428 VanDerWaalsContact C-N 3.28Å; V426-W428 PolarHBondContact O-N 2.78Å; V426-E429 WeakPolarHBondContact O-CB 3.38Å; V426-E429 PolarHBondContact O-N 2.74Å; V426-E429 VanDerWaalsContact O-N 3.15Å; V426-M430 HydrophobicContact CG1-CE 3.93Å; V426-M430 PolarHBondContact O-N 3.5Å; V426-M430 VanDerWaalsContact O-N 3.11Å
427	V	98.8	Very high	97.6	Very high	0 Å²	0	13 Å²	13	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.3	-40.5	175.7	170.8	0	0	0	0	111	Y423 G424 E429 M430 S431 M486 M490	Y423-V427 HydrophobicContact CD1-CG2 3.93Å; Y423-V427 HydrophobicContact CE1-CG2 3.35Å; Y423-V427 HydrophobicContact CE2-CG2 4.33Å; Y423-V427 WeakPolarHBondContact O-CG2 3.46Å; Y423-V427 PolarHBondContact O-N 3.34Å; G424-V427 PolarHBondContact O-N 3.04Å; V427-E429 VanDerWaalsContact C-N 3.34Å; V427-E429 PolarHBondContact O-N 2.68Å; V427-M430 PolarHBondContact O-N 3.46Å; V427-S431 WeakPolarHBondContact O-CB 3.31Å; V427-S431 PolarHBondContact O-N 3.09Å; V427-S431 PolarHBondContact O-OG 2.81Å; V427-M486 HydrophobicContact CG1-CE 3.41Å; V427-M486 VanDerWaalsContact CG1-CE 3.41Å; V427-M490 HydrophobicContact CB-CB 4.26Å; V427-M490 HydrophobicContact CG1-CB 4.02Å
428	W	98.8	Very high	97.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-59.9	-42	174.1	177	93.2	0	0	0	112.5	G424 L425 V426 M430 S431 R432 Q444 P446 F448 P471 S472 W477 M490 W494	G424-W428 PolarHBondContact O-N 2.92Å; G424-W428 VanDerWaalsContact O-N 3.12Å; L425-W428 WeakPolarHBondContact O-CB 3.01Å; L425-W428 PolarHBondContact O-N 2.85Å; V426-W428 VanDerWaalsContact C-N 3.28Å; V426-W428 PolarHBondContact O-N 2.78Å; W428-M430 VanDerWaalsContact C-N 3.33Å; W428-M430 PolarHBondContact O-N 3.37Å; W428-S431 PolarHBondContact O-N 2.92Å; W428-R432 HydrophobicContact CD2-CG 4.29Å; W428-R432 VanDerWaalsContact CZ2-CD 3.41Å; W428-R432 HydrophobicContact CZ2-CG 4.33Å; W428-R432 VanDerWaalsContact CZ3-CD 3.41Å; W428-R432 WeakPolarHBondContact O-CG 3.31Å; W428-R432 PolarHBondContact O-N 2.73Å; W428-R432 VanDerWaalsContact O-N 3.1Å; W428-Q444 HydrophobicContact CH2-CB 4.34Å; W428-Q444 WeakPolarHBondContact CZ3-O 3.26Å; W428-P446 HydrophobicContact CE3-CB 4.45Å; W428-P446 HydrophobicContact CE3-CG 4.26Å; W428-P446 HydrophobicContact CZ3-CB 4.46Å; W428-P446 HydrophobicContact CZ3-CG 4.42Å; W428-F448 AromaticContact CH2-CD1 4Å; W428-F448 HydrophobicContact CH2-CD1 4Å; W428-F448 HydrophobicContact CH2-CE1 4.12Å; W428-P471 HydrophobicContact CD2-CB 3.68Å; W428-P471 HydrophobicContact CD2-CG 4.42Å; W428-P471 HydrophobicContact CE3-CB 4.28Å; W428-P471 HydrophobicContact CG-CB 4.01Å; W428-P471 HydrophobicContact CH2-CB 4.24Å; W428-P471 HydrophobicContact CZ2-CB 3.61Å; W428-S472 PolarHBondContact NE1-O 3.42Å; W428-W477 AromaticContact CD1-CH2 3.73Å; W428-W477 HydrophobicContact CG-CH2 4.3Å; W428-M490 HydrophobicContact CB-SD 3.7Å; W428-M490 HydrophobicContact CG-SD 4.3Å; W428-W494 HydrophobicContact CB-CH2 4.17Å; W428-W494 HydrophobicContact CB-CZ3 3.75Å; W428-W494 AromaticContact CD1-CH2 3.81Å; W428-W494 HydrophobicContact CG-CH2 4.21Å; W428-W494 HydrophobicContact CG-CZ3 4.12Å
429	E	98.8	Very high	96.9	Very high	0 Å²	0	20 Å²	20	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-43.4	175.6	-66	178.6	-110.4	0	0	111.6	L311 S355 Y397 L425 V426 V427 Y443 P446	L311-E429 HydrophobicContact CD1-CB 4.05Å; S355-E429 VanDerWaalsContact CB-OE2 3.28Å; S355-E429 WeakPolarHBondContact CB-OE2 3.41Å; S355-E429 PolarHBondContact OG-OE1 3.47Å; S355-E429 PolarHBondContact OG-OE2 3.15Å; Y397-E429 VanDerWaalsContact CE1-OE1 3.28Å; Y397-E429 WeakPolarHBondContact CE1-OE1 3.06Å; Y397-E429 VanDerWaalsContact OH-CD 3.31Å; Y397-E429 PolarHBondContact OH-OE1 2.86Å; Y397-E429 PolarHBondContact OH-OE2 3.36Å; L425-E429 PolarHBondContact O-N 2.84Å; V426-E429 WeakPolarHBondContact O-CB 3.38Å; V426-E429 PolarHBondContact O-N 2.74Å; V426-E429 VanDerWaalsContact O-N 3.15Å; V427-E429 VanDerWaalsContact C-N 3.34Å; V427-E429 PolarHBondContact O-N 2.68Å; E429-Y443 HydrophobicContact CB-CE2 4.36Å; E429-Y443 PolarHBondContact OE2-OH 2.84Å; E429-P446 HydrophobicContact CG-CG 3.88Å
430	M	98.7	Very high	96.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.6	-48.3	176.8	-61	176.6	178	0	0	111.4	L307 L311 L316 L321 L324 A325 A328 V426 V427 W428 R432 R433 C434	L307-M430 HydrophobicContact CD1-CE 4.11Å; L307-M430 HydrophobicContact CD1-CG 4.43Å; L307-M430 HydrophobicContact CD2-CE 3.26Å; L307-M430 HydrophobicContact CD2-CG 4.1Å; L307-M430 HydrophobicContact CG-CE 4.33Å; L311-M430 HydrophobicContact CD1-CG 4.23Å; L316-M430 HydrophobicContact CD1-CB 4.34Å; L321-M430 HydrophobicContact CD1-CB 3.46Å; L321-M430 VanDerWaalsContact CD1-CB 3.46Å; L324-M430 HydrophobicContact CB-CE 4.05Å; L324-M430 HydrophobicContact CB-SD 4.02Å; A325-M430 HydrophobicContact CB-SD 3.95Å; A328-M430 HydrophobicContact CB-CE 4.4Å; V426-M430 HydrophobicContact CG1-CE 3.93Å; V426-M430 PolarHBondContact O-N 3.5Å; V426-M430 VanDerWaalsContact O-N 3.11Å; V427-M430 PolarHBondContact O-N 3.46Å; W428-M430 VanDerWaalsContact C-N 3.33Å; W428-M430 PolarHBondContact O-N 3.37Å; M430-R432 VanDerWaalsContact C-N 3.32Å; M430-R432 PolarHBondContact O-N 3.4Å; M430-R433 PolarHBondContact O-N 3.03Å; M430-C434 PolarHBondContact O-N 2.84Å
431	S	98.4	Very high	96.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.3	-33.6	-175.8	-71.4	0	0	0	0	113.4	V427 W428 R433 C434	V427-S431 WeakPolarHBondContact O-CB 3.31Å; V427-S431 PolarHBondContact O-N 3.09Å; V427-S431 PolarHBondContact O-OG 2.81Å; W428-S431 PolarHBondContact O-N 2.92Å; S431-R433 PolarHBondContact O-N 2.02Å; S431-C434 VanDerWaalsContact O-CB 3.26Å; S431-C434 WeakPolarHBondContact O-CB 3.12Å; S431-C434 PolarHBondContact O-N 3.09Å; S431-C434 VanDerWaalsContact O-N 3.1Å
432	R	97.9	Very high	96.6	Very high	22 Å²	22	30.1 Å²	30.1	8%	0.083	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-34.5	172.4	-76.1	179.7	66.9	78	4.7	113.6	W428 M430 C434 V440 E441 D442 R476 W477	W428-R432 HydrophobicContact CD2-CG 4.29Å; W428-R432 VanDerWaalsContact CZ2-CD 3.41Å; W428-R432 HydrophobicContact CZ2-CG 4.33Å; W428-R432 VanDerWaalsContact CZ3-CD 3.41Å; W428-R432 WeakPolarHBondContact O-CG 3.31Å; W428-R432 PolarHBondContact O-N 2.73Å; W428-R432 VanDerWaalsContact O-N 3.1Å; M430-R432 VanDerWaalsContact C-N 3.32Å; M430-R432 PolarHBondContact O-N 3.4Å; R432-C434 VanDerWaalsContact C-N 3.28Å; R432-V440 WeakPolarHBondContact O-CG2 3.47Å; R432-E441 WeakPolarHBondContact CA-OE2 3.36Å; R432-E441 PolarHBondContact O-N 2.73Å; R432-E441 VanDerWaalsContact O-OE2 3.08Å; R432-D442 PolarHBondContact NE-O 3.15Å; R432-D442 PolarHBondContact NH2-O 3.48Å; R432-R476 PolarHBondContact O-NH2 2.99Å; R432-W477 HydrophobicContact CB-CZ2 4.4Å; R432-W477 HydrophobicContact CG-CH2 4.21Å; R432-W477 HydrophobicContact CG-CZ2 3.69Å
433	R	98.2	Very high	96.6	Very high	20 Å²	20	31 Å²	31	8%	0.075	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-1.4	-179	-59.5	-56.1	-65	139.8	-0	113.2	L311 N314 T315 L316 M430 S431 V440 E441 Y443	L311-R433 HydrophobicContact CB-CG 4.09Å; L311-R433 HydrophobicContact CD2-CB 4.03Å; L311-R433 HydrophobicContact CD2-CG 4.03Å; L311-R433 PolarHBondContact O-NE 3.2Å; N314-R433 PolarHBondContact O-NE 3.33Å; N314-R433 VanDerWaalsContact O-NE 3.14Å; N314-R433 PolarHBondContact O-NH2 3.26Å; T315-R433 CarbonylContact C-O 3.59Å; T315-R433 WeakPolarHBondContact CA-O 3.23Å; L316-R433 HydrophobicContact CD1-CB 4.48Å; L316-R433 HydrophobicContact CG-CB 4.27Å; L316-R433 PolarHBondContact N-O 3.41Å; M430-R433 PolarHBondContact O-N 3.03Å; S431-R433 PolarHBondContact O-N 2.02Å; R433-V440 WeakPolarHBondContact O-CG2 3.39Å; R433-E441 PolarHBondContact NH1-O 3.39Å; R433-Y443 HydrophobicContact CG-CD2 4.44Å
434	C	97.7	Very high	96.5	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.007	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-77.4	121.9	174.3	-167.2	0	0	0	0	111.1	L316 L321 M430 S431 R432 R476 L483	L316-C434 CarbonylContact O-C 3.58Å; L316-C434 VanDerWaalsContact O-CA 3.29Å; L316-C434 WeakPolarHBondContact O-CA 3.37Å; L321-C434 HydrophobicContact CD2-CB 3.91Å; M430-C434 PolarHBondContact O-N 2.84Å; S431-C434 VanDerWaalsContact O-CB 3.26Å; S431-C434 WeakPolarHBondContact O-CB 3.12Å; S431-C434 PolarHBondContact O-N 3.09Å; S431-C434 VanDerWaalsContact O-N 3.1Å; R432-C434 VanDerWaalsContact C-N 3.28Å; C434-R476 PolarHBondContact O-NH1 2.02Å; C434-R476 PolarHBondContact O-NH2 2.9Å; C434-L483 HydrophobicContact CB-CD2 3.87Å
435	V	96.4	Very high	96.5	Very high	56 Å²	56	35.9 Å²	35.9	34%	0.339	22%	0.224	S	C	.	.			trans	-73.2	127.3	174.3	-174.4	0	0	0	0	108.9	T315 L316 M439 V440	T315-V435 HydrophobicContact CG2-CG2 4.24Å; L316-V435 PolarHBondContact O-N 3.01Å; V435-M439 WeakPolarHBondContact CA-O 3.5Å; V435-V440 HydrophobicContact CG2-CB 4.13Å; V435-V440 HydrophobicContact CG2-CG2 4.31Å
436	T	91.2	Very high	96.5	Very high	20 Å²	20	35.9 Å²	35.9	12%	0.123	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-139.8	130.5	172.3	62.9	0	0	0	0	109.5	G438 M439 R476 D480 L483	T436-G438 PolarHBondContact O-N 2.77Å; T436-M439 PolarHBondContact N-O 3.25Å; T436-M439 PolarHBondContact O-N 3.33Å; T436-R476 PolarHBondContact OG1-NH1 3.48Å; T436-D480 HydrophobicContact CG2-CB 3.8Å; T436-L483 HydrophobicContact CG2-CD1 3.41Å; T436-L483 VanDerWaalsContact CG2-CD1 3.41Å; T436-L483 HydrophobicContact CG2-CG 3.92Å
437	G	86.4	Confident	96.4	Very high	87 Å²	87	35.9 Å²	35.9	90%	0.897	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	32.2	-178.4	0	0	0	0	0	113.3	M439	G437-M439 PolarHBondContact O-N 3.02Å
438	G	90.3	Very high	96.4	Very high	75 Å²	75	39.3 Å²	39.3	77%	0.773	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.1	2.9	-176.9	0	0	0	0	0	115.4	T436	T436-G438 PolarHBondContact O-N 2.77Å
439	M	93.3	Very high	96.3	Very high	128 Å²	128	43.4 Å²	43.4	63%	0.631	26%	0.261	S	S	*	.	B	Isolated β-bridge	trans	-110	147.3	-179.4	-59.1	-178.8	77	0	0	111.6	V435 T436 G437	V435-M439 WeakPolarHBondContact CA-O 3.5Å; T436-M439 PolarHBondContact N-O 3.25Å; T436-M439 PolarHBondContact O-N 3.33Å; G437-M439 PolarHBondContact O-N 3.02Å
440	V	96.4	Very high	96.2	Very high	57 Å²	57	46.3 Å²	46.3	35%	0.345	28%	0.275	S	S	.	.			trans	-150.2	146.4	175.3	67.7	0	0	0	0	109.6	T315 R432 R433 V435	T315-V440 HydrophobicContact CG2-CG1 4.01Å; T315-V440 HydrophobicContact CG2-CG2 4.1Å; R432-V440 WeakPolarHBondContact O-CG2 3.47Å; R433-V440 WeakPolarHBondContact O-CG2 3.39Å; V435-V440 HydrophobicContact CG2-CB 4.13Å; V435-V440 HydrophobicContact CG2-CG2 4.31Å
441	E	96.5	Very high	96.2	Very high	32 Å²	32	47.2 Å²	47.2	15%	0.15	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-91	152.7	172.4	-58.9	101.7	177.9	0	0	111.7	R432 R433 S474 R476 W477	R432-E441 WeakPolarHBondContact CA-OE2 3.36Å; R432-E441 PolarHBondContact O-N 2.73Å; R432-E441 VanDerWaalsContact O-OE2 3.08Å; R433-E441 PolarHBondContact NH1-O 3.39Å; E441-S474 WeakPolarHBondContact OE1-CB 3.3Å; E441-S474 PolarHBondContact OE1-OG 3.45Å; E441-R476 VanDerWaalsContact CD-NH2 3.33Å; E441-R476 IonicContact OE1-CZ 3.52Å; E441-R476 IonicContact OE1-NE 2.64Å; E441-R476 PolarHBondContact OE1-NE 2.65Å; E441-R476 IonicContact OE1-NH2 3.51Å; E441-R476 IonicContact OE2-CZ 2.69Å; E441-R476 IonicContact OE2-NE 2.72Å; E441-R476 PolarHBondContact OE2-NE 2.65Å; E441-R476 IonicContact OE2-NH2 3.51Å; E441-R476 PolarHBondContact OE2-NH2 2.8Å; E441-W477 PolarHBondContact OE1-NE1 3.31Å
442	D	96.8	Very high	96	Very high	125 Å²	125	51.3 Å²	51.3	67%	0.668	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-58.9	149.1	170.2	-65.3	-38.2	0	0	0	112	R432 Q444	R432-D442 PolarHBondContact NE-O 3.15Å; R432-D442 PolarHBondContact NH2-O 3.48Å; D442-Q444 PolarHBondContact O-N 3.37Å
443	Y	97.8	Very high	95.6	Very high	27 Å²	27	55.4 Å²	55.4	11%	0.106	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-59.6	131	172.5	176.7	-94.9	0	0	0	110.3	Y308 L311 K312 E429 R433 L445	Y308-Y443 AromaticContact CD2-CE1 3.93Å; Y308-Y443 HydrophobicContact CD2-CE1 3.93Å; Y308-Y443 AromaticContact CD2-CZ 3.7Å; Y308-Y443 WeakPolarHBondContact CD2-OH 3.47Å; Y308-Y443 AromaticContact CE2-CE1 3.61Å; Y308-Y443 HydrophobicContact CE2-CE1 3.61Å; Y308-Y443 AromaticContact CE2-CZ 3.86Å; Y308-Y443 WeakPolarHBondContact CE2-OH 3.32Å; L311-Y443 HydrophobicContact CB-CD2 3.55Å; L311-Y443 HydrophobicContact CB-CE2 3.82Å; L311-Y443 HydrophobicContact CD1-CE2 4.19Å; K312-Y443 HydrophobicContact CB-CD1 4.46Å; K312-Y443 HydrophobicContact CD-CD1 4.07Å; K312-Y443 HydrophobicContact CD-CE1 4.14Å; K312-Y443 HydrophobicContact CG-CD1 3.26Å; K312-Y443 HydrophobicContact CG-CD2 4.49Å; K312-Y443 HydrophobicContact CG-CE1 3.7Å; K312-Y443 HydrophobicContact CG-CG 3.7Å; E429-Y443 HydrophobicContact CB-CE2 4.36Å; E429-Y443 PolarHBondContact OE2-OH 2.84Å; R433-Y443 HydrophobicContact CG-CD2 4.44Å; Y443-L445 WeakPolarHBondContact OH-CD2 3.28Å
444	Q	98.1	Very high	95.4	Very high	67 Å²	67	62.9 Å²	62.9	31%	0.313	37%	0.373	S	S	.	.			trans	-143.2	149.3	175.1	-68.3	-62.6	-16.7	0	0	109.2	W428 D442 F448	W428-Q444 HydrophobicContact CH2-CB 4.34Å; W428-Q444 WeakPolarHBondContact CZ3-O 3.26Å; D442-Q444 PolarHBondContact O-N 3.37Å; Q444-F448 HydrophobicContact CB-CB 4.14Å; Q444-F448 HydrophobicContact CB-CD1 3.47Å; Q444-F448 VanDerWaalsContact CB-CD1 3.47Å; Q444-F448 HydrophobicContact CB-CD2 4.12Å; Q444-F448 HydrophobicContact CB-CE1 3.85Å; Q444-F448 HydrophobicContact CB-CE2 4.44Å; Q444-F448 HydrophobicContact CB-CG 3.62Å; Q444-F448 HydrophobicContact CB-CZ 4.32Å; Q444-F448 VanDerWaalsContact CD-CD2 3.45Å; Q444-F448 HydrophobicContact CG-CD1 3.87Å; Q444-F448 HydrophobicContact CG-CD2 3.73Å; Q444-F448 HydrophobicContact CG-CE1 3.9Å; Q444-F448 HydrophobicContact CG-CE2 3.76Å; Q444-F448 HydrophobicContact CG-CG 3.79Å; Q444-F448 HydrophobicContact CG-CZ 3.85Å; Q444-F448 VanDerWaalsContact OE1-CD2 3.28Å
445	L	98.1	Very high	95.3	Very high	36 Å²	36	63.2 Å²	63.2	19%	0.188	38%	0.376	C	S	.	.			trans	-72.5	153.6	169.1	-76.4	167.7	0	0	0	110.3	Y308 Y397 Y443 Y447 F448	Y308-L445 HydrophobicContact CD2-CD2 3.98Å; Y308-L445 HydrophobicContact CE2-CD1 4.31Å; Y308-L445 HydrophobicContact CE2-CD2 3.89Å; Y308-L445 HydrophobicContact CE2-CG 4.14Å; Y397-L445 WeakPolarHBondContact OH-CD2 3.38Å; Y443-L445 WeakPolarHBondContact OH-CD2 3.28Å; L445-Y447 PolarHBondContact O-N 2.83Å; L445-F448 VanDerWaalsContact O-CB 3.32Å; L445-F448 WeakPolarHBondContact O-CB 3.3Å; L445-F448 PolarHBondContact O-N 3.41Å; L445-F448 VanDerWaalsContact O-N 3.14Å
446	P	98.4	Very high	95.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	138.1	173	-23.2	33.4	0	0	0	110.5	R396 Y397 L425 W428 E429 F448 P471	R396-P446 VanDerWaalsContact CD-O 3.23Å; R396-P446 WeakPolarHBondContact CD-O 3.42Å; R396-P446 WeakPolarHBondContact CG-O 3.16Å; R396-P446 PolarHBondContact NH1-O 3.13Å; Y397-P446 HydrophobicContact CE1-CG 3.86Å; Y397-P446 WeakPolarHBondContact OH-CD 3.46Å; L425-P446 HydrophobicContact CB-CB 4.19Å; L425-P446 HydrophobicContact CB-CG 3.87Å; L425-P446 HydrophobicContact CD1-CB 4.49Å; L425-P446 HydrophobicContact CD2-CB 4.09Å; W428-P446 HydrophobicContact CE3-CB 4.45Å; W428-P446 HydrophobicContact CE3-CG 4.26Å; W428-P446 HydrophobicContact CZ3-CB 4.46Å; W428-P446 HydrophobicContact CZ3-CG 4.42Å; E429-P446 HydrophobicContact CG-CG 3.88Å; P446-F448 VanDerWaalsContact C-N 3.26Å; P446-F448 PolarHBondContact O-N 2.76Å; P446-P471 HydrophobicContact CB-CG 4.03Å
447	Y	98.4	Very high	95.5	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	15.8	-178	-46.8	-76.1	0	0	0	115.9	R396 Y421 L425 L445 N449 M450 V451 M460 V463 V464 P471	R396-Y447 HydrophobicContact CG-CD2 4.35Å; Y421-Y447 PolarHBondContact OH-OH 2.75Å; L425-Y447 HydrophobicContact CD1-CE2 3.97Å; L425-Y447 HydrophobicContact CD2-CE2 3.76Å; L445-Y447 PolarHBondContact O-N 2.83Å; Y447-N449 PolarHBondContact O-N 3.22Å; Y447-N449 VanDerWaalsContact O-N 3.08Å; Y447-M450 HydrophobicContact CD1-SD 4Å; Y447-M450 PolarHBondContact O-N 3.48Å; Y447-V451 WeakPolarHBondContact O-CG2 3.01Å; Y447-V451 PolarHBondContact O-N 2.72Å; Y447-V451 VanDerWaalsContact O-N 3.08Å; Y447-M460 HydrophobicContact CD2-CE 3.82Å; Y447-M460 HydrophobicContact CE2-CE 4.02Å; Y447-M460 HydrophobicContact CG-CE 4.41Å; Y447-V463 HydrophobicContact CD1-CG1 4Å; Y447-V463 HydrophobicContact CE1-CG1 4.39Å; Y447-V464 HydrophobicContact CE1-CG2 4.14Å; Y447-V464 HydrophobicContact CE2-CG2 4.33Å; Y447-P471 HydrophobicContact CD1-CG 4.32Å; Y447-P471 HydrophobicContact CE1-CG 4.01Å; Y447-P471 HydrophobicContact CE2-CG 4.29Å
448	F	97.8	Very high	96	Very high	72 Å²	72	64.3 Å²	64.3	32%	0.316	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-29.5	-178.6	77.2	-75.4	0	0	0	115	W428 Q444 L445 P446	W428-F448 AromaticContact CH2-CD1 4Å; W428-F448 HydrophobicContact CH2-CD1 4Å; W428-F448 HydrophobicContact CH2-CE1 4.12Å; Q444-F448 HydrophobicContact CB-CB 4.14Å; Q444-F448 HydrophobicContact CB-CD1 3.47Å; Q444-F448 VanDerWaalsContact CB-CD1 3.47Å; Q444-F448 HydrophobicContact CB-CD2 4.12Å; Q444-F448 HydrophobicContact CB-CE1 3.85Å; Q444-F448 HydrophobicContact CB-CE2 4.44Å; Q444-F448 HydrophobicContact CB-CG 3.62Å; Q444-F448 HydrophobicContact CB-CZ 4.32Å; Q444-F448 VanDerWaalsContact CD-CD2 3.45Å; Q444-F448 HydrophobicContact CG-CD1 3.87Å; Q444-F448 HydrophobicContact CG-CD2 3.73Å; Q444-F448 HydrophobicContact CG-CE1 3.9Å; Q444-F448 HydrophobicContact CG-CE2 3.76Å; Q444-F448 HydrophobicContact CG-CG 3.79Å; Q444-F448 HydrophobicContact CG-CZ 3.85Å; Q444-F448 VanDerWaalsContact OE1-CD2 3.28Å; L445-F448 VanDerWaalsContact O-CB 3.32Å; L445-F448 WeakPolarHBondContact O-CB 3.3Å; L445-F448 PolarHBondContact O-N 3.41Å; L445-F448 VanDerWaalsContact O-N 3.14Å; P446-F448 VanDerWaalsContact C-N 3.26Å; P446-F448 PolarHBondContact O-N 2.76Å
449	N	96.8	Very high	96.3	Very high	86 Å²	86	63.8 Å²	63.8	46%	0.46	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	1.4	-179.3	66	-39	0	0	0	113.5	Y447	Y447-N449 PolarHBondContact O-N 3.22Å; Y447-N449 VanDerWaalsContact O-N 3.08Å
450	M	97.5	Very high	96.6	Very high	62 Å²	62	57.7 Å²	57.7	31%	0.305	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-27	-175.8	-60.5	177.9	-173.7	0	0	112.6	Y447 V463 L469 R470	Y447-M450 HydrophobicContact CD1-SD 4Å; Y447-M450 PolarHBondContact O-N 3.48Å; M450-V463 HydrophobicContact CB-CG1 4.12Å; M450-V463 HydrophobicContact CB-CG2 4.25Å; M450-V463 HydrophobicContact SD-CG1 3.75Å; M450-L469 HydrophobicContact CE-CB 4.31Å; M450-L469 HydrophobicContact CE-CD1 4.42Å; M450-L469 HydrophobicContact SD-CB 3.92Å; M450-L469 HydrophobicContact SD-CD1 3.97Å; M450-R470 WeakPolarHBondContact CE-O 3.36Å
451	V	97.3	Very high	96.6	Very high	19 Å²	19	57.6 Å²	57.6	12%	0.115	30%	0.302	C	S	.	.	S	Bend	trans	-136.9	161	-178.6	-56.3	0	0	0	0	111.3	Y447 P455 D459 M460 V463	Y447-V451 WeakPolarHBondContact O-CG2 3.01Å; Y447-V451 PolarHBondContact O-N 2.72Å; Y447-V451 VanDerWaalsContact O-N 3.08Å; V451-P455 HydrophobicContact CB-CB 3.96Å; V451-P455 HydrophobicContact CG2-CB 3.87Å; V451-P455 HydrophobicContact CG2-CG 4.1Å; V451-D459 HydrophobicContact CG1-CB 4.21Å; V451-M460 HydrophobicContact CG1-SD 4.16Å; V451-M460 HydrophobicContact CG2-SD 4.06Å; V451-V463 HydrophobicContact CG1-CB 4.4Å; V451-V463 HydrophobicContact CG1-CG2 3.75Å
452	T	94.9	Very high	96.7	Very high	86 Å²	86	59.9 Å²	59.9	53%	0.528	31%	0.313	S	S	.	.			trans	-63.3	170.9	176.1	65.1	0	0	0	0	112	R396 E454	R396-T452 PolarHBondContact NH2-O 2.77Å; T452-E454 VanDerWaalsContact C-N 3.28Å; T452-E454 PolarHBondContact O-N 2.71Å; T452-E454 PolarHBondContact OG1-O 3.37Å
453	S	90.3	Very high	96.8	Very high	107 Å²	107	54.4 Å²	54.4	75%	0.748	28%	0.284	S	S	*	.	S	Bend	trans	-61	-35	179.7	-54.6	0	0	0	0	113.4	R396 P455	R396-S453 VanDerWaalsContact NH2-C 3.32Å; R396-S453 PolarHBondContact NH2-O 3.34Å; S453-P455 WeakPolarHBondContact O-CD 3.44Å
454	E	92.3	Very high	96.8	Very high	177 Å²	177	53.1 Å²	53.1	83%	0.827	28%	0.279	S	S	*	.	S	Bend	trans	-120.8	79.2	176.2	-64.6	-168.6	167	0	0	109.8	T452	T452-E454 VanDerWaalsContact C-N 3.28Å; T452-E454 PolarHBondContact O-N 2.71Å; T452-E454 PolarHBondContact OG1-O 3.37Å
455	P	96.4	Very high	96.8	Very high	9 Å²	9	51.1 Å²	51.1	6%	0.058	27%	0.272	C	S	.	.			trans	-67.9	146	-173	28.9	-35.5	0	0	0	111.3	R395 R396 V451 S453 D459 M460	R395-P455 WeakPolarHBondContact CD-O 2.99Å; R396-P455 HydrophobicContact CB-CG 4.22Å; V451-P455 HydrophobicContact CB-CB 3.96Å; V451-P455 HydrophobicContact CG2-CB 3.87Å; V451-P455 HydrophobicContact CG2-CG 4.1Å; S453-P455 WeakPolarHBondContact O-CD 3.44Å; P455-D459 HydrophobicContact CB-CB 4.05Å; P455-M460 HydrophobicContact CB-CG 3.91Å; P455-M460 HydrophobicContact CB-SD 3.99Å; P455-M460 HydrophobicContact CG-CG 3.93Å; P455-M460 HydrophobicContact CG-SD 3.85Å
456	S	96.6	Very high	96.8	Very high	38 Å²	38	54 Å²	54	27%	0.266	29%	0.291	S	S	.	.			trans	-70	176.4	168.5	93.2	0	0	0	0	110.6	E458 D459	S456-E458 WeakPolarHBondContact CB-OE2 3.49Å; S456-E458 PolarHBondContact OG-N 3.33Å; S456-E458 VanDerWaalsContact OG-N 3.14Å; S456-E458 PolarHBondContact OG-OE2 2.93Å; S456-D459 PolarHBondContact N-OD2 2.96Å; S456-D459 PolarHBondContact OG-N 2.67Å; S456-D459 VanDerWaalsContact OG-N 3.13Å
457	Y	94.6	Very high	96.7	Very high	26 Å²	26	59.8 Å²	59.8	10%	0.102	32%	0.316	C	S	.	.	H	α-helix	trans	-68.8	-41.5	174.1	-172.4	-91.9	0	0	0	110.8	R391 M398 V402 L403 M460 L461	R391-Y457 HydrophobicContact CB-CE2 4.4Å; R391-Y457 VanDerWaalsContact CD-OH 3.23Å; R391-Y457 WeakPolarHBondContact CD-OH 3.44Å; R391-Y457 HydrophobicContact CG-CE2 4.09Å; R391-Y457 VanDerWaalsContact CZ-CZ 3.49Å; R391-Y457 PolarHBondContact NE-OH 2.7Å; R391-Y457 PolarHBondContact NH2-OH 2.84Å; M398-Y457 HydrophobicContact SD-CE2 4.26Å; V402-Y457 PolarHBondContact O-OH 3.38Å; L403-Y457 VanDerWaalsContact CA-OH 3.22Å; L403-Y457 WeakPolarHBondContact CA-OH 3.32Å; L403-Y457 HydrophobicContact CD2-CD2 4.23Å; L403-Y457 HydrophobicContact CD2-CE2 4.05Å; L403-Y457 WeakPolarHBondContact O-CE1 3.1Å; L403-Y457 PolarHBondContact O-OH 2.75Å; Y457-M460 PolarHBondContact O-N 3Å; Y457-L461 WeakPolarHBondContact O-CB 2.99Å; Y457-L461 PolarHBondContact O-N 2.92Å
458	E	96.8	Very high	96.7	Very high	121 Å²	121	61.8 Å²	61.8	57%	0.565	34%	0.336	S	S	*	.	H	α-helix	trans	-64.1	-41.7	179.8	-58.8	69.7	-149.9	0	0	111.4	S456 M460 L461 E462	S456-E458 WeakPolarHBondContact CB-OE2 3.49Å; S456-E458 PolarHBondContact OG-N 3.33Å; S456-E458 VanDerWaalsContact OG-N 3.14Å; S456-E458 PolarHBondContact OG-OE2 2.93Å; E458-M460 VanDerWaalsContact C-N 3.31Å; E458-M460 PolarHBondContact O-N 2.87Å; E458-L461 PolarHBondContact O-N 2.95Å; E458-E462 WeakPolarHBondContact O-CB 3.38Å; E458-E462 PolarHBondContact O-N 3.46Å
459	D	97.7	Very high	96.7	Very high	64 Å²	64	61.6 Å²	61.6	34%	0.342	34%	0.339	S	S	.	.	H	α-helix	trans	-56.1	-47.1	175.1	-68	-27.6	0	0	0	111.4	V451 P455 S456 V463	V451-D459 HydrophobicContact CG1-CB 4.21Å; P455-D459 HydrophobicContact CB-CB 4.05Å; S456-D459 PolarHBondContact N-OD2 2.96Å; S456-D459 PolarHBondContact OG-N 2.67Å; S456-D459 VanDerWaalsContact OG-N 3.13Å; D459-V463 WeakPolarHBondContact O-CG2 2.96Å; D459-V463 PolarHBondContact O-N 3.07Å; D459-V463 VanDerWaalsContact O-N 3.15Å
460	M	98.3	Very high	96.8	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-71.8	-40.7	-178.7	-70.3	-56.4	-53.1	0	0	111.9	R395 R396 L403 Y447 V451 P455 Y457 E458 E462 V463 V464	R395-M460 HydrophobicContact CB-CG 4.23Å; R396-M460 WeakPolarHBondContact O-CE 3.24Å; L403-M460 HydrophobicContact CD1-CB 3.98Å; L403-M460 HydrophobicContact CD2-CB 3.72Å; Y447-M460 HydrophobicContact CD2-CE 3.82Å; Y447-M460 HydrophobicContact CE2-CE 4.02Å; Y447-M460 HydrophobicContact CG-CE 4.41Å; V451-M460 HydrophobicContact CG1-SD 4.16Å; V451-M460 HydrophobicContact CG2-SD 4.06Å; P455-M460 HydrophobicContact CB-CG 3.91Å; P455-M460 HydrophobicContact CB-SD 3.99Å; P455-M460 HydrophobicContact CG-CG 3.93Å; P455-M460 HydrophobicContact CG-SD 3.85Å; Y457-M460 PolarHBondContact O-N 3Å; E458-M460 VanDerWaalsContact C-N 3.31Å; E458-M460 PolarHBondContact O-N 2.87Å; M460-E462 VanDerWaalsContact C-N 3.34Å; M460-E462 PolarHBondContact O-N 2.84Å; M460-V463 PolarHBondContact O-N 2.95Å; M460-V464 HydrophobicContact CE-CG2 3.65Å; M460-V464 VanDerWaalsContact O-CB 3.24Å; M460-V464 WeakPolarHBondContact O-CB 3.46Å; M460-V464 WeakPolarHBondContact O-CG2 3.24Å; M460-V464 PolarHBondContact O-N 2.94Å
461	L	97.8	Very high	96.8	Very high	55 Å²	55	56.9 Å²	56.9	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-58.2	-46.7	175	177.1	71.4	0	0	0	111	L403 D404 Y457 E458 C465 V466	L403-L461 HydrophobicContact CB-CD1 4.4Å; L403-L461 VanDerWaalsContact O-CD1 3.3Å; L403-L461 WeakPolarHBondContact O-CD1 3.03Å; D404-L461 HydrophobicContact CB-CD1 4.1Å; Y457-L461 WeakPolarHBondContact O-CB 2.99Å; Y457-L461 PolarHBondContact O-N 2.92Å; E458-L461 PolarHBondContact O-N 2.95Å; L461-C465 HydrophobicContact CD1-CB 3.7Å; L461-C465 WeakPolarHBondContact O-CA 3.16Å; L461-C465 VanDerWaalsContact O-CB 3.24Å; L461-C465 WeakPolarHBondContact O-CB 3.32Å; L461-C465 PolarHBondContact O-N 2.97Å; L461-V466 PolarHBondContact O-N 3.05Å; L461-V466 VanDerWaalsContact O-N 3.08Å
462	E	98.3	Very high	96.7	Very high	81 Å²	81	58.3 Å²	58.3	38%	0.379	32%	0.323	S	S	.	.	I	π-helix	trans	-61.9	-47.9	179.2	178.3	62.8	-168.7	0	0	111.6	E458 M460 V466 K467	E458-E462 WeakPolarHBondContact O-CB 3.38Å; E458-E462 PolarHBondContact O-N 3.46Å; M460-E462 VanDerWaalsContact C-N 3.34Å; M460-E462 PolarHBondContact O-N 2.84Å; E462-V466 WeakPolarHBondContact O-CB 3.5Å; E462-K467 WeakPolarHBondContact O-CG 3.42Å; E462-K467 PolarHBondContact O-N 2.83Å; E462-K467 WeakPolarHBondContact OE1-CE 3.46Å; E462-K467 IonicContact OE1-NZ 3.69Å
463	V	98.4	Very high	96.7	Very high	10 Å²	10	56.5 Å²	56.5	6%	0.061	31%	0.311	C	S	.	.	I	π-helix	trans	-70.5	-45	-177.6	171	0	0	0	0	112.1	Y447 M450 V451 D459 M460 G468 L469	Y447-V463 HydrophobicContact CD1-CG1 4Å; Y447-V463 HydrophobicContact CE1-CG1 4.39Å; M450-V463 HydrophobicContact CB-CG1 4.12Å; M450-V463 HydrophobicContact CB-CG2 4.25Å; M450-V463 HydrophobicContact SD-CG1 3.75Å; V451-V463 HydrophobicContact CG1-CB 4.4Å; V451-V463 HydrophobicContact CG1-CG2 3.75Å; D459-V463 WeakPolarHBondContact O-CG2 2.96Å; D459-V463 PolarHBondContact O-N 3.07Å; D459-V463 VanDerWaalsContact O-N 3.15Å; M460-V463 PolarHBondContact O-N 2.95Å; V463-G468 PolarHBondContact O-N 2.89Å; V463-L469 HydrophobicContact CG1-CB 4.04Å; V463-L469 HydrophobicContact CG1-CD1 4.39Å; V463-L469 WeakPolarHBondContact O-CB 3.33Å; V463-L469 PolarHBondContact O-N 3.13Å
464	V	98.3	Very high	96.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.291	C	S	.	.	I	π-helix	trans	-91	-40.6	-168.6	175.5	0	0	0	0	112.8	P400 L403 Y421 Y447 M460 G468	P400-V464 HydrophobicContact CB-CG1 4.31Å; P400-V464 HydrophobicContact CG-CG1 3.78Å; L403-V464 HydrophobicContact CD1-CB 3.83Å; L403-V464 HydrophobicContact CD1-CG1 3.98Å; L403-V464 HydrophobicContact CD1-CG2 4.22Å; Y421-V464 WeakPolarHBondContact OH-CG1 3.38Å; Y447-V464 HydrophobicContact CE1-CG2 4.14Å; Y447-V464 HydrophobicContact CE2-CG2 4.33Å; M460-V464 HydrophobicContact CE-CG2 3.65Å; M460-V464 VanDerWaalsContact O-CB 3.24Å; M460-V464 WeakPolarHBondContact O-CB 3.46Å; M460-V464 WeakPolarHBondContact O-CG2 3.24Å; M460-V464 PolarHBondContact O-N 2.94Å; V464-G468 WeakPolarHBondContact O-CA 3.38Å
465	C	97.8	Very high	96.8	Very high	25 Å²	25	51.7 Å²	51.7	17%	0.169	29%	0.287	C	S	.	.	I	π-helix	trans	-95.9	-47.8	-174.6	-56.4	0	0	0	0	111.7	P400 L461	P400-C465 VanDerWaalsContact CA-SG 3.57Å; P400-C465 PolarHBondContact O-SG 2.9Å; L461-C465 HydrophobicContact CD1-CB 3.7Å; L461-C465 WeakPolarHBondContact O-CA 3.16Å; L461-C465 VanDerWaalsContact O-CB 3.24Å; L461-C465 WeakPolarHBondContact O-CB 3.32Å; L461-C465 PolarHBondContact O-N 2.97Å
466	V	97.5	Very high	96.5	Very high	96 Å²	96	52.7 Å²	52.7	58%	0.582	29%	0.289	S	S	*	.	I	π-helix	trans	-76.7	-54.3	-177	-178.6	0	0	0	0	111.1	L461 E462	L461-V466 PolarHBondContact O-N 3.05Å; L461-V466 VanDerWaalsContact O-N 3.08Å; E462-V466 WeakPolarHBondContact O-CB 3.5Å
467	K	97.9	Very high	96.5	Very high	122 Å²	122	50.9 Å²	50.9	53%	0.53	28%	0.277	S	S	.	.	S	Bend	trans	-83.4	-13.9	-179.2	-62.9	178	-177.3	166.4	0	113.8	E462 L469	E462-K467 WeakPolarHBondContact O-CG 3.42Å; E462-K467 PolarHBondContact O-N 2.83Å; E462-K467 WeakPolarHBondContact OE1-CE 3.46Å; E462-K467 IonicContact OE1-NZ 3.69Å; K467-L469 HydrophobicContact CB-CD1 3.94Å; K467-L469 HydrophobicContact CB-CG 3.74Å; K467-L469 HydrophobicContact CD-CD1 4.03Å; K467-L469 PolarHBondContact O-N 2.93Å
468	G	97.5	Very high	96.4	Very high	41 Å²	41	53.5 Å²	53.5	42%	0.423	29%	0.292	S	S	.	.			trans	64	22.4	-179.6	0	0	0	0	0	114.5	V463 V464	V463-G468 PolarHBondContact O-N 2.89Å; V464-G468 WeakPolarHBondContact O-CA 3.38Å
469	L	98.1	Very high	96.1	Very high	69 Å²	69	52.8 Å²	52.8	36%	0.361	30%	0.3	S	S	.	.			trans	-76.8	156.7	-173.9	-61.6	174.8	0	0	0	112.1	M450 V463 K467	M450-L469 HydrophobicContact CE-CB 4.31Å; M450-L469 HydrophobicContact CE-CD1 4.42Å; M450-L469 HydrophobicContact SD-CB 3.92Å; M450-L469 HydrophobicContact SD-CD1 3.97Å; V463-L469 HydrophobicContact CG1-CB 4.04Å; V463-L469 HydrophobicContact CG1-CD1 4.39Å; V463-L469 WeakPolarHBondContact O-CB 3.33Å; V463-L469 PolarHBondContact O-N 3.13Å; K467-L469 HydrophobicContact CB-CD1 3.94Å; K467-L469 HydrophobicContact CB-CG 3.74Å; K467-L469 HydrophobicContact CD-CD1 4.03Å; K467-L469 PolarHBondContact O-N 2.93Å
470	R	98.3	Very high	96	Very high	43 Å²	43	52 Å²	52	16%	0.162	30%	0.296	C	S	.	.			trans	-132.4	162.1	174.7	-67.5	-62.1	-179.3	-86.9	1.4	109.8	M450 S472 W494	M450-R470 WeakPolarHBondContact CE-O 3.36Å; R470-S472 PolarHBondContact O-N 3.14Å; R470-W494 HydrophobicContact CB-CZ2 4.28Å; R470-W494 HydrophobicContact CG-CD2 4.46Å; R470-W494 HydrophobicContact CG-CG 4.39Å; R470-W494 PolarHBondContact NE-O 2.9Å; R470-W494 PolarHBondContact NH2-O 2.91Å
471	P	97.9	Very high	95.8	Very high	5 Å²	5	57.1 Å²	57.1	3%	0.032	32%	0.32	C	S	.	.			trans	-55.2	133.9	179.1	-25.8	36.3	0	0	0	111.7	L425 W428 P446 Y447 W494	L425-P471 HydrophobicContact CD2-CG 3.62Å; W428-P471 HydrophobicContact CD2-CB 3.68Å; W428-P471 HydrophobicContact CD2-CG 4.42Å; W428-P471 HydrophobicContact CE3-CB 4.28Å; W428-P471 HydrophobicContact CG-CB 4.01Å; W428-P471 HydrophobicContact CH2-CB 4.24Å; W428-P471 HydrophobicContact CZ2-CB 3.61Å; P446-P471 HydrophobicContact CB-CG 4.03Å; Y447-P471 HydrophobicContact CD1-CG 4.32Å; Y447-P471 HydrophobicContact CE1-CG 4.01Å; Y447-P471 HydrophobicContact CE2-CG 4.29Å; P471-W494 HydrophobicContact CB-CH2 4.4Å; P471-W494 HydrophobicContact CB-CZ3 4.38Å; P471-W494 HydrophobicContact CG-CH2 4.35Å; P471-W494 HydrophobicContact CG-CZ3 3.91Å
472	S	94.6	Very high	95.6	Very high	50 Å²	50	54.7 Å²	54.7	35%	0.35	31%	0.308	S	S	.	.			trans	-63.7	139.5	-178.6	56.5	0	0	0	0	111.4	W428 R470	W428-S472 PolarHBondContact NE1-O 3.42Å; R470-S472 PolarHBondContact O-N 3.14Å
473	V	94.6	Very high	95.6	Very high	47 Å²	47	50.9 Å²	50.9	29%	0.285	29%	0.29	S	S	.	.			trans	-116	134.8	179.3	-177.1	0	0	0	0	109.2	W477 L487 M490	V473-W477 HydrophobicContact CG1-CB 4.07Å; V473-W477 HydrophobicContact CG1-CD2 3.47Å; V473-W477 VanDerWaalsContact CG1-CD2 3.47Å; V473-W477 HydrophobicContact CG1-CE3 3.54Å; V473-W477 HydrophobicContact CG1-CG 3.75Å; V473-W477 HydrophobicContact CG1-CZ2 4.47Å; V473-W477 HydrophobicContact CG1-CZ3 4.11Å; V473-L487 HydrophobicContact CB-CD1 4.34Å; V473-L487 HydrophobicContact CG1-CD1 3.99Å; V473-L487 HydrophobicContact CG1-CD2 4.26Å; V473-L487 HydrophobicContact CG2-CD1 3.87Å; V473-M490 HydrophobicContact CG1-CE 4.5Å; V473-M490 HydrophobicContact CG2-CE 3.62Å
474	S	93.1	Very high	95.5	Very high	48 Å²	48	55.9 Å²	55.9	34%	0.336	31%	0.308	S	S	.	.			trans	-74	140.7	176.4	178	0	0	0	0	111	E441 R476 W477	E441-S474 WeakPolarHBondContact OE1-CB 3.3Å; E441-S474 PolarHBondContact OE1-OG 3.45Å; S474-R476 PolarHBondContact O-N 3.37Å; S474-R476 PolarHBondContact OG-N 3.05Å; S474-W477 WeakPolarHBondContact O-CB 3.43Å; S474-W477 PolarHBondContact O-N 2Å; S474-W477 VanDerWaalsContact O-N 3.08Å
475	N	91.5	Very high	95.4	Very high	136 Å²	136	57.8 Å²	57.8	73%	0.727	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-57.7	-23.7	177.3	-70.8	-26.2	0	0	0	113	W477 N478	N475-W477 PolarHBondContact O-N 3.46Å; N475-W477 VanDerWaalsContact O-N 3.12Å; N475-N478 WeakPolarHBondContact O-CB 3.33Å; N475-N478 PolarHBondContact O-N 3.48Å; N475-N478 VanDerWaalsContact O-N 3.1Å
476	R	91.9	Very high	95.4	Very high	30 Å²	30	56.6 Å²	56.6	11%	0.113	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-57.3	-27.5	177.2	80	175.1	-179.3	99.8	-6.5	112.8	R432 C434 T436 E441 S474 N478 S479	R432-R476 PolarHBondContact O-NH2 2.99Å; C434-R476 PolarHBondContact O-NH1 2.02Å; C434-R476 PolarHBondContact O-NH2 2.9Å; T436-R476 PolarHBondContact OG1-NH1 3.48Å; E441-R476 VanDerWaalsContact CD-NH2 3.33Å; E441-R476 IonicContact OE1-CZ 3.52Å; E441-R476 IonicContact OE1-NE 2.64Å; E441-R476 PolarHBondContact OE1-NE 2.65Å; E441-R476 IonicContact OE1-NH2 3.51Å; E441-R476 IonicContact OE2-CZ 2.69Å; E441-R476 IonicContact OE2-NE 2.72Å; E441-R476 PolarHBondContact OE2-NE 2.65Å; E441-R476 IonicContact OE2-NH2 3.51Å; E441-R476 PolarHBondContact OE2-NH2 2.8Å; S474-R476 PolarHBondContact O-N 3.37Å; S474-R476 PolarHBondContact OG-N 3.05Å; R476-N478 PolarHBondContact O-N 3.34Å; R476-S479 WeakPolarHBondContact O-CB 3.26Å; R476-S479 PolarHBondContact O-N 3.02Å
477	W	94.6	Very high	95.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-65.5	-26.7	-177.3	-67.2	32.3	0	0	0	111.1	W428 R432 E441 V473 S474 N475 S479 L483 R484 L487 M490	W428-W477 AromaticContact CD1-CH2 3.73Å; W428-W477 HydrophobicContact CG-CH2 4.3Å; R432-W477 HydrophobicContact CB-CZ2 4.4Å; R432-W477 HydrophobicContact CG-CH2 4.21Å; R432-W477 HydrophobicContact CG-CZ2 3.69Å; E441-W477 PolarHBondContact OE1-NE1 3.31Å; V473-W477 HydrophobicContact CG1-CB 4.07Å; V473-W477 HydrophobicContact CG1-CD2 3.47Å; V473-W477 VanDerWaalsContact CG1-CD2 3.47Å; V473-W477 HydrophobicContact CG1-CE3 3.54Å; V473-W477 HydrophobicContact CG1-CG 3.75Å; V473-W477 HydrophobicContact CG1-CZ2 4.47Å; V473-W477 HydrophobicContact CG1-CZ3 4.11Å; S474-W477 WeakPolarHBondContact O-CB 3.43Å; S474-W477 PolarHBondContact O-N 2Å; S474-W477 VanDerWaalsContact O-N 3.08Å; N475-W477 PolarHBondContact O-N 3.46Å; N475-W477 VanDerWaalsContact O-N 3.12Å; W477-S479 VanDerWaalsContact C-N 3.27Å; W477-S479 PolarHBondContact O-N 3.35Å; W477-L483 HydrophobicContact CB-CB 3.97Å; W477-L483 HydrophobicContact CB-CD1 4.37Å; W477-L483 HydrophobicContact CD2-CD1 4.39Å; W477-L483 HydrophobicContact CG-CB 4.24Å; W477-L483 HydrophobicContact CG-CD1 3.98Å; W477-R484 PolarHBondContact O-N 3.06Å; W477-R484 VanDerWaalsContact O-N 3.17Å; W477-L487 HydrophobicContact CE3-CB 4.31Å; W477-M490 HydrophobicContact CE3-CE 3.84Å; W477-M490 HydrophobicContact CH2-CE 3.97Å; W477-M490 HydrophobicContact CH2-SD 4.42Å; W477-M490 HydrophobicContact CZ3-CE 3.17Å; W477-M490 HydrophobicContact CZ3-SD 3.8Å
478	N	93.3	Very high	95.4	Very high	80 Å²	80	54.1 Å²	54.1	43%	0.428	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-73.4	-19.1	175.7	-68	-55.1	0	0	0	113	N475 R476 R484	N475-N478 WeakPolarHBondContact O-CB 3.33Å; N475-N478 PolarHBondContact O-N 3.48Å; N475-N478 VanDerWaalsContact O-N 3.1Å; R476-N478 PolarHBondContact O-N 3.34Å; N478-R484 VanDerWaalsContact O-CZ 3.26Å; N478-R484 PolarHBondContact O-NE 3.46Å; N478-R484 PolarHBondContact O-NH2 2.91Å
479	S	91.5	Very high	95.5	Very high	106 Å²	106	52.4 Å²	52.4	74%	0.741	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-82.3	-18.5	-179.9	-56.7	0	0	0	0	113.1	R476 W477	R476-S479 WeakPolarHBondContact O-CB 3.26Å; R476-S479 PolarHBondContact O-N 3.02Å; W477-S479 VanDerWaalsContact C-N 3.27Å; W477-S479 PolarHBondContact O-N 3.35Å
480	D	94	Very high	95.4	Very high	47 Å²	47	49.1 Å²	49.1	25%	0.251	26%	0.262	S	S	.	.	S	Bend	trans	-108.9	135.9	178.6	178	-98.3	0	0	0	111.3	T436 C482 L483 R484	T436-D480 HydrophobicContact CG2-CB 3.8Å; D480-C482 WeakPolarHBondContact OD1-CA 3.44Å; D480-C482 VanDerWaalsContact OD1-CB 3.29Å; D480-C482 WeakPolarHBondContact OD1-CB 3.01Å; D480-C482 PolarHBondContact OD1-N 3.47Å; D480-L483 HydrophobicContact CB-CB 4.2Å; D480-L483 HydrophobicContact CB-CG 4.45Å; D480-L483 PolarHBondContact OD1-N 2.92Å; D480-R484 WeakPolarHBondContact O-CB 3.47Å; D480-R484 PolarHBondContact O-N 2.88Å
481	E	94.1	Very high	95.4	Very high	109 Å²	109	49.3 Å²	49.3	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-66.1	-41.2	-176.6	-170.9	-173	162.7	0	0	112.3	A485 K521	E481-A485 WeakPolarHBondContact O-CB 2.95Å; E481-A485 PolarHBondContact O-N 3.42Å; E481-A485 VanDerWaalsContact O-N 3.09Å; E481-K521 IonicContact OE1-NZ 2.75Å; E481-K521 IonicContact OE2-NZ 2.84Å; E481-K521 PolarHBondContact OE2-NZ 3.33Å
482	C	95.4	Very high	95.4	Very high	4 Å²	4	52.5 Å²	52.5	3%	0.027	28%	0.284	C	S	.	.	H	α-helix	trans	-67.7	-49.4	-179.3	-178.4	0	0	0	0	110.5	A318 D480 R484 A485 M486	A318-C482 HydrophobicContact CB-CB 4.19Å; D480-C482 WeakPolarHBondContact OD1-CA 3.44Å; D480-C482 VanDerWaalsContact OD1-CB 3.29Å; D480-C482 WeakPolarHBondContact OD1-CB 3.01Å; D480-C482 PolarHBondContact OD1-N 3.47Å; C482-R484 VanDerWaalsContact C-N 3.34Å; C482-R484 PolarHBondContact O-N 3.26Å; C482-A485 PolarHBondContact O-N 3.49Å; C482-M486 VanDerWaalsContact O-CG 3.28Å; C482-M486 WeakPolarHBondContact O-CG 3.4Å; C482-M486 PolarHBondContact O-N 3.32Å
483	L	96.4	Very high	95.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-35.2	178	-72.3	-171.8	0	0	0	113.1	L321 C434 T436 W477 D480 M486 L487	L321-L483 HydrophobicContact CD2-CD2 3.78Å; C434-L483 HydrophobicContact CB-CD2 3.87Å; T436-L483 HydrophobicContact CG2-CD1 3.41Å; T436-L483 VanDerWaalsContact CG2-CD1 3.41Å; T436-L483 HydrophobicContact CG2-CG 3.92Å; W477-L483 HydrophobicContact CB-CB 3.97Å; W477-L483 HydrophobicContact CB-CD1 4.37Å; W477-L483 HydrophobicContact CD2-CD1 4.39Å; W477-L483 HydrophobicContact CG-CB 4.24Å; W477-L483 HydrophobicContact CG-CD1 3.98Å; D480-L483 HydrophobicContact CB-CB 4.2Å; D480-L483 HydrophobicContact CB-CG 4.45Å; D480-L483 PolarHBondContact OD1-N 2.92Å; L483-M486 PolarHBondContact O-N 3.33Å; L483-L487 VanDerWaalsContact O-CB 3.31Å; L483-L487 WeakPolarHBondContact O-CB 3.28Å; L483-L487 PolarHBondContact O-N 3.35Å
484	R	96.8	Very high	95.8	Very high	116 Å²	116	48.7 Å²	48.7	44%	0.438	26%	0.257	S	S	.	.	H	α-helix	trans	-64.1	-41.3	174.3	-165.7	-171.3	-49	121.5	4.3	111.7	W477 N478 D480 C482 L487 K488	W477-R484 PolarHBondContact O-N 3.06Å; W477-R484 VanDerWaalsContact O-N 3.17Å; N478-R484 VanDerWaalsContact O-CZ 3.26Å; N478-R484 PolarHBondContact O-NE 3.46Å; N478-R484 PolarHBondContact O-NH2 2.91Å; D480-R484 WeakPolarHBondContact O-CB 3.47Å; D480-R484 PolarHBondContact O-N 2.88Å; C482-R484 VanDerWaalsContact C-N 3.34Å; C482-R484 PolarHBondContact O-N 3.26Å; R484-L487 PolarHBondContact O-N 3.26Å; R484-K488 PolarHBondContact O-N 2.99Å; R484-K488 VanDerWaalsContact O-N 3.1Å
485	A	97.3	Very high	96	Very high	39 Å²	39	47.5 Å²	47.5	32%	0.322	25%	0.25	S	S	.	.	H	α-helix	trans	-67.5	-40.3	175.3	0	0	0	0	0	112.1	E481 C482 L487 K488 L489 M514	E481-A485 WeakPolarHBondContact O-CB 2.95Å; E481-A485 PolarHBondContact O-N 3.42Å; E481-A485 VanDerWaalsContact O-N 3.09Å; C482-A485 PolarHBondContact O-N 3.49Å; A485-L487 VanDerWaalsContact C-N 3.35Å; A485-K488 PolarHBondContact O-N 3.45Å; A485-L489 WeakPolarHBondContact O-CB 3.37Å; A485-L489 PolarHBondContact O-N 2.96Å; A485-M514 HydrophobicContact CB-CE 3.39Å; A485-M514 HydrophobicContact CB-SD 4.05Å
486	M	97.9	Very high	96.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-39.1	174	-68.2	-63.3	-80.5	0	0	112.1	L321 L322 A325 V427 C482 L483 L489 M490 L511 M514	L321-M486 HydrophobicContact CD1-CE 3.93Å; L321-M486 HydrophobicContact CD2-CE 4.38Å; L321-M486 HydrophobicContact CD2-CG 4.08Å; L321-M486 HydrophobicContact CG-CE 4.08Å; L322-M486 HydrophobicContact CD2-SD 3.95Å; A325-M486 HydrophobicContact CB-CE 3.82Å; V427-M486 HydrophobicContact CG1-CE 3.41Å; V427-M486 VanDerWaalsContact CG1-CE 3.41Å; C482-M486 VanDerWaalsContact O-CG 3.28Å; C482-M486 WeakPolarHBondContact O-CG 3.4Å; C482-M486 PolarHBondContact O-N 3.32Å; L483-M486 PolarHBondContact O-N 3.33Å; M486-L489 PolarHBondContact O-N 3.49Å; M486-M490 WeakPolarHBondContact O-CG 3.5Å; M486-M490 PolarHBondContact O-N 2.73Å; M486-L511 HydrophobicContact CE-CD2 4.28Å; M486-L511 HydrophobicContact SD-CD2 3.66Å; M486-M514 HydrophobicContact CG-CE 4.09Å; M486-M514 HydrophobicContact SD-CE 4Å
487	L	97.6	Very high	96.6	Very high	31 Å²	31	48.3 Å²	48.3	16%	0.162	25%	0.254	C	S	.	.	H	α-helix	trans	-59.4	-46.5	174.4	172	58.2	0	0	0	111.9	V473 W477 L483 R484 A485 M490 S491	V473-L487 HydrophobicContact CB-CD1 4.34Å; V473-L487 HydrophobicContact CG1-CD1 3.99Å; V473-L487 HydrophobicContact CG1-CD2 4.26Å; V473-L487 HydrophobicContact CG2-CD1 3.87Å; W477-L487 HydrophobicContact CE3-CB 4.31Å; L483-L487 VanDerWaalsContact O-CB 3.31Å; L483-L487 WeakPolarHBondContact O-CB 3.28Å; L483-L487 PolarHBondContact O-N 3.35Å; R484-L487 PolarHBondContact O-N 3.26Å; A485-L487 VanDerWaalsContact C-N 3.35Å; L487-M490 HydrophobicContact CB-CE 4.19Å; L487-M490 HydrophobicContact CD1-CE 3.27Å; L487-M490 HydrophobicContact CG-CE 4.33Å; L487-M490 WeakPolarHBondContact O-CG 3.28Å; L487-S491 VanDerWaalsContact O-CB 3.24Å; L487-S491 WeakPolarHBondContact O-CB 3.3Å; L487-S491 PolarHBondContact O-N 3.48Å; L487-S491 PolarHBondContact O-OG 2.74Å
488	K	97.9	Very high	96.8	Very high	135 Å²	135	49.7 Å²	49.7	59%	0.587	26%	0.263	S	S	*	.	H	α-helix	trans	-60	-49	174.5	-178.4	175.9	178	176.9	0	111.2	R484 A485 M490 S491 E492	R484-K488 PolarHBondContact O-N 2.99Å; R484-K488 VanDerWaalsContact O-N 3.1Å; A485-K488 PolarHBondContact O-N 3.45Å; K488-M490 PolarHBondContact O-N 2.85Å; K488-S491 PolarHBondContact O-N 3.3Å; K488-E492 WeakPolarHBondContact CE-OE1 3.17Å; K488-E492 WeakPolarHBondContact CG-OE1 3.31Å; K488-E492 WeakPolarHBondContact O-CG 3.18Å; K488-E492 PolarHBondContact O-N 2.91Å; K488-E492 VanDerWaalsContact O-N 3.07Å
489	L	98.2	Very high	96.9	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-59	-50.4	-178.4	-175.5	149.8	0	0	0	112.2	Y423 A485 M486 S491 E492 C493 V507 T510 L511	Y423-L489 HydrophobicContact CE1-CD2 4.37Å; A485-L489 WeakPolarHBondContact O-CB 3.37Å; A485-L489 PolarHBondContact O-N 2.96Å; M486-L489 PolarHBondContact O-N 3.49Å; L489-S491 VanDerWaalsContact C-N 3.29Å; L489-S491 PolarHBondContact O-N 3.29Å; L489-E492 PolarHBondContact O-N 2.71Å; L489-C493 PolarHBondContact O-N 3.38Å; L489-C493 VanDerWaalsContact O-N 3.08Å; L489-C493 PolarHBondContact O-SG 2.86Å; L489-V507 HydrophobicContact CD1-CG1 4.25Å; L489-V507 HydrophobicContact CD2-CG1 4.14Å; L489-V507 HydrophobicContact CD2-CG2 4.46Å; L489-V507 HydrophobicContact CG-CG2 4.5Å; L489-T510 HydrophobicContact CD1-CG2 3.98Å; L489-L511 HydrophobicContact CD1-CD1 4.49Å; L489-L511 HydrophobicContact CD1-CD2 4Å; L489-L511 HydrophobicContact CD1-CG 3.89Å
490	M	96.6	Very high	97.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.9	-32	179.8	71.2	-175.9	-177	0	0	112.1	V427 W428 V473 W477 M486 L487 K488 E492 C493 W494	V427-M490 HydrophobicContact CB-CB 4.26Å; V427-M490 HydrophobicContact CG1-CB 4.02Å; W428-M490 HydrophobicContact CB-SD 3.7Å; W428-M490 HydrophobicContact CG-SD 4.3Å; V473-M490 HydrophobicContact CG1-CE 4.5Å; V473-M490 HydrophobicContact CG2-CE 3.62Å; W477-M490 HydrophobicContact CE3-CE 3.84Å; W477-M490 HydrophobicContact CH2-CE 3.97Å; W477-M490 HydrophobicContact CH2-SD 4.42Å; W477-M490 HydrophobicContact CZ3-CE 3.17Å; W477-M490 HydrophobicContact CZ3-SD 3.8Å; M486-M490 WeakPolarHBondContact O-CG 3.5Å; M486-M490 PolarHBondContact O-N 2.73Å; L487-M490 HydrophobicContact CB-CE 4.19Å; L487-M490 HydrophobicContact CD1-CE 3.27Å; L487-M490 HydrophobicContact CG-CE 4.33Å; L487-M490 WeakPolarHBondContact O-CG 3.28Å; K488-M490 PolarHBondContact O-N 2.85Å; M490-E492 PolarHBondContact O-N 2.82Å; M490-C493 WeakPolarHBondContact O-CB 3.39Å; M490-C493 PolarHBondContact O-N 2.93Å; M490-C493 VanDerWaalsContact O-N 3.13Å; M490-W494 HydrophobicContact CE-CH2 3.75Å; M490-W494 HydrophobicContact CE-CZ2 4.11Å; M490-W494 HydrophobicContact CG-CH2 3.92Å; M490-W494 HydrophobicContact CG-CZ2 4.04Å; M490-W494 HydrophobicContact CG-CZ3 4.28Å; M490-W494 VanDerWaalsContact O-CG 3.27Å; M490-W494 PolarHBondContact O-N 2.98Å; M490-W494 HydrophobicContact SD-CH2 3.72Å; M490-W494 HydrophobicContact SD-CZ2 4.35Å; M490-W494 HydrophobicContact SD-CZ3 4.12Å
491	S	97.9	Very high	97.4	Very high	47 Å²	47	46.6 Å²	46.6	33%	0.329	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-40.3	176.9	-61.7	0	0	0	0	112.8	L487 K488 L489 C493 W494 A495	L487-S491 VanDerWaalsContact O-CB 3.24Å; L487-S491 WeakPolarHBondContact O-CB 3.3Å; L487-S491 PolarHBondContact O-N 3.48Å; L487-S491 PolarHBondContact O-OG 2.74Å; K488-S491 PolarHBondContact O-N 3.3Å; L489-S491 VanDerWaalsContact C-N 3.29Å; L489-S491 PolarHBondContact O-N 3.29Å; S491-C493 VanDerWaalsContact C-N 3.33Å; S491-W494 VanDerWaalsContact O-CD1 3.26Å; S491-A495 PolarHBondContact O-N 2.98Å
492	E	98.4	Very high	97.6	Very high	72 Å²	72	42.8 Å²	42.8	34%	0.336	24%	0.236	S	C	.	.	H	α-helix	trans	-74.8	-23.2	174.3	-62.8	172	-171.1	0	0	111.7	K488 L489 M490 R501 L502	K488-E492 WeakPolarHBondContact CE-OE1 3.17Å; K488-E492 WeakPolarHBondContact CG-OE1 3.31Å; K488-E492 WeakPolarHBondContact O-CG 3.18Å; K488-E492 PolarHBondContact O-N 2.91Å; K488-E492 VanDerWaalsContact O-N 3.07Å; L489-E492 PolarHBondContact O-N 2.71Å; M490-E492 PolarHBondContact O-N 2.82Å; E492-R501 VanDerWaalsContact O-CA 3.27Å; E492-R501 WeakPolarHBondContact O-CA 3.47Å; E492-L502 HydrophobicContact CB-CD1 3.85Å; E492-L502 HydrophobicContact CB-CD2 4.28Å; E492-L502 HydrophobicContact CB-CG 3.68Å; E492-L502 PolarHBondContact O-N 2.74Å; E492-L502 WeakPolarHBondContact OE2-CD1 3.47Å; E492-L502 WeakPolarHBondContact OE2-CD2 3.39Å
493	C	98.7	Very high	97.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-75.4	-38.8	174.6	-68	0	0	0	0	112.9	M420 Y421 L489 M490 S491 R501	M420-C493 CarbonylContact C-O 3.53Å; M420-C493 WeakPolarHBondContact O-CB 3.31Å; Y421-C493 WeakPolarHBondContact CA-O 3Å; Y421-C493 PolarHBondContact N-O 3.49Å; L489-C493 PolarHBondContact O-N 3.38Å; L489-C493 VanDerWaalsContact O-N 3.08Å; L489-C493 PolarHBondContact O-SG 2.86Å; M490-C493 WeakPolarHBondContact O-CB 3.39Å; M490-C493 PolarHBondContact O-N 2.93Å; M490-C493 VanDerWaalsContact O-N 3.13Å; S491-C493 VanDerWaalsContact C-N 3.33Å; C493-R501 VanDerWaalsContact O-CD 3.24Å; C493-R501 WeakPolarHBondContact O-CD 3.42Å; C493-R501 VanDerWaalsContact O-CG 3.3Å; C493-R501 WeakPolarHBondContact O-CG 3.17Å
494	W	98.1	Very high	97.9	Very high	16 Å²	16	47.3 Å²	47.3	6%	0.061	26%	0.263	C	S	.	.	S	Bend	trans	-98.6	20	-176.7	66.9	27.9	0	0	0	114.4	Y421 L425 W428 R470 P471 M490 S491	Y421-W494 HydrophobicContact CD2-CB 3.77Å; Y421-W494 HydrophobicContact CE2-CB 3.98Å; L425-W494 HydrophobicContact CD2-CE3 3.69Å; L425-W494 HydrophobicContact CD2-CZ3 4.08Å; L425-W494 HydrophobicContact CG-CE3 4.48Å; W428-W494 HydrophobicContact CB-CH2 4.17Å; W428-W494 HydrophobicContact CB-CZ3 3.75Å; W428-W494 AromaticContact CD1-CH2 3.81Å; W428-W494 HydrophobicContact CG-CH2 4.21Å; W428-W494 HydrophobicContact CG-CZ3 4.12Å; R470-W494 HydrophobicContact CB-CZ2 4.28Å; R470-W494 HydrophobicContact CG-CD2 4.46Å; R470-W494 HydrophobicContact CG-CG 4.39Å; R470-W494 PolarHBondContact NE-O 2.9Å; R470-W494 PolarHBondContact NH2-O 2.91Å; P471-W494 HydrophobicContact CB-CH2 4.4Å; P471-W494 HydrophobicContact CB-CZ3 4.38Å; P471-W494 HydrophobicContact CG-CH2 4.35Å; P471-W494 HydrophobicContact CG-CZ3 3.91Å; M490-W494 HydrophobicContact CE-CH2 3.75Å; M490-W494 HydrophobicContact CE-CZ2 4.11Å; M490-W494 HydrophobicContact CG-CH2 3.92Å; M490-W494 HydrophobicContact CG-CZ2 4.04Å; M490-W494 HydrophobicContact CG-CZ3 4.28Å; M490-W494 VanDerWaalsContact O-CG 3.27Å; M490-W494 PolarHBondContact O-N 2.98Å; M490-W494 HydrophobicContact SD-CH2 3.72Å; M490-W494 HydrophobicContact SD-CZ2 4.35Å; M490-W494 HydrophobicContact SD-CZ3 4.12Å; S491-W494 VanDerWaalsContact O-CD1 3.26Å
495	A	98.4	Very high	97.9	Very high	23 Å²	23	45.7 Å²	45.7	19%	0.19	26%	0.263	C	S	.	.			trans	-52	143.1	175.2	0	0	0	0	0	110.8	S491 R501	S491-A495 PolarHBondContact O-N 2.98Å; A495-R501 HydrophobicContact CB-CG 4.13Å; A495-R501 PolarHBondContact O-NE 3.4Å; A495-R501 PolarHBondContact O-NH2 2.65Å
496	H	97.7	Very high	98	Very high	98 Å²	98	50.9 Å²	50.9	45%	0.454	27%	0.274	S	S	.	.	S	Bend	trans	-60.8	-53.3	-177.4	-174.5	95.2	0	0	0	110.8	P498 R501	H496-P498 WeakPolarHBondContact O-CD 3.09Å; H496-R501 PolarHBondContact O-NH2 2.84Å; H496-R501 VanDerWaalsContact O-NH2 3.09Å
497	N	97.8	Very high	98	Very high	86 Å²	86	50.9 Å²	50.9	46%	0.46	27%	0.274	S	S	.	.	S	Bend	trans	-67.7	120.5	173.7	-177.5	-5.2	0	0	0	110.9	A499 S500	N497-A499 VanDerWaalsContact C-N 3.29Å; N497-A499 PolarHBondContact O-N 3.23Å; N497-A499 PolarHBondContact OD1-N 3.48Å; N497-S500 PolarHBondContact O-N 3.25Å; N497-S500 VanDerWaalsContact O-N 3.15Å
498	P	97.8	Very high	98	Very high	29 Å²	29	52.3 Å²	52.3	19%	0.188	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-54.8	-41.1	177.7	-25.8	35.2	0	0	0	113.5	E401 M417 H496 S500 R501	E401-P498 HydrophobicContact CB-CG 4.34Å; E401-P498 HydrophobicContact CG-CG 4.04Å; M417-P498 HydrophobicContact CB-CB 3.87Å; M417-P498 HydrophobicContact CE-CB 3.77Å; M417-P498 HydrophobicContact CG-CB 4.41Å; M417-P498 HydrophobicContact SD-CB 3.75Å; H496-P498 WeakPolarHBondContact O-CD 3.09Å; P498-S500 PolarHBondContact O-N 3.29Å; P498-R501 VanDerWaalsContact O-CB 3.3Å; P498-R501 WeakPolarHBondContact O-CB 3.05Å; P498-R501 WeakPolarHBondContact O-CG 3.43Å; P498-R501 PolarHBondContact O-N 2.76Å
499	A	96.8	Very high	98	Very high	78 Å²	78	52.3 Å²	52.3	65%	0.645	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-68.3	-17.3	-176.7	0	0	0	0	0	113.7	N497 R501	N497-A499 VanDerWaalsContact C-N 3.29Å; N497-A499 PolarHBondContact O-N 3.23Å; N497-A499 PolarHBondContact OD1-N 3.48Å; A499-R501 VanDerWaalsContact C-N 3.32Å
500	S	97.6	Very high	98.1	Very high	74 Å²	74	54.1 Å²	54.1	52%	0.517	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-85.2	-7.6	175.1	-55.9	0	0	0	0	112.9	N497 P498	N497-S500 PolarHBondContact O-N 3.25Å; N497-S500 VanDerWaalsContact O-N 3.15Å; P498-S500 PolarHBondContact O-N 3.29Å
501	R	98.6	Very high	98.1	Very high	16 Å²	16	54.1 Å²	54.1	6%	0.06	29%	0.29	C	S	.	.	S	Bend	trans	-74.8	144.2	-176.7	-60.7	176.5	-170	150.6	13.4	110.9	E401 M417 M420 E492 C493 A495 H496 P498 A499	E401-R501 IonicContact OE1-CZ 3.72Å; E401-R501 IonicContact OE1-NH1 3.56Å; E401-R501 PolarHBondContact OE1-NH1 3.48Å; E401-R501 IonicContact OE1-NH2 3.73Å; E401-R501 IonicContact OE2-CZ 3.83Å; E401-R501 IonicContact OE2-NH1 3.35Å; E401-R501 PolarHBondContact OE2-NH1 3.03Å; E401-R501 IonicContact OE2-NH2 2.77Å; E401-R501 PolarHBondContact OE2-NH2 2.71Å; M417-R501 VanDerWaalsContact C-NH1 3.33Å; M417-R501 VanDerWaalsContact O-CD 3.32Å; M417-R501 WeakPolarHBondContact O-CD 3.28Å; M417-R501 PolarHBondContact O-NH1 3.09Å; M420-R501 HydrophobicContact CB-CB 4.37Å; E492-R501 VanDerWaalsContact O-CA 3.27Å; E492-R501 WeakPolarHBondContact O-CA 3.47Å; C493-R501 VanDerWaalsContact O-CD 3.24Å; C493-R501 WeakPolarHBondContact O-CD 3.42Å; C493-R501 VanDerWaalsContact O-CG 3.3Å; C493-R501 WeakPolarHBondContact O-CG 3.17Å; A495-R501 HydrophobicContact CB-CG 4.13Å; A495-R501 PolarHBondContact O-NE 3.4Å; A495-R501 PolarHBondContact O-NH2 2.65Å; H496-R501 PolarHBondContact O-NH2 2.84Å; H496-R501 VanDerWaalsContact O-NH2 3.09Å; P498-R501 VanDerWaalsContact O-CB 3.3Å; P498-R501 WeakPolarHBondContact O-CB 3.05Å; P498-R501 WeakPolarHBondContact O-CG 3.43Å; P498-R501 PolarHBondContact O-N 2.76Å; A499-R501 VanDerWaalsContact C-N 3.32Å
502	L	98.3	Very high	98.1	Very high	29 Å²	29	52.8 Å²	52.8	15%	0.152	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-60	143.5	172.2	-65.5	179.7	0	0	0	110.7	M420 E492 R506 V507	M420-L502 WeakPolarHBondContact CE-O 3.29Å; M420-L502 WeakPolarHBondContact CG-O 3.48Å; E492-L502 HydrophobicContact CB-CD1 3.85Å; E492-L502 HydrophobicContact CB-CD2 4.28Å; E492-L502 HydrophobicContact CB-CG 3.68Å; E492-L502 PolarHBondContact O-N 2.74Å; E492-L502 WeakPolarHBondContact OE2-CD1 3.47Å; E492-L502 WeakPolarHBondContact OE2-CD2 3.39Å; L502-R506 HydrophobicContact CD2-CG 3.96Å; L502-V507 HydrophobicContact CB-CG2 3.76Å; L502-V507 HydrophobicContact CD1-CG2 3.82Å; L502-V507 HydrophobicContact CG-CG2 4.48Å
503	T	98.1	Very high	98	Very high	90 Å²	90	56.8 Å²	56.8	55%	0.552	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-72	150.3	164.9	66.4	0	0	0	0	110	L505 R506 V507	T503-L505 PolarHBondContact O-N 3.31Å; T503-R506 WeakPolarHBondContact O-CB 3.22Å; T503-R506 PolarHBondContact O-N 3.44Å; T503-R506 WeakPolarHBondContact OG1-CB 3.47Å; T503-R506 PolarHBondContact OG1-N 3.29Å; T503-V507 PolarHBondContact O-N 3.44Å
504	I	98.4	Very high	97.9	Very high	8 Å²	8	57.9 Å²	57.9	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-32.6	179.1	-167.3	55.7	0	0	0	112.8	A329 L332 C333 H336 M420 R506 V507 K508	A329-I504 HydrophobicContact CB-CD1 3.95Å; L332-I504 HydrophobicContact CB-CD1 4.05Å; L332-I504 HydrophobicContact CB-CG1 3.87Å; L332-I504 HydrophobicContact CD2-CD1 3.78Å; L332-I504 HydrophobicContact CD2-CG1 4.1Å; L332-I504 HydrophobicContact CG-CD1 4.15Å; L332-I504 HydrophobicContact CG-CG1 3.94Å; C333-I504 HydrophobicContact CB-CG1 3.95Å; C333-I504 HydrophobicContact CB-CG2 3.95Å; H336-I504 HydrophobicContact CB-CG2 3.96Å; H336-I504 WeakPolarHBondContact ND1-CG2 3.46Å; M420-I504 HydrophobicContact CE-CB 4.26Å; M420-I504 HydrophobicContact CE-CD1 3.94Å; M420-I504 HydrophobicContact SD-CB 3.57Å; M420-I504 VanDerWaalsContact SD-CB 3.57Å; M420-I504 HydrophobicContact SD-CD1 3.95Å; M420-I504 HydrophobicContact SD-CG1 4.26Å; I504-R506 VanDerWaalsContact C-N 3.31Å; I504-R506 PolarHBondContact O-N 2.95Å; I504-V507 HydrophobicContact CD1-CB 4.22Å; I504-V507 HydrophobicContact CD1-CG1 4.2Å; I504-V507 PolarHBondContact O-N 3.45Å; I504-K508 WeakPolarHBondContact O-CB 3.31Å; I504-K508 PolarHBondContact O-N 3.46Å
505	L	98.1	Very high	97.6	Very high	82 Å²	82	58.9 Å²	58.9	43%	0.429	31%	0.312	S	S	.	.	H	α-helix	trans	-63.5	-38.8	174.7	-179.5	60.9	0	0	0	111.4	T503 K509	T503-L505 PolarHBondContact O-N 3.31Å; L505-K509 WeakPolarHBondContact O-CG 3.48Å; L505-K509 PolarHBondContact O-N 2.72Å
506	R	98.4	Very high	97.3	Very high	149 Å²	149	63.9 Å²	63.9	56%	0.562	33%	0.331	S	S	*	.	H	α-helix	trans	-65.7	-45.9	175.1	179.6	56.7	173.1	-172.4	-0.8	110.8	L502 T503 I504 K509 T510	L502-R506 HydrophobicContact CD2-CG 3.96Å; T503-R506 WeakPolarHBondContact O-CB 3.22Å; T503-R506 PolarHBondContact O-N 3.44Å; T503-R506 WeakPolarHBondContact OG1-CB 3.47Å; T503-R506 PolarHBondContact OG1-N 3.29Å; I504-R506 VanDerWaalsContact C-N 3.31Å; I504-R506 PolarHBondContact O-N 2.95Å; R506-K509 PolarHBondContact O-N 3.23Å; R506-T510 PolarHBondContact O-N 2.97Å; R506-T510 PolarHBondContact O-OG1 3.27Å
507	V	98.6	Very high	96.8	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.1	-49.4	175	166.6	0	0	0	0	111.4	A329 M420 Y423 L489 L502 T503 I504 K509 T510 L511	A329-V507 HydrophobicContact CB-CG1 4.09Å; M420-V507 HydrophobicContact CE-CB 4.46Å; M420-V507 HydrophobicContact CE-CG2 3.73Å; Y423-V507 HydrophobicContact CD1-CG1 4.4Å; Y423-V507 HydrophobicContact CE1-CG1 3.56Å; L489-V507 HydrophobicContact CD1-CG1 4.25Å; L489-V507 HydrophobicContact CD2-CG1 4.14Å; L489-V507 HydrophobicContact CD2-CG2 4.46Å; L489-V507 HydrophobicContact CG-CG2 4.5Å; L502-V507 HydrophobicContact CB-CG2 3.76Å; L502-V507 HydrophobicContact CD1-CG2 3.82Å; L502-V507 HydrophobicContact CG-CG2 4.48Å; T503-V507 PolarHBondContact O-N 3.44Å; I504-V507 HydrophobicContact CD1-CB 4.22Å; I504-V507 HydrophobicContact CD1-CG1 4.2Å; I504-V507 PolarHBondContact O-N 3.45Å; V507-K509 PolarHBondContact O-N 2.67Å; V507-T510 PolarHBondContact O-N 3.37Å; V507-L511 HydrophobicContact CG1-CD1 3.73Å; V507-L511 HydrophobicContact CG1-CG 4.44Å; V507-L511 WeakPolarHBondContact O-CG 3.3Å; V507-L511 PolarHBondContact O-N 3.46Å
508	K	98.4	Very high	95.9	Very high	61 Å²	61	59.1 Å²	59.1	27%	0.265	31%	0.312	S	S	.	.	H	α-helix	trans	-55.4	-48.4	177	177.8	-176.2	170.4	176.4	0	111.6	Y326 A329 C330 C333 I504 L511 A512	Y326-K508 HydrophobicContact CD2-CG 4.38Å; Y326-K508 HydrophobicContact CE2-CG 3.7Å; Y326-K508 WeakPolarHBondContact CE2-O 3.13Å; A329-K508 HydrophobicContact CB-CB 4.42Å; C330-K508 VanDerWaalsContact SG-CE 3.54Å; C333-K508 HydrophobicContact CB-CD 4.24Å; I504-K508 WeakPolarHBondContact O-CB 3.31Å; I504-K508 PolarHBondContact O-N 3.46Å; K508-L511 PolarHBondContact O-N 3.2Å; K508-A512 WeakPolarHBondContact O-CB 3.48Å; K508-A512 PolarHBondContact O-N 2.96Å
509	K	98.2	Very high	94.7	Very high	134 Å²	134	62.4 Å²	62.4	58%	0.583	33%	0.327	S	S	*	.	H	α-helix	trans	-63.6	-40.9	178.5	-74.7	-178.1	177.6	-175.7	0	112.4	L505 R506 V507 K513	L505-K509 WeakPolarHBondContact O-CG 3.48Å; L505-K509 PolarHBondContact O-N 2.72Å; R506-K509 PolarHBondContact O-N 3.23Å; V507-K509 PolarHBondContact O-N 2.67Å; K509-K513 PolarHBondContact O-N 3.27Å; K509-K513 VanDerWaalsContact O-N 3.15Å
510	T	98.3	Very high	92.8	Very high	44 Å²	44	66.5 Å²	66.5	27%	0.27	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-47.4	176.5	-58.5	0	0	0	0	110.9	L489 R506 V507 K513 M514	L489-T510 HydrophobicContact CD1-CG2 3.98Å; R506-T510 PolarHBondContact O-N 2.97Å; R506-T510 PolarHBondContact O-OG1 3.27Å; V507-T510 PolarHBondContact O-N 3.37Å; T510-K513 PolarHBondContact O-N 3.32Å; T510-M514 HydrophobicContact CG2-SD 4.1Å; T510-M514 VanDerWaalsContact O-CG 3.3Å; T510-M514 WeakPolarHBondContact O-CG 3.27Å; T510-M514 PolarHBondContact O-N 3.08Å; T510-M514 VanDerWaalsContact O-N 3.07Å
511	L	98.3	Very high	90.9	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.9	-40.4	178.5	-71.7	169.1	0	0	0	112.2	L322 A325 Y326 A329 Y423 M486 L489 V507 K508 K513 M514 V515	L322-L511 HydrophobicContact CD2-CD2 4.09Å; A325-L511 HydrophobicContact CB-CD1 4.08Å; A325-L511 HydrophobicContact CB-CD2 4.16Å; Y326-L511 HydrophobicContact CD2-CB 3.85Å; Y326-L511 HydrophobicContact CG-CB 4.47Å; A329-L511 HydrophobicContact CB-CD1 4Å; Y423-L511 WeakPolarHBondContact OH-CD1 3.01Å; M486-L511 HydrophobicContact CE-CD2 4.28Å; M486-L511 HydrophobicContact SD-CD2 3.66Å; L489-L511 HydrophobicContact CD1-CD1 4.49Å; L489-L511 HydrophobicContact CD1-CD2 4Å; L489-L511 HydrophobicContact CD1-CG 3.89Å; V507-L511 HydrophobicContact CG1-CD1 3.73Å; V507-L511 HydrophobicContact CG1-CG 4.44Å; V507-L511 WeakPolarHBondContact O-CG 3.3Å; V507-L511 PolarHBondContact O-N 3.46Å; K508-L511 PolarHBondContact O-N 3.2Å; L511-K513 VanDerWaalsContact C-N 3.33Å; L511-K513 PolarHBondContact O-N 2.65Å; L511-M514 HydrophobicContact CD2-SD 4.35Å; L511-M514 WeakPolarHBondContact O-CB 3.49Å; L511-M514 PolarHBondContact O-N 3.2Å; L511-M514 VanDerWaalsContact O-N 3.11Å; L511-V515 WeakPolarHBondContact O-CG2 3.22Å; L511-V515 PolarHBondContact O-N 3.46Å
512	A	97.2	Very high	88.3	Confident	20 Å²	20	76.7 Å²	76.7	17%	0.165	38%	0.378	C	S	.	.	H	α-helix	trans	-56.1	-48.1	174.4	0	0	0	0	0	111.6	Y326 K508 M514 V515 E516	Y326-A512 HydrophobicContact CD2-CB 4.36Å; Y326-A512 HydrophobicContact CE2-CB 3.7Å; K508-A512 WeakPolarHBondContact O-CB 3.48Å; K508-A512 PolarHBondContact O-N 2.96Å; A512-M514 VanDerWaalsContact C-N 3.27Å; A512-M514 PolarHBondContact O-N 3.39Å; A512-V515 WeakPolarHBondContact O-CB 3.46Å; A512-V515 PolarHBondContact O-N 3.49Å; A512-V515 VanDerWaalsContact O-N 3.14Å; A512-E516 WeakPolarHBondContact O-CG 3.49Å; A512-E516 PolarHBondContact O-N 3.24Å
513	K	96.6	Very high	87.8	Confident	155 Å²	155	79.1 Å²	79.1	67%	0.674	39%	0.389	S	S	*	.	H	α-helix	trans	-61.6	-35.5	176.8	-174.2	177.1	179	178.9	0	112.6	K509 T510 L511 S517	K509-K513 PolarHBondContact O-N 3.27Å; K509-K513 VanDerWaalsContact O-N 3.15Å; T510-K513 PolarHBondContact O-N 3.32Å; L511-K513 VanDerWaalsContact C-N 3.33Å; L511-K513 PolarHBondContact O-N 2.65Å; K513-S517 WeakPolarHBondContact O-CB 3.49Å; K513-S517 PolarHBondContact O-N 2.88Å; K513-S517 VanDerWaalsContact O-N 3.07Å; K513-S517 PolarHBondContact O-OG 3.17Å
514	M	95.9	Very high	87.3	Confident	23 Å²	23	78.5 Å²	78.5	11%	0.113	38%	0.38	C	S	.	.	H	α-helix	trans	-71.4	-35	176.3	-67.4	171.1	67.1	0	0	112.3	L322 A485 M486 T510 L511 A512 S517 Q518	L322-M514 HydrophobicContact CD1-CB 4.06Å; L322-M514 WeakPolarHBondContact CD1-O 3.08Å; L322-M514 HydrophobicContact CD2-CB 4.04Å; L322-M514 HydrophobicContact CD2-CE 3.7Å; L322-M514 HydrophobicContact CD2-SD 4.49Å; A485-M514 HydrophobicContact CB-CE 3.39Å; A485-M514 HydrophobicContact CB-SD 4.05Å; M486-M514 HydrophobicContact CG-CE 4.09Å; M486-M514 HydrophobicContact SD-CE 4Å; T510-M514 HydrophobicContact CG2-SD 4.1Å; T510-M514 VanDerWaalsContact O-CG 3.3Å; T510-M514 WeakPolarHBondContact O-CG 3.27Å; T510-M514 PolarHBondContact O-N 3.08Å; T510-M514 VanDerWaalsContact O-N 3.07Å; L511-M514 HydrophobicContact CD2-SD 4.35Å; L511-M514 WeakPolarHBondContact O-CB 3.49Å; L511-M514 PolarHBondContact O-N 3.2Å; L511-M514 VanDerWaalsContact O-N 3.11Å; A512-M514 VanDerWaalsContact C-N 3.27Å; A512-M514 PolarHBondContact O-N 3.39Å; M514-S517 PolarHBondContact O-OG 3.23Å; M514-S517 VanDerWaalsContact O-OG 3.06Å; M514-Q518 WeakPolarHBondContact O-CG 3.35Å; M514-Q518 PolarHBondContact O-N 3.16Å
515	V	92.9	Very high	86.7	Confident	38 Å²	38	82.4 Å²	82.4	23%	0.23	40%	0.399	C	S	.	.	H	α-helix	trans	-64.4	-50.5	173.6	171.9	0	0	0	0	109.6	L322 L511 A512 S517 Q518 D519	L322-V515 HydrophobicContact CB-CG2 3.73Å; L322-V515 HydrophobicContact CD1-CG2 4.47Å; L511-V515 WeakPolarHBondContact O-CG2 3.22Å; L511-V515 PolarHBondContact O-N 3.46Å; A512-V515 WeakPolarHBondContact O-CB 3.46Å; A512-V515 PolarHBondContact O-N 3.49Å; A512-V515 VanDerWaalsContact O-N 3.14Å; V515-S517 VanDerWaalsContact C-N 3.28Å; V515-S517 PolarHBondContact O-N 3.15Å; V515-Q518 PolarHBondContact O-N 3.45Å; V515-Q518 VanDerWaalsContact O-N 3.07Å; V515-D519 PolarHBondContact O-N 3.27Å
516	E	90.8	Very high	86	Confident	128 Å²	128	82.5 Å²	82.5	60%	0.598	40%	0.397	S	S	*	.	H	α-helix	trans	-57.1	-40.2	178	-70.4	168.2	-171.8	0	0	112.2	A512 Q518 D519 M520	A512-E516 WeakPolarHBondContact O-CG 3.49Å; A512-E516 PolarHBondContact O-N 3.24Å; E516-Q518 VanDerWaalsContact C-N 3.32Å; E516-Q518 PolarHBondContact O-N 3.49Å; E516-D519 PolarHBondContact O-N 3.38Å; E516-M520 WeakPolarHBondContact O-CG 3.45Å; E516-M520 PolarHBondContact O-N 3.29Å
517	S	87.1	Confident	85.2	Confident	46 Å²	46	78.3 Å²	78.3	32%	0.322	39%	0.387	S	S	.	.	H	α-helix	trans	-73.3	-21.2	179.5	72.3	0	0	0	0	114.3	K513 M514 V515 K521	K513-S517 WeakPolarHBondContact O-CB 3.49Å; K513-S517 PolarHBondContact O-N 2.88Å; K513-S517 VanDerWaalsContact O-N 3.07Å; K513-S517 PolarHBondContact O-OG 3.17Å; M514-S517 PolarHBondContact O-OG 3.23Å; M514-S517 VanDerWaalsContact O-OG 3.06Å; V515-S517 VanDerWaalsContact C-N 3.28Å; V515-S517 PolarHBondContact O-N 3.15Å; S517-K521 WeakPolarHBondContact O-CG 3.49Å
518	Q	78.7	Confident	84.3	Confident	38 Å²	38	83.5 Å²	83.5	18%	0.178	41%	0.413	C	S	.	.	H	α-helix	trans	-79.7	-41.3	172.2	-71.7	-66.5	-38.3	0	0	111.2	L322 M514 V515 E516 M520 K521 I522	L322-Q518 HydrophobicContact CD1-CB 4.47Å; L322-Q518 HydrophobicContact CD1-CG 3.59Å; M514-Q518 WeakPolarHBondContact O-CG 3.35Å; M514-Q518 PolarHBondContact O-N 3.16Å; V515-Q518 PolarHBondContact O-N 3.45Å; V515-Q518 VanDerWaalsContact O-N 3.07Å; E516-Q518 VanDerWaalsContact C-N 3.32Å; E516-Q518 PolarHBondContact O-N 3.49Å; Q518-M520 PolarHBondContact O-N 3.2Å; Q518-K521 PolarHBondContact O-N 3.07Å; Q518-I522 PolarHBondContact O-N 3.28Å
519	D	73.1	Confident	83.3	Confident	97 Å²	97	85.1 Å²	85.1	52%	0.519	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-27	177.9	-69.8	-20.1	0	0	0	112	V515 E516 K521	V515-D519 PolarHBondContact O-N 3.27Å; E516-D519 PolarHBondContact O-N 3.38Å; D519-K521 VanDerWaalsContact C-N 3.34Å
520	M	57.7	Low	82.2	Confident	164 Å²	164	81.4 Å²	81.4	81%	0.808	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-13.8	172.7	-70.1	-175.8	70.9	0	0	114.8	E516 Q518	E516-M520 WeakPolarHBondContact O-CG 3.45Å; E516-M520 PolarHBondContact O-N 3.29Å; Q518-M520 PolarHBondContact O-N 3.2Å
521	K	56.2	Low	80.8	Confident	122 Å²	122	84.5 Å²	84.5	53%	0.53	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-9.6	-178.8	-73.5	178.3	-179.9	-179.1	0	113.2	E481 S517 Q518 D519	E481-K521 IonicContact OE1-NZ 2.75Å; E481-K521 IonicContact OE2-NZ 2.84Å; E481-K521 PolarHBondContact OE2-NZ 3.33Å; S517-K521 WeakPolarHBondContact O-CG 3.49Å; Q518-K521 PolarHBondContact O-N 3.07Å; D519-K521 VanDerWaalsContact C-N 3.34Å
522	I	45.3	Very low	79.2	Confident	183 Å²	183	92.2 Å²	92.2	94%	0.938	46%	0.461	S	S	*	.			trans	-93.2	0	172.4	-58.2	172.1	0	0	0	107.7	Q518	Q518-I522 PolarHBondContact O-N 3.28Å

Retrieved 522 of 522 residues in 313.6 ms (Link to these results)

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