A0A087XGH1_POEFO Loading...

Vesicle amine transport 1

AlphaFold DB (A0A3B3U6Q7), UniProt , Accession A0A087XGH1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 441 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	36.6	Very low	236 Å²	236	152.5 Å²	152.5	100%	1.163	88%	0.875	S	S	*	*				0	98	0	-72.8	179.3	173.6	0	0	105.6
2	M	34.1	Very low	36.5	Very low	186 Å²	186	156.2 Å²	156.2	92%	0.916	88%	0.879	S	S	*	*				68.5	132.2	107.9	-81.5	-177.4	167.1	0	0	111.5
3	S	36.1	Very low	36.3	Very low	115 Å²	115	159 Å²	159	80%	0.804	88%	0.88	S	S	*	*			cis	171.5	139.6	-12.4	37.4	0	0	0	0	103.3
4	G	35.1	Very low	36.1	Very low	81 Å²	81	160.6 Å²	160.6	84%	0.835	88%	0.878	S	S	*	*			trans	-178.2	94	175.5	0	0	0	0	0	110
5	E	34.2	Very low	36	Very low	199 Å²	199	158.5 Å²	158.5	93%	0.93	88%	0.875	S	S	*	*			trans	-75.2	138.7	175.3	-68.7	166.4	133.8	0	0	110
6	E	38.5	Very low	35.9	Very low	199 Å²	199	160.1 Å²	160.1	93%	0.93	87%	0.874	S	S	*	*			trans	-136.3	135.4	160.4	-112.8	-178.5	172.6	0	0	108.9
7	E	36.2	Very low	35.6	Very low	197 Å²	197	162.3 Å²	162.3	92%	0.921	88%	0.877	S	S	*	*	P	Polyproline II helix	trans	-69.9	145	-161.2	-69.5	172.6	128.7	0	0	115
8	A	39.7	Very low	35.5	Very low	90 Å²	90	160.4 Å²	160.4	74%	0.744	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-86.8	150.5	173.5	0	0	0	0	0	112.2
9	P	39.3	Very low	35.2	Very low	128 Å²	128	162.5 Å²	162.5	83%	0.831	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-79.1	143.9	-177.8	31.7	-32.8	0	0	0	112.9
10	T	36.7	Very low	35	Very low	134 Å²	134	163.6 Å²	163.6	82%	0.822	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-69.8	135.1	-174.1	-35.1	0	0	0	0	113.1
11	P	37.6	Very low	34.8	Very low	112 Å²	112	161.7 Å²	161.7	73%	0.727	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-78.3	139	172.3	-9.5	25.8	0	0	0	112.6
12	Q	35	Very low	34.7	Very low	197 Å²	197	157.6 Å²	157.6	92%	0.921	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-66.6	133	170.7	-74.8	173.5	-28.4	0	0	110.9
13	Q	34.4	Very low	34.9	Very low	193 Å²	193	157.3 Å²	157.3	90%	0.902	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-77.5	130.7	-177.6	-71.2	172.6	-48	0	0	112.1
14	E	34	Very low	35.1	Very low	182 Å²	182	157.6 Å²	157.6	85%	0.85	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-71.9	144.2	162.4	-69.7	178.3	144.4	0	0	110.4
15	P	34.8	Very low	35.3	Very low	128 Å²	128	159.4 Å²	159.4	83%	0.831	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-79.6	130	171.8	22.7	-18.1	0	0	0	112
16	E	33.6	Very low	35.4	Very low	184 Å²	184	155.7 Å²	155.7	86%	0.86	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-57.6	140.3	-178.7	-73.7	178.3	131.3	0	0	114.8
17	Q	30.3	Very low	35.3	Very low	198 Å²	198	151.4 Å²	151.4	93%	0.925	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-71.2	119.4	164.3	-70.8	179.3	-5.8	0	0	110.6
18	V	34	Very low	35	Very low	128 Å²	128	146.9 Å²	146.9	78%	0.776	83%	0.826	S	S	*	*			trans	-95.6	113.4	166.1	179.4	0	0	0	0	109.5
19	K	30.7	Very low	34.6	Very low	201 Å²	201	147.6 Å²	147.6	87%	0.874	83%	0.832	S	S	*	*			trans	-62.8	124	166.6	-113.8	175.6	176.9	176.3	0	109.8
20	K	30.3	Very low	34.2	Very low	184 Å²	184	145.8 Å²	145.8	80%	0.8	83%	0.828	S	S	*	*			trans	-129.9	108	156.6	-101.4	-173.9	174.7	-173.9	0	109.4
21	T	31.4	Very low	33.8	Very low	123 Å²	123	144.3 Å²	144.3	76%	0.755	83%	0.829	S	S	*	*			trans	-74.2	132.6	156.9	40.1	0	0	0	0	108.4
22	D	33.7	Very low	33.6	Very low	150 Å²	150	148.3 Å²	148.3	80%	0.802	84%	0.838	S	S	*	*			trans	-148.7	125.3	158.5	-86.7	-41.6	0	0	0	109.9
23	E	37.5	Very low	33.3	Very low	181 Å²	181	148.1 Å²	148.1	85%	0.846	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-65.9	163.1	174.6	-81.7	176.8	137.1	0	0	112.9
24	P	40.7	Very low	33.1	Very low	121 Å²	121	147.3 Å²	147.3	79%	0.786	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-82.9	142.2	-178.7	33.7	-32.1	0	0	0	111.9
25	P	39.7	Very low	33	Very low	119 Å²	119	147.9 Å²	147.9	77%	0.773	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-91.8	163.7	165.7	35.2	-29.1	0	0	0	111.9
26	P	36.2	Very low	32.8	Very low	120 Å²	120	150.6 Å²	150.6	78%	0.779	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-96.9	163.3	-143.7	35.8	-32	0	0	0	114.8
27	A	35.1	Very low	32.7	Very low	109 Å²	109	146.6 Å²	146.6	90%	0.901	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-63.6	130	167.1	0	0	0	0	0	111.3
28	A	30.3	Very low	32.9	Very low	102 Å²	102	146.8 Å²	146.8	84%	0.843	83%	0.831	S	S	*	*			trans	-130.3	125.7	167.7	0	0	0	0	0	109.4
29	A	30.9	Very low	32.9	Very low	106 Å²	106	146.4 Å²	146.4	88%	0.876	83%	0.832	S	S	*	*			trans	-81.6	141	174.1	0	0	0	0	0	111.1
30	A	30.3	Very low	33	Very low	89 Å²	89	141.7 Å²	141.7	74%	0.736	83%	0.83	S	S	*	*			trans	-161.4	105.5	156.2	0	0	0	0	0	104.9
31	A	30	Very low	33.3	Very low	103 Å²	103	138.9 Å²	138.9	85%	0.851	83%	0.834	S	S	*	*				53.1	87.6	82.7	0	0	0	0	0	111.7
32	E	32.2	Very low	33.4	Very low	196 Å²	196	136.5 Å²	136.5	92%	0.916	83%	0.834	S	S	*	*			trans	-125.9	143	159.6	-77.7	-172.2	167.6	0	0	109.5
33	E	30	Very low	33.6	Very low	194 Å²	194	135.7 Å²	135.7	91%	0.907	84%	0.839	S	S	*	*			trans	-77	143.7	-152.4	-68.1	168.3	133	0	0	114.8	E35	E33-E35 PolarHBondContact O-N 3.41Å
34	E	30.2	Very low	33.4	Very low	175 Å²	175	130 Å²	130	82%	0.818	83%	0.829	S	S	*	*			trans	-68.1	111.1	160.5	-76.2	-174	144.4	0	0	110.1
35	E	30.4	Very low	33	Very low	194 Å²	194	129.7 Å²	129.7	91%	0.907	83%	0.83	S	S	*	*			trans	-100.4	105.8	159.7	-152.8	176.9	-171.4	0	0	110.3	E33 A37	E33-E35 PolarHBondContact O-N 3.41Å; E35-A37 PolarHBondContact O-N 3.36Å
36	K	30.9	Very low	33.1	Very low	185 Å²	185	129.9 Å²	129.9	80%	0.804	83%	0.831	S	S	*	*			trans	-72.3	109.9	173	-84.2	173.4	175.6	160.4	0	110.6
37	A	31.4	Very low	33.3	Very low	101 Å²	101	128.5 Å²	128.5	84%	0.835	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-103.2	117.5	156.6	0	0	0	0	0	110.3	E35	E35-A37 PolarHBondContact O-N 3.36Å
38	K	34.4	Very low	33.6	Very low	202 Å²	202	128.3 Å²	128.3	88%	0.878	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-74.1	157.1	172.5	-99.3	-176.9	177.4	179.8	0	111.3
39	P	34.8	Very low	34.5	Very low	120 Å²	120	127.9 Å²	127.9	78%	0.779	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-83.6	140.7	-162.2	33.5	-33.4	0	0	0	112.6
40	A	33.3	Very low	35.5	Very low	102 Å²	102	131.2 Å²	131.2	84%	0.843	82%	0.816	S	S	*	*			trans	-85.3	114.8	161.2	0	0	0	0	0	108.8	G42	A40-G42 PolarHBondContact O-N 3.36Å
41	S	36.3	Very low	36.9	Very low	125 Å²	125	135.4 Å²	135.4	87%	0.874	82%	0.821	S	S	*	*			trans	-66.2	105.1	173.7	53.8	0	0	0	0	110.8
42	G	33.4	Very low	38.8	Very low	73 Å²	73	135.5 Å²	135.5	75%	0.753	80%	0.803	S	S	*	*			trans	-114.1	101.1	161.8	0	0	0	0	0	108.7	A40 G44	A40-G42 PolarHBondContact O-N 3.36Å; G42-G44 VanDerWaalsContact C-N 3.34Å; G42-G44 PolarHBondContact O-N 3.4Å
43	S	37.3	Very low	41.1	Very low	132 Å²	132	135.3 Å²	135.3	92%	0.923	80%	0.799	S	S	*	*			trans	-69.1	87.9	174.3	58.5	0	0	0	0	110.2
44	G	33.3	Very low	43.8	Very low	62 Å²	62	129.3 Å²	129.3	64%	0.639	78%	0.777	S	S	*	*			trans	-105.6	112.9	154.1	0	0	0	0	0	107	G42	G42-G44 VanDerWaalsContact C-N 3.34Å; G42-G44 PolarHBondContact O-N 3.4Å
45	S	33.5	Very low	46.7	Very low	115 Å²	115	123.4 Å²	123.4	80%	0.804	75%	0.751	S	S	*	*			trans	-46.1	129.9	170.7	-66.3	0	0	0	0	109.5	A47	S45-A47 PolarHBondContact O-N 3.47Å
46	P	40.6	Very low	49.8	Very low	122 Å²	122	118.7 Å²	118.7	79%	0.792	74%	0.736	S	S	*	*			trans	-63.3	110.3	160.8	26.5	-27.6	0	0	0	105	S48	P46-S48 PolarHBondContact O-N 3Å
47	A	40.6	Very low	52.9	Low	92 Å²	92	110.8 Å²	110.8	76%	0.76	70%	0.701	S	S	*	*			trans	-48.2	119.4	161.2	0	0	0	0	0	105.3	S45 A49	S45-A47 PolarHBondContact O-N 3.47Å; A47-A49 PolarHBondContact O-N 3.33Å
48	S	41.5	Very low	56.1	Low	105 Å²	105	107.7 Å²	107.7	73%	0.734	67%	0.667	S	S	*	*			trans	-48.5	108.2	175.8	47.5	0	0	0	0	107.3	P46 E50	P46-S48 PolarHBondContact O-N 3Å; S48-E50 PolarHBondContact O-N 3.25Å
49	A	48.6	Very low	59.1	Low	92 Å²	92	98 Å²	98	76%	0.76	63%	0.625	S	S	*	*			trans	-59.7	100.7	166.4	0	0	0	0	0	104.7	A47 E51	A47-A49 PolarHBondContact O-N 3.33Å; A49-E51 PolarHBondContact O-N 3.31Å
50	E	53	Low	62.2	Low	177 Å²	177	92.4 Å²	92.4	83%	0.827	59%	0.589	S	S	*	*			trans	-52.7	111.6	168.4	-71.5	-176.2	159.2	0	0	105.4	S48 E52	S48-E50 PolarHBondContact O-N 3.25Å; E50-E52 PolarHBondContact O-N 3.35Å
51	E	60.2	Low	65.3	Low	177 Å²	177	87.8 Å²	87.8	83%	0.827	55%	0.55	S	S	*	*			trans	-58.3	104.1	175.7	-79.3	-170.6	142.3	0	0	107.2	A49 K53	A49-E51 PolarHBondContact O-N 3.31Å; E51-K53 PolarHBondContact O-N 3.05Å
52	E	68.7	Low	68.2	Low	105 Å²	105	81.9 Å²	81.9	49%	0.491	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-52.6	117.4	177.8	-94.7	-167.3	151.5	0	0	108.6	E50	E50-E52 PolarHBondContact O-N 3.35Å
53	K	81.4	Confident	71.3	Confident	191 Å²	191	81.1 Å²	81.1	83%	0.83	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-57.3	131	176.6	-75.4	-178.5	-179.3	175	0	108.7	E51 I55	E51-K53 PolarHBondContact O-N 3.05Å; K53-I55 PolarHBondContact O-N 3.32Å
54	P	86.3	Confident	74.1	Confident	68 Å²	68	75.7 Å²	75.7	44%	0.442	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-64.1	133.6	-179.3	26.7	-33.8	0	0	0	110.1	T56 M78	P54-T56 PolarHBondContact O-N 3.48Å; P54-M78 CarbonylContact C-O 3.5Å; P54-M78 WeakPolarHBondContact CA-O 3.26Å
55	I	91.2	Very high	77.1	Confident	52 Å²	52	78.2 Å²	78.2	27%	0.267	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	123.7	176.2	-57.7	171.3	0	0	0	107.4	K53 S77 M78 K80 L155	K53-I55 PolarHBondContact O-N 3.32Å; I55-S77 CarbonylContact O-C 3.59Å; I55-S77 VanDerWaalsContact O-CA 3.24Å; I55-S77 WeakPolarHBondContact O-CA 3.36Å; I55-M78 PolarHBondContact N-O 3.11Å; I55-M78 PolarHBondContact O-N 3.34Å; I55-K80 HydrophobicContact CD1-CB 4.05Å; I55-K80 HydrophobicContact CD1-CD 4.48Å; I55-K80 HydrophobicContact CD1-CG 4.39Å; I55-L155 HydrophobicContact CG2-CD1 3.76Å
56	T	94.8	Very high	79.8	Confident	95 Å²	95	73.1 Å²	73.1	58%	0.583	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	143.3	172.4	56.2	0	0	0	0	110.9	P54 V75 K76	P54-T56 PolarHBondContact O-N 3.48Å; T56-V75 HydrophobicContact CG2-CG1 4.32Å; T56-K76 CarbonylContact C-O 3.5Å; T56-K76 WeakPolarHBondContact CA-O 3.47Å
57	Y	96.4	Very high	82.2	Confident	18 Å²	18	67.5 Å²	67.5	7%	0.071	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	154.8	-179.2	64.4	-90.2	0	0	0	110.9	A59 V75 K76 M78 Q153 E154 L155	Y57-A59 HydrophobicContact CE2-CB 4.48Å; Y57-V75 CarbonylContact O-C 3.57Å; Y57-V75 WeakPolarHBondContact O-CA 3.37Å; Y57-K76 HydrophobicContact CD2-CB 4.26Å; Y57-K76 HydrophobicContact CE1-CB 3.98Å; Y57-K76 HydrophobicContact CE2-CB 3.68Å; Y57-K76 HydrophobicContact CE2-CD 4.06Å; Y57-K76 HydrophobicContact CE2-CG 4.41Å; Y57-K76 PolarHBondContact N-O 3.2Å; Y57-K76 PolarHBondContact O-N 3.04Å; Y57-M78 HydrophobicContact CD1-CG 4.07Å; Y57-M78 HydrophobicContact CD1-SD 4.42Å; Y57-M78 HydrophobicContact CE1-CB 3.88Å; Y57-M78 HydrophobicContact CE1-CG 3.65Å; Y57-M78 HydrophobicContact CE1-SD 3.97Å; Y57-Q153 HydrophobicContact CD2-CB 4.31Å; Y57-Q153 HydrophobicContact CE2-CB 4.23Å; Y57-Q153 VanDerWaalsContact CE2-OE1 3.29Å; Y57-E154 WeakPolarHBondContact CA-OE2 3.42Å; Y57-L155 HydrophobicContact CD1-CB 4.18Å; Y57-L155 HydrophobicContact CD1-CD1 4.01Å; Y57-L155 HydrophobicContact CD2-CB 4.13Å; Y57-L155 HydrophobicContact CG-CB 3.92Å; Y57-L155 HydrophobicContact CG-CD1 4.19Å; Y57-L155 HydrophobicContact CG-CG 4.32Å
58	R	98.1	Very high	84.7	Confident	36 Å²	36	64.1 Å²	64.1	14%	0.136	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	144.2	-178	-53.4	-173.4	-57.2	152.5	13.3	111.6	L73 Q74 Q153 E154 E373 P395 P397	R58-L73 HydrophobicContact CB-CD1 3.99Å; R58-Q74 CarbonylContact C-O 3.53Å; R58-Q74 WeakPolarHBondContact CA-O 3.49Å; R58-Q153 CarbonylContact O-C 3.59Å; R58-Q153 VanDerWaalsContact O-CA 3.26Å; R58-Q153 WeakPolarHBondContact O-CA 3.31Å; R58-E154 HydrophobicContact CB-CG 4.18Å; R58-E154 IonicContact CZ-OE1 3.59Å; R58-E154 PolarHBondContact N-OE2 2.87Å; R58-E154 IonicContact NE-OE1 2.84Å; R58-E154 PolarHBondContact NE-OE1 3.39Å; R58-E154 IonicContact NH2-OE1 3.64Å; R58-E154 PolarHBondContact O-N 2.7Å; R58-E373 IonicContact CZ-OE1 3.9Å; R58-E373 IonicContact NH1-OE1 3.11Å; R58-E373 PolarHBondContact NH1-OE1 3.2Å; R58-E373 IonicContact NH2-OE1 3.33Å; R58-P395 PolarHBondContact NH2-O 3.17Å; R58-P397 VanDerWaalsContact NH2-CA 3.29Å
59	A	98.4	Very high	87.2	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	144.1	-179.6	0	0	0	0	0	111.8	Y57 V61 L73 Q74 K76 T118 W152 Q153	Y57-A59 HydrophobicContact CE2-CB 4.48Å; A59-V61 HydrophobicContact CB-CG2 4.27Å; A59-L73 WeakPolarHBondContact O-CA 3.49Å; A59-Q74 PolarHBondContact N-O 3.29Å; A59-Q74 PolarHBondContact O-N 2.92Å; A59-K76 HydrophobicContact CB-CD 3.65Å; A59-K76 HydrophobicContact CB-CG 4.25Å; A59-T118 HydrophobicContact CB-CG2 4.23Å; A59-W152 WeakPolarHBondContact CA-O 3.42Å; A59-Q153 HydrophobicContact CB-CB 3.58Å
60	L	98.6	Very high	89.5	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	108.6	170.2	-68.2	172	0	0	0	109.8	I71 L73 T118 L119 W152 F372 V375 L393	L60-I71 HydrophobicContact CB-CG2 4.1Å; L60-I71 HydrophobicContact CD2-CG2 4.24Å; L60-L73 HydrophobicContact CD2-CB 4.1Å; L60-L73 HydrophobicContact CD2-CD1 4.04Å; L60-L73 HydrophobicContact CG-CD1 4.49Å; L60-T118 WeakPolarHBondContact O-CA 3.35Å; L60-L119 PolarHBondContact O-N 2.86Å; L60-W152 HydrophobicContact CB-CB 3.98Å; L60-W152 HydrophobicContact CB-CE3 4.1Å; L60-W152 HydrophobicContact CD1-CB 4.23Å; L60-W152 HydrophobicContact CD1-CD2 4.43Å; L60-W152 HydrophobicContact CD1-CE3 3.93Å; L60-W152 PolarHBondContact N-O 3.47Å; L60-F372 HydrophobicContact CD1-CB 4.07Å; L60-F372 HydrophobicContact CD1-CD1 3.59Å; L60-F372 HydrophobicContact CD1-CD2 4.49Å; L60-F372 HydrophobicContact CD1-CE1 4.08Å; L60-F372 HydrophobicContact CD1-CG 3.81Å; L60-F372 HydrophobicContact CD2-CB 4.16Å; L60-F372 HydrophobicContact CG-CB 4.1Å; L60-F372 HydrophobicContact CG-CD1 4.19Å; L60-F372 HydrophobicContact CG-CD2 4.22Å; L60-F372 HydrophobicContact CG-CG 3.93Å; L60-V375 HydrophobicContact CD1-CB 3.89Å; L60-V375 HydrophobicContact CD1-CG2 3.78Å; L60-V375 HydrophobicContact CD2-CB 4.24Å; L60-V375 HydrophobicContact CD2-CG1 3.98Å; L60-L393 HydrophobicContact CD1-CD1 4.04Å
61	V	98.6	Very high	91.6	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.036	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.7	-174.8	-176.4	0	0	0	0	109.7	A59 T63 I71 K72 Q74 P116 V117	A59-V61 HydrophobicContact CB-CG2 4.27Å; V61-T63 HydrophobicContact CG1-CG2 4.26Å; V61-T63 PolarHBondContact O-N 3.05Å; V61-I71 WeakPolarHBondContact O-CA 3.33Å; V61-K72 PolarHBondContact N-O 3.24Å; V61-K72 PolarHBondContact O-N 3.21Å; V61-Q74 HydrophobicContact CB-CG 4.37Å; V61-Q74 HydrophobicContact CG2-CB 4.2Å; V61-Q74 HydrophobicContact CG2-CG 4.23Å; V61-P116 HydrophobicContact CG1-CB 4.08Å; V61-V117 CarbonylContact C-O 3.39Å; V61-V117 WeakPolarHBondContact CA-O 3.44Å
62	L	98.4	Very high	93.4	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	114	165	-177.6	68.9	0	0	0	108	G64 Y65 K70 I71 K105 L112 P115 P116 V117 L119	L62-G64 WeakPolarHBondContact CD1-O 3.43Å; L62-G64 WeakPolarHBondContact CG-O 3.49Å; L62-Y65 HydrophobicContact CD2-CD1 4.48Å; L62-K70 CarbonylContact C-O 3.17Å; L62-K70 WeakPolarHBondContact CA-O 3.48Å; L62-K70 HydrophobicContact CD1-CB 4.06Å; L62-I71 HydrophobicContact CD1-CG1 3.87Å; L62-K105 HydrophobicContact CD1-CB 3.93Å; L62-L112 HydrophobicContact CD2-CD2 3.97Å; L62-P115 HydrophobicContact CD2-CG 3.82Å; L62-P115 HydrophobicContact CG-CB 4.5Å; L62-P115 HydrophobicContact CG-CG 3.96Å; L62-P115 WeakPolarHBondContact O-CB 3.42Å; L62-P116 VanDerWaalsContact O-CA 3.24Å; L62-P116 WeakPolarHBondContact O-CA 3.29Å; L62-V117 HydrophobicContact CB-CG1 4.09Å; L62-V117 HydrophobicContact CD2-CG1 4.32Å; L62-V117 PolarHBondContact N-O 2.99Å; L62-V117 PolarHBondContact O-N 2.86Å; L62-L119 HydrophobicContact CB-CD1 4.14Å; L62-L119 HydrophobicContact CB-CD2 4.05Å; L62-L119 HydrophobicContact CB-CG 3.98Å; L62-L119 HydrophobicContact CD2-CD2 4.18Å
63	T	98	Very high	94.8	Very high	58 Å²	58	49.2 Å²	49.2	36%	0.356	25%	0.251	S	S	.	.			trans	-96.9	-8.1	-176.6	59.4	0	0	0	0	113.7	V61 K70 K72	V61-T63 HydrophobicContact CG1-CG2 4.26Å; V61-T63 PolarHBondContact O-N 3.05Å; T63-K70 PolarHBondContact N-O 3.26Å; T63-K70 PolarHBondContact OG1-O 2.84Å; T63-K70 VanDerWaalsContact OG1-O 3.1Å; T63-K72 HydrophobicContact CG2-CB 4.11Å; T63-K72 HydrophobicContact CG2-CG 3.77Å
64	G	96.5	Very high	95.6	Very high	18 Å²	18	43.8 Å²	43.8	19%	0.186	23%	0.229	C	C	.	.	S	Bend	trans	-178.8	172.1	175.7	0	0	0	0	0	110.6	L62 K70	L62-G64 WeakPolarHBondContact CD1-O 3.43Å; L62-G64 WeakPolarHBondContact CG-O 3.49Å; G64-K70 WeakPolarHBondContact O-CB 3.25Å
65	Y	95.1	Very high	96.1	Very high	114 Å²	114	45.6 Å²	45.6	45%	0.447	24%	0.239	S	C	.	.	S	Bend	trans	-81.6	139.2	177.6	-56.3	-59.9	0	0	0	111.7	L62 K105 G107 P115	L62-Y65 HydrophobicContact CD2-CD1 4.48Å; Y65-K105 CarbonylContact C-O 3.56Å; Y65-K105 VanDerWaalsContact CA-O 3.27Å; Y65-K105 WeakPolarHBondContact CA-O 3.47Å; Y65-G107 VanDerWaalsContact CD1-CA 3.41Å; Y65-P115 HydrophobicContact CD1-CG 4Å; Y65-P115 VanDerWaalsContact CE1-CD 3.46Å; Y65-P115 HydrophobicContact CE1-CG 3.7Å; Y65-P115 HydrophobicContact CE2-CG 4.41Å; Y65-P115 HydrophobicContact CG-CG 4.49Å; Y65-P115 VanDerWaalsContact OH-CD 3.27Å; Y65-P115 WeakPolarHBondContact OH-CD 3.06Å
66	G	91.8	Very high	96.3	Very high	9 Å²	9	46.5 Å²	46.5	9%	0.093	24%	0.241	C	C	.	.	S	Bend	trans	154.9	-141.9	177.9	0	0	0	0	0	115.3	K105 Q303	G66-K105 PolarHBondContact N-O 3.46Å; G66-K105 PolarHBondContact O-NZ 3.11Å; G66-Q303 CarbonylContact C-O 3.57Å; G66-Q303 VanDerWaalsContact O-O 3.06Å
67	G	90.5	Very high	96.2	Very high	4 Å²	4	45.6 Å²	45.6	4%	0.041	24%	0.238	C	C	.	.	S	Bend	trans	-77.2	-175.5	176.6	0	0	0	0	0	112.7	D69 K70 Q303	G67-D69 VanDerWaalsContact C-OD1 3.26Å; G67-D69 VanDerWaalsContact CA-OD1 3.23Å; G67-D69 WeakPolarHBondContact CA-OD1 3.37Å; G67-D69 PolarHBondContact N-OD1 3.44Å; G67-D69 PolarHBondContact O-N 3.05Å; G67-K70 PolarHBondContact O-N 3.32Å; G67-K70 VanDerWaalsContact O-N 3.15Å; G67-Q303 WeakPolarHBondContact CA-O 3.46Å
68	C	92.8	Very high	95.9	Very high	20 Å²	20	45.8 Å²	45.8	14%	0.135	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-62.9	-18.9	175.9	-60.5	0	0	0	0	112.7	K70 I71 A376	C68-K70 PolarHBondContact O-N 3Å; C68-K70 VanDerWaalsContact O-N 3.09Å; C68-I71 PolarHBondContact O-N 3.2Å; C68-A376 HydrophobicContact CB-CB 3.94Å
69	D	93.3	Very high	95.2	Very high	88 Å²	88	50.2 Å²	50.2	47%	0.471	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-58.1	-21.1	173.1	64.3	-69.4	0	0	0	113.3	G67 K72	G67-D69 VanDerWaalsContact C-OD1 3.26Å; G67-D69 VanDerWaalsContact CA-OD1 3.23Å; G67-D69 WeakPolarHBondContact CA-OD1 3.37Å; G67-D69 PolarHBondContact N-OD1 3.44Å; G67-D69 PolarHBondContact O-N 3.05Å; D69-K72 WeakPolarHBondContact O-CE 3.47Å; D69-K72 PolarHBondContact O-NZ 3.04Å
70	K	96.6	Very high	93.8	Very high	78 Å²	78	55 Å²	55	34%	0.339	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-86.1	-3	176.6	-57.3	-56.4	-177.9	-172.9	0	114.5	L62 T63 G64 G67 C68	L62-K70 CarbonylContact C-O 3.17Å; L62-K70 WeakPolarHBondContact CA-O 3.48Å; L62-K70 HydrophobicContact CD1-CB 4.06Å; T63-K70 PolarHBondContact N-O 3.26Å; T63-K70 PolarHBondContact OG1-O 2.84Å; T63-K70 VanDerWaalsContact OG1-O 3.1Å; G64-K70 WeakPolarHBondContact O-CB 3.25Å; G67-K70 PolarHBondContact O-N 3.32Å; G67-K70 VanDerWaalsContact O-N 3.15Å; C68-K70 PolarHBondContact O-N 3Å; C68-K70 VanDerWaalsContact O-N 3.09Å
71	I	97.9	Very high	92.2	Very high	11 Å²	11	59.2 Å²	59.2	6%	0.056	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.5	175.8	-58.6	167.9	0	0	0	107.2	L60 V61 L62 C68 K105 L119 V375 M379	L60-I71 HydrophobicContact CB-CG2 4.1Å; L60-I71 HydrophobicContact CD2-CG2 4.24Å; V61-I71 WeakPolarHBondContact O-CA 3.33Å; L62-I71 HydrophobicContact CD1-CG1 3.87Å; C68-I71 PolarHBondContact O-N 3.2Å; I71-K105 HydrophobicContact CD1-CD 4.43Å; I71-L119 HydrophobicContact CD1-CD1 3.78Å; I71-L119 HydrophobicContact CG1-CD1 4.01Å; I71-V375 HydrophobicContact CG2-CG1 4.17Å; I71-V375 HydrophobicContact CG2-CG2 4.34Å; I71-M379 HydrophobicContact CD1-CE 3.2Å; I71-M379 HydrophobicContact CD1-SD 3.33Å; I71-M379 WeakPolarHBondContact CD1-SD 3.45Å
72	K	98.1	Very high	91.1	Very high	98 Å²	98	61.9 Å²	61.9	43%	0.426	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.2	-175.5	-59.2	-57.1	-173	-168	0	109.6	V61 T63 D69 Q74	V61-K72 PolarHBondContact N-O 3.24Å; V61-K72 PolarHBondContact O-N 3.21Å; T63-K72 HydrophobicContact CG2-CB 4.11Å; T63-K72 HydrophobicContact CG2-CG 3.77Å; D69-K72 WeakPolarHBondContact O-CE 3.47Å; D69-K72 PolarHBondContact O-NZ 3.04Å; K72-Q74 HydrophobicContact CB-CG 4.16Å; K72-Q74 PolarHBondContact O-N 3.42Å
73	L	98.3	Very high	90.8	Very high	68 Å²	68	63.6 Å²	63.6	36%	0.356	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	119.1	163.9	-175.2	58	0	0	0	108	R58 A59 L60 F372 E373	R58-L73 HydrophobicContact CB-CD1 3.99Å; A59-L73 WeakPolarHBondContact O-CA 3.49Å; L60-L73 HydrophobicContact CD2-CB 4.1Å; L60-L73 HydrophobicContact CD2-CD1 4.04Å; L60-L73 HydrophobicContact CG-CD1 4.49Å; L73-F372 HydrophobicContact CD1-CB 3.92Å; L73-F372 HydrophobicContact CD1-CD2 4Å; L73-F372 HydrophobicContact CD1-CG 4.44Å; L73-F372 HydrophobicContact CD2-CB 4.46Å; L73-E373 HydrophobicContact CD2-CG 4.03Å
74	Q	97.9	Very high	90.6	Very high	78 Å²	78	67.8 Å²	67.8	36%	0.364	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	148.8	-179.1	-64.6	-175.1	-3.8	0	0	109.9	R58 A59 V61 K72	R58-Q74 CarbonylContact C-O 3.53Å; R58-Q74 WeakPolarHBondContact CA-O 3.49Å; A59-Q74 PolarHBondContact N-O 3.29Å; A59-Q74 PolarHBondContact O-N 2.92Å; V61-Q74 HydrophobicContact CB-CG 4.37Å; V61-Q74 HydrophobicContact CG2-CB 4.2Å; V61-Q74 HydrophobicContact CG2-CG 4.23Å; K72-Q74 HydrophobicContact CB-CG 4.16Å; K72-Q74 PolarHBondContact O-N 3.42Å
75	V	97.2	Very high	90.6	Very high	106 Å²	106	70.7 Å²	70.7	64%	0.642	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	119.6	166.2	-178.3	0	0	0	0	107.6	T56 Y57	T56-V75 HydrophobicContact CG2-CG1 4.32Å; Y57-V75 CarbonylContact O-C 3.57Å; Y57-V75 WeakPolarHBondContact O-CA 3.37Å
76	K	95.3	Very high	90.6	Very high	71 Å²	71	66.5 Å²	66.5	31%	0.309	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	166	174.1	-65.2	179.2	71.1	-169.3	0	109.2	T56 Y57 A59	T56-K76 CarbonylContact C-O 3.5Å; T56-K76 WeakPolarHBondContact CA-O 3.47Å; Y57-K76 HydrophobicContact CD2-CB 4.26Å; Y57-K76 HydrophobicContact CE1-CB 3.98Å; Y57-K76 HydrophobicContact CE2-CB 3.68Å; Y57-K76 HydrophobicContact CE2-CD 4.06Å; Y57-K76 HydrophobicContact CE2-CG 4.41Å; Y57-K76 PolarHBondContact N-O 3.2Å; Y57-K76 PolarHBondContact O-N 3.04Å; A59-K76 HydrophobicContact CB-CD 3.65Å; A59-K76 HydrophobicContact CB-CG 4.25Å
77	S	93.1	Very high	90.9	Very high	75 Å²	75	67.9 Å²	67.9	52%	0.524	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	150.1	174.4	66	0	0	0	0	111.2	I55	I55-S77 CarbonylContact O-C 3.59Å; I55-S77 VanDerWaalsContact O-CA 3.24Å; I55-S77 WeakPolarHBondContact O-CA 3.36Å
78	M	89	Confident	91.2	Very high	23 Å²	23	67.7 Å²	67.7	11%	0.113	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.7	173.4	66.5	178.1	-64.2	0	0	111.1	P54 I55 Y57 L89 L155 V157	P54-M78 CarbonylContact C-O 3.5Å; P54-M78 WeakPolarHBondContact CA-O 3.26Å; I55-M78 PolarHBondContact N-O 3.11Å; I55-M78 PolarHBondContact O-N 3.34Å; Y57-M78 HydrophobicContact CD1-CG 4.07Å; Y57-M78 HydrophobicContact CD1-SD 4.42Å; Y57-M78 HydrophobicContact CE1-CB 3.88Å; Y57-M78 HydrophobicContact CE1-CG 3.65Å; Y57-M78 HydrophobicContact CE1-SD 3.97Å; M78-L89 HydrophobicContact CE-CD1 3.94Å; M78-L89 HydrophobicContact CE-CD2 4.35Å; M78-L89 HydrophobicContact SD-CD1 3.93Å; M78-L155 HydrophobicContact CG-CD1 4.48Å; M78-L155 HydrophobicContact SD-CB 4.18Å; M78-L155 HydrophobicContact SD-CD1 3.98Å; M78-V157 HydrophobicContact CE-CG2 3.93Å
79	K	84.9	Confident	91.5	Very high	129 Å²	129	66.8 Å²	66.8	56%	0.561	37%	0.367	S	S	*	.			trans	-91.9	138.7	169.7	-64.6	-173.8	176.4	-171.6	0	108.8	A81 S82	K79-A81 VanDerWaalsContact C-N 3.35Å; K79-A81 PolarHBondContact O-N 3.41Å; K79-S82 WeakPolarHBondContact O-CB 3.41Å; K79-S82 PolarHBondContact O-N 2.92Å; K79-S82 PolarHBondContact O-OG 3.01Å
80	K	68.9	Low	91.7	Very high	99 Å²	99	62.6 Å²	62.6	43%	0.43	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-37.2	-175	-169.5	177.9	178	-178.6	0	112.3	I55 S82	I55-K80 HydrophobicContact CD1-CB 4.05Å; I55-K80 HydrophobicContact CD1-CD 4.48Å; I55-K80 HydrophobicContact CD1-CG 4.39Å; K80-S82 PolarHBondContact O-N 3.01Å
81	A	63.8	Low	91.8	Very high	91 Å²	91	61.4 Å²	61.4	75%	0.752	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	15.7	178	0	0	0	0	0	115.7	K79	K79-A81 VanDerWaalsContact C-N 3.35Å; K79-A81 PolarHBondContact O-N 3.41Å
82	S	76.1	Confident	91.8	Very high	62 Å²	62	61.1 Å²	61.1	43%	0.434	34%	0.337	S	S	.	.			trans	-96.8	10.8	-172	77.9	0	0	0	0	115.4	K79 K80	K79-S82 WeakPolarHBondContact O-CB 3.41Å; K79-S82 PolarHBondContact O-N 2.92Å; K79-S82 PolarHBondContact O-OG 3.01Å; K80-S82 PolarHBondContact O-N 3.01Å
83	L	91.9	Very high	91.8	Very high	36 Å²	36	61.3 Å²	61.3	19%	0.188	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-72.6	132	-179.8	-64.7	-174.1	0	0	0	110.6	E87 L89 A129 A131 V157	L83-E87 HydrophobicContact CD2-CB 4.35Å; L83-L89 HydrophobicContact CD1-CB 4.37Å; L83-L89 HydrophobicContact CD2-CB 4.19Å; L83-A129 HydrophobicContact CD1-CB 3.75Å; L83-A131 HydrophobicContact CB-CB 4.29Å; L83-V157 HydrophobicContact CD2-CB 4.44Å; L83-V157 HydrophobicContact CD2-CG1 3.8Å; L83-V157 HydrophobicContact CD2-CG2 3.84Å
84	K	94.4	Very high	91.9	Very high	145 Å²	145	58 Å²	58	63%	0.63	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-82.1	165.6	169.6	-56.3	173.1	-176.7	168.6	0	109.9	G86 E87 A131	K84-G86 PolarHBondContact O-N 2.91Å; K84-E87 HydrophobicContact CB-CG 4.13Å; K84-E87 WeakPolarHBondContact CB-OE2 3.36Å; K84-E87 PolarHBondContact N-OE2 3.31Å; K84-E87 WeakPolarHBondContact O-CB 3.3Å; K84-E87 PolarHBondContact O-N 2.78Å; K84-E87 VanDerWaalsContact O-N 3.11Å; K84-A131 WeakPolarHBondContact O-CB 3.48Å
85	A	95.7	Very high	91.9	Very high	80 Å²	80	54.3 Å²	54.3	66%	0.661	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	135	170.7	0	0	0	0	0	111.1	E87 D133	A85-E87 VanDerWaalsContact C-N 3.3Å; A85-E87 PolarHBondContact O-N 3.22Å; A85-D133 VanDerWaalsContact CA-OD1 3.23Å; A85-D133 WeakPolarHBondContact CA-OD1 3.32Å; A85-D133 WeakPolarHBondContact CB-OD2 3.5Å
86	G	96.3	Very high	92	Very high	26 Å²	26	49.3 Å²	49.3	27%	0.268	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	7.3	-179.7	0	0	0	0	0	115.4	K84 D133 A160	K84-G86 PolarHBondContact O-N 2.91Å; G86-D133 VanDerWaalsContact N-CG 3.29Å; G86-D133 PolarHBondContact N-OD1 3.03Å; G86-D133 PolarHBondContact N-OD2 2.96Å; G86-A160 WeakPolarHBondContact O-CB 3.39Å; G86-A160 PolarHBondContact O-N 3.3Å
87	E	97.1	Very high	92.1	Very high	38 Å²	38	45.9 Å²	45.9	18%	0.178	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	153.6	-179.2	-64.5	-177.4	155.3	0	0	113.4	L83 K84 A85 A131 V157 V158	L83-E87 HydrophobicContact CD2-CB 4.35Å; K84-E87 HydrophobicContact CB-CG 4.13Å; K84-E87 WeakPolarHBondContact CB-OE2 3.36Å; K84-E87 PolarHBondContact N-OE2 3.31Å; K84-E87 WeakPolarHBondContact O-CB 3.3Å; K84-E87 PolarHBondContact O-N 2.78Å; K84-E87 VanDerWaalsContact O-N 3.11Å; A85-E87 VanDerWaalsContact C-N 3.3Å; A85-E87 PolarHBondContact O-N 3.22Å; E87-A131 VanDerWaalsContact O-CB 3.29Å; E87-A131 WeakPolarHBondContact O-CB 3.48Å; E87-A131 PolarHBondContact O-N 3.5Å; E87-V157 HydrophobicContact CB-CG1 3.91Å; E87-V157 VanDerWaalsContact CD-CG1 3.49Å; E87-V157 HydrophobicContact CG-CG1 4.08Å; E87-V157 VanDerWaalsContact OE2-CG1 3.29Å; E87-V157 WeakPolarHBondContact OE2-CG1 3.43Å; E87-V158 WeakPolarHBondContact CA-O 3.38Å
88	V	97.4	Very high	92.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	149.1	168.6	-61.2	0	0	0	0	110.5	V90 I127 A129 V130 V134 R137 V157 V158 A160 T163	V88-V90 HydrophobicContact CG2-CG2 4.11Å; V88-I127 HydrophobicContact CB-CG2 4.48Å; V88-I127 HydrophobicContact CG1-CD1 4.46Å; V88-A129 WeakPolarHBondContact CA-O 3.36Å; V88-V130 HydrophobicContact CG1-CB 4.41Å; V88-V130 HydrophobicContact CG1-CG1 4.14Å; V88-V130 HydrophobicContact CG1-CG2 4.12Å; V88-V134 HydrophobicContact CG1-CG1 4.23Å; V88-R137 HydrophobicContact CG1-CB 4.38Å; V88-V157 WeakPolarHBondContact O-CA 3.45Å; V88-V158 HydrophobicContact CG2-CG2 3.66Å; V88-V158 PolarHBondContact N-O 3.43Å; V88-V158 PolarHBondContact O-N 2.96Å; V88-A160 HydrophobicContact CG1-CB 4.03Å; V88-T163 HydrophobicContact CG2-CG2 3.67Å
89	L	97.4	Very high	92.6	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	121.2	170.5	-177.6	60.8	0	0	0	109.5	M78 L83 I127 E128 A129 L155 V157	M78-L89 HydrophobicContact CE-CD1 3.94Å; M78-L89 HydrophobicContact CE-CD2 4.35Å; M78-L89 HydrophobicContact SD-CD1 3.93Å; L83-L89 HydrophobicContact CD1-CB 4.37Å; L83-L89 HydrophobicContact CD2-CB 4.19Å; L89-I127 CarbonylContact O-C 3.56Å; L89-I127 WeakPolarHBondContact O-CA 3.23Å; L89-E128 HydrophobicContact CD2-CB 4.32Å; L89-E128 HydrophobicContact CG-CB 4.41Å; L89-E128 PolarHBondContact O-N 3.06Å; L89-A129 HydrophobicContact CB-CB 3.94Å; L89-A129 HydrophobicContact CD2-CB 4.4Å; L89-A129 PolarHBondContact N-O 3.5Å; L89-L155 HydrophobicContact CD1-CB 4.11Å; L89-L155 HydrophobicContact CD1-CD2 4.02Å; L89-L155 HydrophobicContact CD2-CD2 4.23Å; L89-L155 HydrophobicContact CG-CD2 4.08Å; L89-V157 HydrophobicContact CD1-CG2 3.92Å
90	V	98.3	Very high	93	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.6	178.5	-178	0	0	0	0	110.1	V88 V92 I127 V143 A145 A156 V158	V88-V90 HydrophobicContact CG2-CG2 4.11Å; V90-V92 PolarHBondContact O-N 2.91Å; V90-I127 HydrophobicContact CG2-CG1 4.48Å; V90-V143 HydrophobicContact CG1-CG2 4.16Å; V90-V143 HydrophobicContact CG2-CG2 4Å; V90-A145 HydrophobicContact CG2-CB 4.39Å; V90-A156 PolarHBondContact N-O 3.49Å; V90-A156 PolarHBondContact O-N 3.45Å; V90-V158 HydrophobicContact CG2-CG2 3.82Å
91	R	98.3	Very high	94.2	Very high	53 Å²	53	34 Å²	34	20%	0.2	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	101.5	162.6	-178.3	67.2	59.4	-174.6	-4.5	109	G125 V126 E128 E154 L155	R91-G125 CarbonylContact O-C 3.41Å; R91-G125 WeakPolarHBondContact O-CA 3.4Å; R91-V126 PolarHBondContact N-O 3.5Å; R91-V126 PolarHBondContact O-N 3.06Å; R91-E128 HydrophobicContact CB-CG 3.8Å; R91-E128 WeakPolarHBondContact CB-OE1 3.43Å; R91-E128 IonicContact CZ-OE1 3.57Å; R91-E128 IonicContact CZ-OE2 3.52Å; R91-E128 IonicContact NE-OE1 2.76Å; R91-E128 PolarHBondContact NE-OE1 3.02Å; R91-E128 IonicContact NE-OE2 3.53Å; R91-E128 VanDerWaalsContact NH2-CD 3.32Å; R91-E128 IonicContact NH2-OE1 2.69Å; R91-E128 PolarHBondContact NH2-OE1 2.81Å; R91-E128 VanDerWaalsContact NH2-OE1 3.11Å; R91-E128 IonicContact NH2-OE2 2.74Å; R91-E128 PolarHBondContact NH2-OE2 2.94Å; R91-E154 CarbonylContact C-O 3.59Å; R91-E154 WeakPolarHBondContact CA-O 3.46Å; R91-E154 WeakPolarHBondContact CD-O 3.44Å; R91-L155 HydrophobicContact CB-CD2 4.42Å; R91-L155 VanDerWaalsContact NH1-CG 3.33Å; R91-L155 VanDerWaalsContact NH2-CD2 3.32Å
92	V	98.7	Very high	95.6	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.03	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	134.2	-175.7	-172.4	0	0	0	0	109.7	V90 A94 C95 M151 Q153 E154 A156 P395	V90-V92 PolarHBondContact O-N 2.91Å; V92-A94 WeakPolarHBondContact CG1-O 3.32Å; V92-C95 VanDerWaalsContact CG1-SG 3.52Å; V92-M151 HydrophobicContact CG2-CE 4.13Å; V92-Q153 VanDerWaalsContact CB-O 3.29Å; V92-Q153 WeakPolarHBondContact CB-O 3.4Å; V92-Q153 VanDerWaalsContact CG2-O 3.27Å; V92-Q153 WeakPolarHBondContact CG2-O 3.46Å; V92-E154 PolarHBondContact N-O 3.31Å; V92-A156 HydrophobicContact CG2-CB 3.82Å; V92-P395 HydrophobicContact CB-CG 4.09Å; V92-P395 HydrophobicContact CG1-CG 3.92Å
93	K	98.8	Very high	96.4	Very high	101 Å²	101	27.9 Å²	27.9	44%	0.439	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-31.5	178.6	-64	-61.9	-176	179.3	0	112.2	S124 F172 P395	K93-S124 PolarHBondContact N-O 2.59Å; K93-F172 HydrophobicContact CB-CB 3.95Å; K93-F172 HydrophobicContact CB-CD1 3.97Å; K93-F172 HydrophobicContact CB-CD2 3.92Å; K93-F172 HydrophobicContact CB-CE1 4.46Å; K93-F172 HydrophobicContact CB-CE2 4.4Å; K93-F172 HydrophobicContact CB-CG 3.67Å; K93-F172 HydrophobicContact CG-CD1 4.23Å; K93-F172 HydrophobicContact CG-CD2 4.09Å; K93-F172 HydrophobicContact CG-CE1 4.22Å; K93-F172 HydrophobicContact CG-CE2 4.06Å; K93-F172 HydrophobicContact CG-CG 4.17Å; K93-F172 HydrophobicContact CG-CZ 4.12Å; K93-P395 WeakPolarHBondContact O-CD 3.31Å
94	A	98.9	Very high	96.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	145.4	173.9	0	0	0	0	0	110.4	V92 G123 S124 F172 E173 A176 I392 L393 L394	V92-A94 WeakPolarHBondContact CG1-O 3.32Å; A94-G123 CarbonylContact O-C 3.55Å; A94-G123 WeakPolarHBondContact O-CA 3.43Å; A94-S124 PolarHBondContact N-O 2.9Å; A94-S124 PolarHBondContact O-N 2.82Å; A94-F172 HydrophobicContact CB-CB 4.31Å; A94-E173 HydrophobicContact CB-CG 4.17Å; A94-A176 HydrophobicContact CB-CB 3.79Å; A94-A176 WeakPolarHBondContact O-CB 3.2Å; A94-I392 HydrophobicContact CB-CG2 3.88Å; A94-L393 CarbonylContact C-O 3.58Å; A94-L393 WeakPolarHBondContact CA-O 3.33Å; A94-L394 HydrophobicContact CB-CD2 4.25Å
95	C	98.8	Very high	96.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	142.1	173.9	-39.4	0	0	0	0	110.4	V92 M151 W152 I392 L393	V92-C95 VanDerWaalsContact CG1-SG 3.52Å; C95-M151 PolarHBondContact SG-O 2.87Å; C95-W152 VanDerWaalsContact CB-CD1 3.47Å; C95-I392 WeakPolarHBondContact O-CA 3.47Å; C95-L393 HydrophobicContact CB-CB 4.24Å; C95-L393 PolarHBondContact N-O 3.49Å; C95-L393 PolarHBondContact O-N 3.4Å
96	G	98.6	Very high	96.2	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	138.2	170.5	0	0	0	0	0	111.4	E122 W152	G96-E122 PolarHBondContact N-O 2.95Å; G96-E122 VanDerWaalsContact N-O 3.14Å; G96-W152 PolarHBondContact O-NE1 2.8Å; G96-W152 VanDerWaalsContact O-NE1 3.14Å
97	L	98.5	Very high	95.9	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.082	C	C	.	.			trans	-96.8	131.8	164.7	-167.7	155	0	0	0	109.1	W152 A378 M379 M382 K390 V391 L393	L97-W152 HydrophobicContact CB-CZ2 4.17Å; L97-W152 HydrophobicContact CD1-CH2 4.15Å; L97-W152 HydrophobicContact CD1-CZ2 4.23Å; L97-W152 HydrophobicContact CG-CH2 4.1Å; L97-W152 HydrophobicContact CG-CZ2 3.85Å; L97-A378 HydrophobicContact CD1-CB 3.95Å; L97-M379 HydrophobicContact CD1-CG 3.97Å; L97-M382 HydrophobicContact CD2-CB 3.99Å; L97-M382 HydrophobicContact CD2-CE 3.37Å; L97-M382 HydrophobicContact CD2-CG 4.25Å; L97-M382 HydrophobicContact CD2-SD 3.3Å; L97-M382 WeakPolarHBondContact CD2-SD 3.23Å; L97-M382 WeakPolarHBondContact O-CE 3.45Å; L97-K390 WeakPolarHBondContact O-CE 3.46Å; L97-V391 HydrophobicContact CB-CB 4.25Å; L97-V391 HydrophobicContact CB-CG1 4.4Å; L97-V391 WeakPolarHBondContact CB-O 3.37Å; L97-V391 HydrophobicContact CD1-CG1 4.36Å; L97-V391 PolarHBondContact N-O 2.88Å; L97-V391 VanDerWaalsContact N-O 3.07Å; L97-L393 HydrophobicContact CD1-CD1 4.49Å
98	N	97.5	Very high	95.4	Very high	8 Å²	8	15.9 Å²	15.9	4%	0.043	8%	0.082	C	C	.	.			trans	-122.2	169	177	-54.7	-79	0	0	0	111.8	A100 E101 M121 E122 I180 K390	N98-A100 PolarHBondContact O-N 3.34Å; N98-E101 VanDerWaalsContact C-OE2 3.23Å; N98-E101 WeakPolarHBondContact CA-OE2 3.43Å; N98-E101 WeakPolarHBondContact CB-OE2 3.12Å; N98-E101 PolarHBondContact N-OE2 2.88Å; N98-E101 PolarHBondContact O-N 2.64Å; N98-M121 HydrophobicContact CB-CE 3.73Å; N98-E122 PolarHBondContact ND2-OE1 2.92Å; N98-E122 PolarHBondContact OD1-OE1 3.01Å; N98-E122 VanDerWaalsContact OD1-OE1 3.11Å; N98-I180 VanDerWaalsContact OD1-CG2 3.32Å; N98-I180 WeakPolarHBondContact OD1-CG2 3.44Å; N98-K390 PolarHBondContact OD1-NZ 3.15Å
99	F	93.6	Very high	95.1	Very high	47 Å²	47	17 Å²	17	21%	0.206	9%	0.087	C	C	.	.	H	α-helix	trans	-67.2	-26.5	175.1	-154.9	-91.8	0	0	0	112.2	E101 L102 L103 A297 V300	F99-E101 VanDerWaalsContact C-N 3.3Å; F99-E101 PolarHBondContact O-N 3.44Å; F99-L102 HydrophobicContact CD2-CD1 4.01Å; F99-L102 HydrophobicContact CE2-CD1 4.1Å; F99-L102 WeakPolarHBondContact O-CB 3.45Å; F99-L102 PolarHBondContact O-N 2.69Å; F99-L102 VanDerWaalsContact O-N 3.09Å; F99-L103 HydrophobicContact CD1-CD1 4.18Å; F99-L103 HydrophobicContact CD1-CG 4.18Å; F99-L103 HydrophobicContact CE1-CG 4.3Å; F99-L103 PolarHBondContact O-N 3.15Å; F99-L103 VanDerWaalsContact O-N 3.1Å; F99-A297 HydrophobicContact CE1-CB 3.94Å; F99-A297 HydrophobicContact CE2-CB 4.19Å; F99-A297 HydrophobicContact CZ-CB 3.62Å; F99-V300 HydrophobicContact CE1-CB 4.05Å; F99-V300 HydrophobicContact CE1-CG2 3.64Å; F99-V300 HydrophobicContact CZ-CB 3.74Å; F99-V300 HydrophobicContact CZ-CG1 4.16Å; F99-V300 HydrophobicContact CZ-CG2 3.88Å
100	A	93.5	Very high	94.8	Very high	13 Å²	13	25.1 Å²	25.1	11%	0.107	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-34.5	176.8	0	0	0	0	0	112.1	N98 L102 L103 G104 Y109 M121	N98-A100 PolarHBondContact O-N 3.34Å; A100-L102 VanDerWaalsContact C-N 3.32Å; A100-L102 PolarHBondContact O-N 3.11Å; A100-L103 PolarHBondContact O-N 3.16Å; A100-G104 PolarHBondContact O-N 3.19Å; A100-Y109 HydrophobicContact CB-CD1 4.38Å; A100-Y109 HydrophobicContact CB-CE1 4.16Å; A100-Y109 HydrophobicContact CB-CE2 4.35Å; A100-M121 HydrophobicContact CB-CE 3.56Å; A100-M121 HydrophobicContact CB-SD 4.07Å
101	E	95.1	Very high	94.4	Very high	7 Å²	7	27.2 Å²	27.2	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-69.4	-29.7	174.1	-67.7	82.6	-173.1	0	0	112.4	N98 F99 G104 K105 L119 G120 M121 W152 M379	N98-E101 VanDerWaalsContact C-OE2 3.23Å; N98-E101 WeakPolarHBondContact CA-OE2 3.43Å; N98-E101 WeakPolarHBondContact CB-OE2 3.12Å; N98-E101 PolarHBondContact N-OE2 2.88Å; N98-E101 PolarHBondContact O-N 2.64Å; F99-E101 VanDerWaalsContact C-N 3.3Å; F99-E101 PolarHBondContact O-N 3.44Å; E101-G104 PolarHBondContact O-N 3.06Å; E101-K105 PolarHBondContact O-N 3.39Å; E101-L119 HydrophobicContact CG-CB 4.5Å; E101-G120 WeakPolarHBondContact OE1-CA 3.19Å; E101-M121 PolarHBondContact OE1-N 3.31Å; E101-W152 HydrophobicContact CB-CH2 3.73Å; E101-W152 HydrophobicContact CB-CZ2 3.97Å; E101-W152 HydrophobicContact CG-CH2 3.82Å; E101-W152 HydrophobicContact CG-CZ2 3.63Å; E101-M379 HydrophobicContact CB-CE 4.37Å
102	L	93.6	Very high	94.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.4	-35.3	171.7	-59.5	-176.9	0	0	0	112.2	F99 A100 K105 Q106 M379 M382 H383	F99-L102 HydrophobicContact CD2-CD1 4.01Å; F99-L102 HydrophobicContact CE2-CD1 4.1Å; F99-L102 WeakPolarHBondContact O-CB 3.45Å; F99-L102 PolarHBondContact O-N 2.69Å; F99-L102 VanDerWaalsContact O-N 3.09Å; A100-L102 VanDerWaalsContact C-N 3.32Å; A100-L102 PolarHBondContact O-N 3.11Å; L102-K105 WeakPolarHBondContact O-CG 3.28Å; L102-Q106 WeakPolarHBondContact O-CG 3.12Å; L102-M379 HydrophobicContact CD2-CB 4.01Å; L102-M379 HydrophobicContact CD2-CG 3.98Å; L102-M379 HydrophobicContact CD2-SD 4.12Å; L102-M382 HydrophobicContact CD1-CB 4.29Å; L102-M382 HydrophobicContact CD1-CG 3.92Å; L102-M382 HydrophobicContact CD1-SD 4.16Å; L102-H383 HydrophobicContact CD1-CB 4.29Å
103	L	91.5	Very high	94.2	Very high	25 Å²	25	27.9 Å²	27.9	13%	0.131	15%	0.146	C	C	.	.	H	α-helix	trans	-71.1	-43.9	171.8	-70	169.2	0	0	0	111.1	F99 A100 K105 Q106 G107 L108 V300	F99-L103 HydrophobicContact CD1-CD1 4.18Å; F99-L103 HydrophobicContact CD1-CG 4.18Å; F99-L103 HydrophobicContact CE1-CG 4.3Å; F99-L103 PolarHBondContact O-N 3.15Å; F99-L103 VanDerWaalsContact O-N 3.1Å; A100-L103 PolarHBondContact O-N 3.16Å; L103-K105 PolarHBondContact O-N 3.33Å; L103-Q106 CarbonylContact O-C 3.53Å; L103-Q106 PolarHBondContact O-N 2.99Å; L103-G107 PolarHBondContact O-N 3.48Å; L103-L108 HydrophobicContact CB-CB 4.21Å; L103-L108 HydrophobicContact CD2-CB 3.98Å; L103-L108 HydrophobicContact CD2-CD1 4.2Å; L103-L108 PolarHBondContact O-N 3.21Å; L103-V300 HydrophobicContact CD2-CG2 3.39Å; L103-V300 HydrophobicContact CG-CG2 4.15Å
104	G	92.6	Very high	94	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-45.8	-178.8	0	0	0	0	0	112.8	A100 E101 Q106 G107	A100-G104 PolarHBondContact O-N 3.19Å; E101-G104 PolarHBondContact O-N 3.06Å; G104-Q106 PolarHBondContact O-N 3.43Å; G104-Q106 VanDerWaalsContact O-N 3.12Å; G104-G107 PolarHBondContact O-N 3.02Å
105	K	93.8	Very high	93.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-24	176.3	80.8	-173.1	-173.4	81.1	0	113	L62 Y65 G66 I71 E101 L102 L103 Q303 M379	L62-K105 HydrophobicContact CD1-CB 3.93Å; Y65-K105 CarbonylContact C-O 3.56Å; Y65-K105 VanDerWaalsContact CA-O 3.27Å; Y65-K105 WeakPolarHBondContact CA-O 3.47Å; G66-K105 PolarHBondContact N-O 3.46Å; G66-K105 PolarHBondContact O-NZ 3.11Å; I71-K105 HydrophobicContact CD1-CD 4.43Å; E101-K105 PolarHBondContact O-N 3.39Å; L102-K105 WeakPolarHBondContact O-CG 3.28Å; L103-K105 PolarHBondContact O-N 3.33Å; K105-Q303 PolarHBondContact NZ-O 3.21Å; K105-M379 HydrophobicContact CD-CE 4.22Å; K105-M379 HydrophobicContact CD-SD 3.59Å; K105-M379 VanDerWaalsContact CD-SD 3.59Å
106	Q	91	Very high	93.8	Very high	5 Å²	5	33.9 Å²	33.9	2%	0.023	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.1	177.7	-60.4	-172.4	19.4	0	0	113.6	L102 L103 G104 L108 G302 K304 K305	L102-Q106 WeakPolarHBondContact O-CG 3.12Å; L103-Q106 CarbonylContact O-C 3.53Å; L103-Q106 PolarHBondContact O-N 2.99Å; G104-Q106 PolarHBondContact O-N 3.43Å; G104-Q106 VanDerWaalsContact O-N 3.12Å; Q106-L108 VanDerWaalsContact C-N 3.33Å; Q106-L108 HydrophobicContact CB-CD1 4.16Å; Q106-L108 HydrophobicContact CB-CG 4.06Å; Q106-G302 PolarHBondContact NE2-O 3.29Å; Q106-K304 PolarHBondContact OE1-O 3.28Å; Q106-K305 HydrophobicContact CB-CB 4.48Å
107	G	90.5	Very high	93.8	Very high	30 Å²	30	34.3 Å²	34.3	31%	0.309	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	30.8	-175.1	0	0	0	0	0	112.9	Y65 L103 G104	Y65-G107 VanDerWaalsContact CD1-CA 3.41Å; L103-G107 PolarHBondContact O-N 3.48Å; G104-G107 PolarHBondContact O-N 3.02Å
108	L	88.1	Confident	93.8	Very high	37 Å²	37	34.9 Å²	34.9	19%	0.194	20%	0.203	C	C	.	.			trans	-110.9	12	179.8	-59.3	-178.8	0	0	0	113	L103 Q106 K305 M310	L103-L108 HydrophobicContact CB-CB 4.21Å; L103-L108 HydrophobicContact CD2-CB 3.98Å; L103-L108 HydrophobicContact CD2-CD1 4.2Å; L103-L108 PolarHBondContact O-N 3.21Å; Q106-L108 VanDerWaalsContact C-N 3.33Å; Q106-L108 HydrophobicContact CB-CD1 4.16Å; Q106-L108 HydrophobicContact CB-CG 4.06Å; L108-K305 HydrophobicContact CD2-CD 3.91Å; L108-K305 HydrophobicContact CD2-CG 4.09Å; L108-M310 HydrophobicContact CD1-SD 4.36Å; L108-M310 HydrophobicContact CD2-CE 3.66Å; L108-M310 HydrophobicContact CD2-SD 3.48Å; L108-M310 WeakPolarHBondContact CD2-SD 3.29Å
109	Y	90.9	Very high	93.8	Very high	25 Å²	25	34.5 Å²	34.5	10%	0.098	20%	0.201	C	C	.	.			trans	-126.8	100.7	-179.7	-170.6	-129.3	0	0	0	110.1	A100 L111 L112 M121 H336	A100-Y109 HydrophobicContact CB-CD1 4.38Å; A100-Y109 HydrophobicContact CB-CE1 4.16Å; A100-Y109 HydrophobicContact CB-CE2 4.35Å; Y109-L111 VanDerWaalsContact C-N 3.26Å; Y109-L111 HydrophobicContact CE1-CB 3.97Å; Y109-L111 HydrophobicContact CE2-CB 4.18Å; Y109-L111 HydrophobicContact CE2-CD1 4.24Å; Y109-L111 HydrophobicContact CE2-CG 4.46Å; Y109-L111 PolarHBondContact O-N 3.27Å; Y109-L111 WeakPolarHBondContact OH-CD1 3.24Å; Y109-L112 HydrophobicContact CD1-CB 3.77Å; Y109-L112 HydrophobicContact CE1-CB 4.45Å; Y109-L112 PolarHBondContact O-N 3.21Å; Y109-M121 HydrophobicContact CE1-SD 4.35Å; Y109-H336 AromaticContact CE2-CE1 3.62Å; Y109-H336 AromaticContact CE2-NE2 3.33Å; Y109-H336 VanDerWaalsContact CE2-NE2 3.33Å; Y109-H336 WeakPolarHBondContact CE2-NE2 3.46Å; Y109-H336 AromaticContact CZ-CE1 3.83Å; Y109-H336 AromaticContact CZ-NE2 3.95Å; Y109-H336 PolarHBondContact OH-CE1 3.2Å
110	E	89.4	Confident	94	Very high	171 Å²	171	32.3 Å²	32.3	80%	0.799	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-26.1	-171.1	-63.5	177.7	172.7	0	0	113.8	L112	E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 2.95Å
111	L	91.5	Very high	94.2	Very high	43 Å²	43	32.5 Å²	32.5	23%	0.225	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-12.8	179.8	-66.2	177.7	0	0	0	113.3	Y109 G338 Y339	Y109-L111 VanDerWaalsContact C-N 3.26Å; Y109-L111 HydrophobicContact CE1-CB 3.97Å; Y109-L111 HydrophobicContact CE2-CB 4.18Å; Y109-L111 HydrophobicContact CE2-CD1 4.24Å; Y109-L111 HydrophobicContact CE2-CG 4.46Å; Y109-L111 PolarHBondContact O-N 3.27Å; Y109-L111 WeakPolarHBondContact OH-CD1 3.24Å; L111-G338 WeakPolarHBondContact CD1-O 3.31Å; L111-Y339 HydrophobicContact CD1-CD1 4.3Å; L111-Y339 HydrophobicContact CD1-CD2 3.69Å; L111-Y339 HydrophobicContact CD1-CE1 4.16Å; L111-Y339 HydrophobicContact CD1-CE2 3.52Å; L111-Y339 HydrophobicContact CD1-CG 4.09Å; L111-Y339 HydrophobicContact CD2-CD1 4.14Å; L111-Y339 HydrophobicContact CD2-CE1 3.71Å; L111-Y339 HydrophobicContact CG-CE1 4.02Å; L111-Y339 HydrophobicContact CG-CE2 3.96Å
112	L	95	Very high	94.4	Very high	18 Å²	18	32.2 Å²	32.2	9%	0.094	19%	0.19	C	C	.	.	S	Bend	trans	-84.5	126.9	175	-176.8	70.1	0	0	0	109.5	L62 Y109 E110 V117 L119 H149	L62-L112 HydrophobicContact CD2-CD2 3.97Å; Y109-L112 HydrophobicContact CD1-CB 3.77Å; Y109-L112 HydrophobicContact CE1-CB 4.45Å; Y109-L112 PolarHBondContact O-N 3.21Å; E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 2.95Å; L112-V117 HydrophobicContact CD1-CG1 4.03Å; L112-V117 HydrophobicContact CD1-CG2 4.17Å; L112-V117 HydrophobicContact CD2-CG1 4.26Å; L112-V117 HydrophobicContact CG-CG1 4.08Å; L112-L119 HydrophobicContact CD1-CD2 3.98Å; L112-L119 HydrophobicContact CD2-CD2 3.68Å; L112-H149 HydrophobicContact CD1-CB 3.89Å
113	P	96	Very high	94.6	Very high	54 Å²	54	32.2 Å²	32.2	35%	0.351	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-55.5	152.6	172.3	-25.7	34	0	0	0	112.7	V117 H149	P113-V117 HydrophobicContact CB-CG2 4.12Å; P113-V117 HydrophobicContact CG-CG2 4.21Å; P113-V117 WeakPolarHBondContact O-CG1 3.3Å; P113-H149 VanDerWaalsContact CD-CD2 3.41Å; P113-H149 WeakPolarHBondContact CD-CD2 3.38Å; P113-H149 WeakPolarHBondContact CG-NE2 3.44Å
114	S	95.4	Very high	95	Very high	90 Å²	90	31 Å²	31	63%	0.629	18%	0.184	S	C	*	.	S	Bend	trans	-57.7	140.4	174.7	-68.8	0	0	0	0	111.4
115	P	97	Very high	95.2	Very high	29 Å²	29	31 Å²	31	19%	0.188	18%	0.183	C	C	.	.	S	Bend	trans	-53.1	145.4	171.1	-28	35.6	0	0	0	112.6	L62 Y65	L62-P115 HydrophobicContact CD2-CG 3.82Å; L62-P115 HydrophobicContact CG-CB 4.5Å; L62-P115 HydrophobicContact CG-CG 3.96Å; L62-P115 WeakPolarHBondContact O-CB 3.42Å; Y65-P115 HydrophobicContact CD1-CG 4Å; Y65-P115 VanDerWaalsContact CE1-CD 3.46Å; Y65-P115 HydrophobicContact CE1-CG 3.7Å; Y65-P115 HydrophobicContact CE2-CG 4.41Å; Y65-P115 HydrophobicContact CG-CG 4.49Å; Y65-P115 VanDerWaalsContact OH-CD 3.27Å; Y65-P115 WeakPolarHBondContact OH-CD 3.06Å
116	P	97.7	Very high	95.5	Very high	108 Å²	108	32.7 Å²	32.7	70%	0.701	19%	0.194	S	C	*	.	S	Bend	cis	-77.5	131.6	2.9	30.7	-34.4	0	0	0	113.7	V61 L62	V61-P116 HydrophobicContact CG1-CB 4.08Å; L62-P116 VanDerWaalsContact O-CA 3.24Å; L62-P116 WeakPolarHBondContact O-CA 3.29Å
117	V	97.9	Very high	95.8	Very high	10 Å²	10	32.5 Å²	32.5	6%	0.061	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	139	-179.3	64.9	0	0	0	0	111.8	V61 L62 L112 P113 H149	V61-V117 CarbonylContact C-O 3.39Å; V61-V117 WeakPolarHBondContact CA-O 3.44Å; L62-V117 HydrophobicContact CB-CG1 4.09Å; L62-V117 HydrophobicContact CD2-CG1 4.32Å; L62-V117 PolarHBondContact N-O 2.99Å; L62-V117 PolarHBondContact O-N 2.86Å; L112-V117 HydrophobicContact CD1-CG1 4.03Å; L112-V117 HydrophobicContact CD1-CG2 4.17Å; L112-V117 HydrophobicContact CD2-CG1 4.26Å; L112-V117 HydrophobicContact CG-CG1 4.08Å; P113-V117 HydrophobicContact CB-CG2 4.12Å; P113-V117 HydrophobicContact CG-CG2 4.21Å; P113-V117 WeakPolarHBondContact O-CG1 3.3Å; V117-H149 HydrophobicContact CG2-CB 4.48Å
118	T	98.3	Very high	96.1	Very high	11 Å²	11	34 Å²	34	7%	0.067	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	127.9	170.7	-57.5	0	0	0	0	109.6	A59 L60 G150 Q153	A59-T118 HydrophobicContact CB-CG2 4.23Å; L60-T118 WeakPolarHBondContact O-CA 3.35Å; T118-G150 WeakPolarHBondContact O-CA 3.38Å; T118-G150 PolarHBondContact O-N 3.16Å; T118-Q153 HydrophobicContact CG2-CB 4.1Å; T118-Q153 HydrophobicContact CG2-CG 4.09Å
119	L	98.1	Very high	96.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.			trans	-80.2	176.2	-176.8	-68.7	178.2	0	0	0	113.1	L60 L62 I71 E101 L112 G150 M151 W152 M379	L60-L119 PolarHBondContact O-N 2.86Å; L62-L119 HydrophobicContact CB-CD1 4.14Å; L62-L119 HydrophobicContact CB-CD2 4.05Å; L62-L119 HydrophobicContact CB-CG 3.98Å; L62-L119 HydrophobicContact CD2-CD2 4.18Å; I71-L119 HydrophobicContact CD1-CD1 3.78Å; I71-L119 HydrophobicContact CG1-CD1 4.01Å; E101-L119 HydrophobicContact CG-CB 4.5Å; L112-L119 HydrophobicContact CD1-CD2 3.98Å; L112-L119 HydrophobicContact CD2-CD2 3.68Å; L119-G150 CarbonylContact O-C 3.47Å; L119-G150 PolarHBondContact O-N 3.04Å; L119-M151 PolarHBondContact O-N 3.07Å; L119-M151 VanDerWaalsContact O-N 3.07Å; L119-W152 HydrophobicContact CB-CD2 3.83Å; L119-W152 HydrophobicContact CB-CE3 3.42Å; L119-W152 VanDerWaalsContact CB-CE3 3.42Å; L119-W152 HydrophobicContact CB-CG 4.4Å; L119-W152 HydrophobicContact CB-CH2 4.41Å; L119-W152 HydrophobicContact CB-CZ3 3.74Å; L119-W152 HydrophobicContact CD1-CE3 4Å; L119-W152 HydrophobicContact CD1-CH2 4.32Å; L119-W152 HydrophobicContact CD1-CZ3 3.56Å; L119-W152 HydrophobicContact CG-CE3 4.34Å; L119-W152 HydrophobicContact CG-CZ3 4.32Å; L119-W152 WeakPolarHBondContact O-CB 3.44Å; L119-W152 PolarHBondContact O-N 2.96Å; L119-M379 HydrophobicContact CD1-CE 4.23Å
120	G	97.4	Very high	96.8	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.021	19%	0.194	C	C	.	.			trans	97.2	127.8	171	0	0	0	0	0	114.4	E101 H149 G150 M151 W152	E101-G120 WeakPolarHBondContact OE1-CA 3.19Å; G120-H149 CarbonylContact O-C 3.59Å; G120-H149 WeakPolarHBondContact O-CA 3.46Å; G120-G150 PolarHBondContact O-N 3.16Å; G120-G150 VanDerWaalsContact O-N 3.14Å; G120-M151 WeakPolarHBondContact O-CB 3.48Å; G120-M151 PolarHBondContact O-N 3.13Å; G120-W152 VanDerWaalsContact CA-CD1 3.41Å
121	M	97.8	Very high	97.1	Very high	17 Å²	17	25.8 Å²	25.8	8%	0.084	16%	0.159	C	C	.	.	S	Bend	trans	-98.5	-17.9	179.6	-61.4	179.8	-62.7	0	0	114.7	N98 A100 E101 Y109 N147 I180	N98-M121 HydrophobicContact CB-CE 3.73Å; A100-M121 HydrophobicContact CB-CE 3.56Å; A100-M121 HydrophobicContact CB-SD 4.07Å; E101-M121 PolarHBondContact OE1-N 3.31Å; Y109-M121 HydrophobicContact CE1-SD 4.35Å; M121-N147 CarbonylContact C-O 3.19Å; M121-N147 WeakPolarHBondContact CA-O 3.43Å; M121-N147 PolarHBondContact O-N 2.8Å; M121-I180 HydrophobicContact CB-CD1 4.09Å; M121-I180 HydrophobicContact CB-CG1 4.37Å; M121-I180 HydrophobicContact CE-CD1 4.3Å; M121-I180 HydrophobicContact CE-CG1 4.41Å; M121-I180 HydrophobicContact CE-CG2 4.36Å
122	E	98.3	Very high	97.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	154.2	-176.5	77.5	-159.3	128.5	0	0	111.9	G96 N98 M146 A176 P179 I180 K390	G96-E122 PolarHBondContact N-O 2.95Å; G96-E122 VanDerWaalsContact N-O 3.14Å; N98-E122 PolarHBondContact ND2-OE1 2.92Å; N98-E122 PolarHBondContact OD1-OE1 3.01Å; N98-E122 VanDerWaalsContact OD1-OE1 3.11Å; E122-M146 HydrophobicContact CB-CG 4.45Å; E122-A176 WeakPolarHBondContact CG-O 3.39Å; E122-P179 VanDerWaalsContact OE2-CD 3.26Å; E122-P179 WeakPolarHBondContact OE2-CD 3.43Å; E122-I180 HydrophobicContact CB-CG1 3.98Å; E122-I180 HydrophobicContact CG-CG1 4.14Å; E122-I180 WeakPolarHBondContact OE1-CB 3.35Å; E122-I180 WeakPolarHBondContact OE1-CG1 3.28Å; E122-I180 WeakPolarHBondContact OE2-CB 3.34Å; E122-I180 VanDerWaalsContact OE2-CG1 3.29Å; E122-I180 WeakPolarHBondContact OE2-CG1 3.42Å; E122-I180 PolarHBondContact OE2-N 2.77Å; E122-K390 WeakPolarHBondContact OE1-CE 3.43Å; E122-K390 IonicContact OE1-NZ 3.77Å; E122-K390 PolarHBondContact OE1-NZ 3.29Å; E122-K390 IonicContact OE2-NZ 3.59Å
123	G	98.6	Very high	97.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	-172.6	170	0	0	0	0	0	111.4	A94 A145	A94-G123 CarbonylContact O-C 3.55Å; A94-G123 WeakPolarHBondContact O-CA 3.43Å; G123-A145 PolarHBondContact N-O 3.31Å; G123-A145 PolarHBondContact O-N 2.93Å
124	S	98.9	Very high	97.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	152.7	175.9	68.8	0	0	0	0	109.2	K93 A94 V143 F172	K93-S124 PolarHBondContact N-O 2.59Å; A94-S124 PolarHBondContact N-O 2.9Å; A94-S124 PolarHBondContact O-N 2.82Å; S124-V143 CarbonylContact C-O 3.54Å; S124-V143 WeakPolarHBondContact CA-O 3.4Å; S124-F172 WeakPolarHBondContact CB-O 3.45Å; S124-F172 VanDerWaalsContact OG-C 3.22Å; S124-F172 WeakPolarHBondContact OG-CA 3.39Å; S124-F172 WeakPolarHBondContact OG-CB 3.36Å; S124-F172 PolarHBondContact OG-O 3.42Å
125	G	98.8	Very high	97.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.6	-162.4	-173.8	0	0	0	0	0	113.9	R91 R142 V143 F172	R91-G125 CarbonylContact O-C 3.41Å; R91-G125 WeakPolarHBondContact O-CA 3.4Å; G125-R142 CarbonylContact O-C 3.03Å; G125-R142 WeakPolarHBondContact O-CA 3.41Å; G125-V143 PolarHBondContact N-O 3.12Å; G125-V143 PolarHBondContact O-N 3.26Å; G125-F172 WeakPolarHBondContact O-CE1 3.35Å
126	V	98.7	Very high	97.3	Very high	37 Å²	37	40.6 Å²	40.6	22%	0.224	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.6	179.5	-178.2	0	0	0	0	109.3	R91 E128 D141 F172	R91-V126 PolarHBondContact N-O 3.5Å; R91-V126 PolarHBondContact O-N 3.06Å; V126-E128 PolarHBondContact O-N 3.36Å; V126-D141 CarbonylContact C-O 3.47Å; V126-D141 VanDerWaalsContact CA-O 3.28Å; V126-D141 WeakPolarHBondContact CA-O 3.35Å; V126-F172 HydrophobicContact CG2-CE1 4.26Å; V126-F172 HydrophobicContact CG2-CZ 3.78Å
127	I	98.5	Very high	97.2	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	126.6	175	-63.3	-172.8	0	0	0	109.8	V88 L89 V90 V130 R137 K138 V139 G140 D141 V143	V88-I127 HydrophobicContact CB-CG2 4.48Å; V88-I127 HydrophobicContact CG1-CD1 4.46Å; L89-I127 CarbonylContact O-C 3.56Å; L89-I127 WeakPolarHBondContact O-CA 3.23Å; V90-I127 HydrophobicContact CG2-CG1 4.48Å; I127-V130 HydrophobicContact CG2-CG2 3.42Å; I127-V130 VanDerWaalsContact CG2-CG2 3.42Å; I127-R137 HydrophobicContact CD1-CB 3.82Å; I127-R137 HydrophobicContact CD1-CG 4.25Å; I127-K138 WeakPolarHBondContact CB-O 3.37Å; I127-V139 WeakPolarHBondContact O-CA 3.37Å; I127-G140 PolarHBondContact O-N 3.23Å; I127-D141 HydrophobicContact CD1-CB 4.05Å; I127-D141 HydrophobicContact CG1-CB 4.26Å; I127-D141 PolarHBondContact N-O 3.27Å; I127-V143 HydrophobicContact CD1-CG1 3.87Å; I127-V143 HydrophobicContact CD1-CG2 4.4Å; I127-V143 HydrophobicContact CG1-CG1 4.03Å; I127-V143 HydrophobicContact CG1-CG2 3.84Å
128	E	96.8	Very high	97.2	Very high	60 Å²	60	43.4 Å²	43.4	28%	0.28	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-25	176.9	-73.6	-162.5	171	0	0	114.1	L89 R91 V126	L89-E128 HydrophobicContact CD2-CB 4.32Å; L89-E128 HydrophobicContact CG-CB 4.41Å; L89-E128 PolarHBondContact O-N 3.06Å; R91-E128 HydrophobicContact CB-CG 3.8Å; R91-E128 WeakPolarHBondContact CB-OE1 3.43Å; R91-E128 IonicContact CZ-OE1 3.57Å; R91-E128 IonicContact CZ-OE2 3.52Å; R91-E128 IonicContact NE-OE1 2.76Å; R91-E128 PolarHBondContact NE-OE1 3.02Å; R91-E128 IonicContact NE-OE2 3.53Å; R91-E128 VanDerWaalsContact NH2-CD 3.32Å; R91-E128 IonicContact NH2-OE1 2.69Å; R91-E128 PolarHBondContact NH2-OE1 2.81Å; R91-E128 VanDerWaalsContact NH2-OE1 3.11Å; R91-E128 IonicContact NH2-OE2 2.74Å; R91-E128 PolarHBondContact NH2-OE2 2.94Å; V126-E128 PolarHBondContact O-N 3.36Å
129	A	95.9	Very high	97.2	Very high	12 Å²	12	47.4 Å²	47.4	10%	0.099	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	152.7	175.1	0	0	0	0	0	110.1	L83 V88 L89	L83-A129 HydrophobicContact CD1-CB 3.75Å; V88-A129 WeakPolarHBondContact CA-O 3.36Å; L89-A129 HydrophobicContact CB-CB 3.94Å; L89-A129 HydrophobicContact CD2-CB 4.4Å; L89-A129 PolarHBondContact N-O 3.5Å
130	V	96.8	Very high	97.2	Very high	39 Å²	39	49.6 Å²	49.6	24%	0.236	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	135.4	-176.8	-179.9	0	0	0	0	107	V88 I127 V134 V139	V88-V130 HydrophobicContact CG1-CB 4.41Å; V88-V130 HydrophobicContact CG1-CG1 4.14Å; V88-V130 HydrophobicContact CG1-CG2 4.12Å; I127-V130 HydrophobicContact CG2-CG2 3.42Å; I127-V130 VanDerWaalsContact CG2-CG2 3.42Å; V130-V134 HydrophobicContact CG1-CB 3.48Å; V130-V134 VanDerWaalsContact CG1-CB 3.48Å; V130-V134 HydrophobicContact CG1-CG1 3.58Å; V130-V134 HydrophobicContact CG1-CG2 4.48Å; V130-V139 HydrophobicContact CG2-CG2 4.44Å
131	A	96.1	Very high	97.2	Very high	10 Å²	10	51.1 Å²	51.1	8%	0.083	28%	0.28	C	S	.	.			trans	-64.9	152.5	172.7	0	0	0	0	0	111.1	L83 K84 E87 D133 V134	L83-A131 HydrophobicContact CB-CB 4.29Å; K84-A131 WeakPolarHBondContact O-CB 3.48Å; E87-A131 VanDerWaalsContact O-CB 3.29Å; E87-A131 WeakPolarHBondContact O-CB 3.48Å; E87-A131 PolarHBondContact O-N 3.5Å; A131-D133 WeakPolarHBondContact CB-OD1 3.35Å; A131-D133 PolarHBondContact O-N 3.25Å; A131-D133 VanDerWaalsContact O-N 3.15Å; A131-V134 HydrophobicContact CB-CG2 4.25Å; A131-V134 PolarHBondContact O-N 3.05Å; A131-V134 VanDerWaalsContact O-N 3.1Å
132	E	94.1	Very high	97.3	Very high	205 Å²	205	54.1 Å²	54.1	96%	0.958	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-29.2	-171.6	-64.9	-178.2	173	0	0	114.1
133	D	95.9	Very high	97.3	Very high	89 Å²	89	54.2 Å²	54.2	48%	0.476	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-10	-178.5	66.3	-47.1	0	0	0	114	A85 G86 A131 T135	A85-D133 VanDerWaalsContact CA-OD1 3.23Å; A85-D133 WeakPolarHBondContact CA-OD1 3.32Å; A85-D133 WeakPolarHBondContact CB-OD2 3.5Å; G86-D133 VanDerWaalsContact N-CG 3.29Å; G86-D133 PolarHBondContact N-OD1 3.03Å; G86-D133 PolarHBondContact N-OD2 2.96Å; A131-D133 WeakPolarHBondContact CB-OD1 3.35Å; A131-D133 PolarHBondContact O-N 3.25Å; A131-D133 VanDerWaalsContact O-N 3.15Å; D133-T135 PolarHBondContact O-N 2.89Å
134	V	96.8	Very high	97.3	Very high	17 Å²	17	54.2 Å²	54.2	10%	0.103	29%	0.291	C	S	.	.			trans	-87.4	111.8	179.5	175.9	0	0	0	0	109.4	V88 V130 A131 R137 A160	V88-V134 HydrophobicContact CG1-CG1 4.23Å; V130-V134 HydrophobicContact CG1-CB 3.48Å; V130-V134 VanDerWaalsContact CG1-CB 3.48Å; V130-V134 HydrophobicContact CG1-CG1 3.58Å; V130-V134 HydrophobicContact CG1-CG2 4.48Å; A131-V134 HydrophobicContact CB-CG2 4.25Å; A131-V134 PolarHBondContact O-N 3.05Å; A131-V134 VanDerWaalsContact O-N 3.1Å; V134-R137 HydrophobicContact CG1-CB 3.89Å; V134-R137 HydrophobicContact CG1-CG 4.09Å; V134-A160 HydrophobicContact CB-CB 4.45Å; V134-A160 HydrophobicContact CG1-CB 3.69Å; V134-A160 HydrophobicContact CG2-CB 3.82Å
135	T	95.6	Very high	97.3	Very high	136 Å²	136	54.2 Å²	54.2	83%	0.834	29%	0.291	S	S	*	.			trans	-107.5	-13.9	-171.8	53.3	0	0	0	0	114.4	D133	D133-T135 PolarHBondContact O-N 2.89Å
136	D	95.5	Very high	97.2	Very high	98 Å²	98	54.6 Å²	54.6	52%	0.524	29%	0.293	S	S	.	.	S	Bend	trans	-103.6	9.5	-174.4	69.3	-32.5	0	0	0	113.2
137	R	97.1	Very high	97	Very high	42 Å²	42	55.3 Å²	55.3	16%	0.158	30%	0.296	C	S	.	.			trans	-135.4	150.2	176.1	-60.8	-64.9	179.9	-78.8	-9.1	110	V88 I127 V134 T163	V88-R137 HydrophobicContact CG1-CB 4.38Å; I127-R137 HydrophobicContact CD1-CB 3.82Å; I127-R137 HydrophobicContact CD1-CG 4.25Å; V134-R137 HydrophobicContact CG1-CB 3.89Å; V134-R137 HydrophobicContact CG1-CG 4.09Å; R137-T163 PolarHBondContact NE-O 2.95Å; R137-T163 PolarHBondContact NE-OG1 3.36Å; R137-T163 PolarHBondContact NH2-O 3.38Å
138	K	96.9	Very high	96.7	Very high	136 Å²	136	60.1 Å²	60.1	59%	0.591	31%	0.314	S	S	*	.			trans	-138.7	156.6	175.6	62.4	-177.1	-179	-55.3	0	112.8	I127 G140 D141	I127-K138 WeakPolarHBondContact CB-O 3.37Å; K138-G140 PolarHBondContact O-N 3.48Å; K138-D141 WeakPolarHBondContact CE-OD1 3.23Å; K138-D141 VanDerWaalsContact CG-CG 3.48Å; K138-D141 VanDerWaalsContact CG-OD1 3.25Å; K138-D141 WeakPolarHBondContact CG-OD1 3.49Å; K138-D141 VanDerWaalsContact CG-OD2 3.32Å; K138-D141 WeakPolarHBondContact CG-OD2 3.35Å; K138-D141 PolarHBondContact N-OD2 3.04Å; K138-D141 IonicContact NZ-OD1 2.81Å; K138-D141 PolarHBondContact NZ-OD1 3.19Å; K138-D141 IonicContact NZ-OD2 3.64Å; K138-D141 VanDerWaalsContact O-CB 3.3Å; K138-D141 WeakPolarHBondContact O-CB 3.32Å; K138-D141 VanDerWaalsContact O-CG 3.27Å; K138-D141 PolarHBondContact O-N 3.09Å; K138-D141 VanDerWaalsContact O-N 3.14Å
139	V	97.9	Very high	96.7	Very high	94 Å²	94	60.2 Å²	60.2	57%	0.57	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	135.9	171.3	176.9	0	0	0	0	109.9	I127 V130	I127-V139 WeakPolarHBondContact O-CA 3.37Å; V130-V139 HydrophobicContact CG2-CG2 4.44Å
140	G	98.1	Very high	96.7	Very high	47 Å²	47	59.9 Å²	59.9	49%	0.485	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	-12	-175.9	0	0	0	0	0	114.5	I127 K138 R142	I127-G140 PolarHBondContact O-N 3.23Å; K138-G140 PolarHBondContact O-N 3.48Å; G140-R142 PolarHBondContact O-N 3.44Å
141	D	98.4	Very high	96.8	Very high	33 Å²	33	58 Å²	58	18%	0.176	30%	0.301	C	S	.	.			trans	-63.3	133.5	175.8	-75.8	-16.8	0	0	0	111.3	V126 I127 K138 V143	V126-D141 CarbonylContact C-O 3.47Å; V126-D141 VanDerWaalsContact CA-O 3.28Å; V126-D141 WeakPolarHBondContact CA-O 3.35Å; I127-D141 HydrophobicContact CD1-CB 4.05Å; I127-D141 HydrophobicContact CG1-CB 4.26Å; I127-D141 PolarHBondContact N-O 3.27Å; K138-D141 WeakPolarHBondContact CE-OD1 3.23Å; K138-D141 VanDerWaalsContact CG-CG 3.48Å; K138-D141 VanDerWaalsContact CG-OD1 3.25Å; K138-D141 WeakPolarHBondContact CG-OD1 3.49Å; K138-D141 VanDerWaalsContact CG-OD2 3.32Å; K138-D141 WeakPolarHBondContact CG-OD2 3.35Å; K138-D141 PolarHBondContact N-OD2 3.04Å; K138-D141 IonicContact NZ-OD1 2.81Å; K138-D141 PolarHBondContact NZ-OD1 3.19Å; K138-D141 IonicContact NZ-OD2 3.64Å; K138-D141 VanDerWaalsContact O-CB 3.3Å; K138-D141 WeakPolarHBondContact O-CB 3.32Å; K138-D141 VanDerWaalsContact O-CG 3.27Å; K138-D141 PolarHBondContact O-N 3.09Å; K138-D141 VanDerWaalsContact O-N 3.14Å; D141-V143 HydrophobicContact CB-CG1 4.1Å
142	R	98.8	Very high	96.9	Very high	81 Å²	81	57.5 Å²	57.5	31%	0.306	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.4	171.1	-62.1	175.7	64.3	-137.1	-2.6	108.2	G125 G140 I166 M170 F172	G125-R142 CarbonylContact O-C 3.03Å; G125-R142 WeakPolarHBondContact O-CA 3.41Å; G140-R142 PolarHBondContact O-N 3.44Å; R142-I166 HydrophobicContact CB-CB 4.09Å; R142-I166 HydrophobicContact CB-CD1 4.16Å; R142-I166 HydrophobicContact CB-CG1 4.42Å; R142-I166 PolarHBondContact O-N 3.13Å; R142-M170 PolarHBondContact NH2-O 3.23Å; R142-F172 HydrophobicContact CB-CE1 4.23Å; R142-F172 HydrophobicContact CB-CZ 4.42Å; R142-F172 HydrophobicContact CG-CE1 4.32Å; R142-F172 HydrophobicContact CG-CZ 4.01Å
143	V	98.8	Very high	97.1	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.3	-173.1	-63.3	0	0	0	0	113.2	V90 S124 G125 I127 D141 F164 I166	V90-V143 HydrophobicContact CG1-CG2 4.16Å; V90-V143 HydrophobicContact CG2-CG2 4Å; S124-V143 CarbonylContact C-O 3.54Å; S124-V143 WeakPolarHBondContact CA-O 3.4Å; G125-V143 PolarHBondContact N-O 3.12Å; G125-V143 PolarHBondContact O-N 3.26Å; I127-V143 HydrophobicContact CD1-CG1 3.87Å; I127-V143 HydrophobicContact CD1-CG2 4.4Å; I127-V143 HydrophobicContact CG1-CG1 4.03Å; I127-V143 HydrophobicContact CG1-CG2 3.84Å; D141-V143 HydrophobicContact CB-CG1 4.1Å; V143-F164 CarbonylContact C-O 3.6Å; V143-F164 VanDerWaalsContact CA-O 3.25Å; V143-F164 WeakPolarHBondContact CA-O 3.18Å; V143-I166 VanDerWaalsContact C-CG1 3.5Å
144	I	98.8	Very high	97.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.8	152.2	-64.6	175.6	0	0	0	106.7	M146 T163 F164 I166 A175 L178 P179 L354	I144-M146 HydrophobicContact CG2-CG 4.43Å; I144-T163 CarbonylContact O-C 3.59Å; I144-T163 WeakPolarHBondContact O-CA 3.23Å; I144-F164 HydrophobicContact CB-CB 4.29Å; I144-F164 PolarHBondContact N-O 3.2Å; I144-F164 PolarHBondContact O-N 2.7Å; I144-I166 HydrophobicContact CG1-CG1 4.02Å; I144-A175 HydrophobicContact CD1-CB 4.43Å; I144-A175 HydrophobicContact CG1-CB 3.82Å; I144-L178 HydrophobicContact CD1-CD2 4.1Å; I144-P179 HydrophobicContact CG2-CB 4.33Å; I144-P179 HydrophobicContact CG2-CG 3.33Å; I144-L354 HydrophobicContact CD1-CD2 3.87Å
145	A	98.2	Very high	97.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133.4	177.1	0	0	0	0	0	110.3	V90 G123 M151 V158 T163	V90-A145 HydrophobicContact CG2-CB 4.39Å; G123-A145 PolarHBondContact N-O 3.31Å; G123-A145 PolarHBondContact O-N 2.93Å; A145-M151 HydrophobicContact CB-CE 3.69Å; A145-V158 HydrophobicContact CB-CG2 4.34Å; A145-T163 HydrophobicContact CB-CG2 4.38Å
146	M	97	Very high	97.3	Very high	8 Å²	8	38.7 Å²	38.7	4%	0.039	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144	178.8	-62.8	-176.4	73	0	0	110.8	E122 I144 R162 P179 I180 M183 L337 F346 L350	E122-M146 HydrophobicContact CB-CG 4.45Å; I144-M146 HydrophobicContact CG2-CG 4.43Å; M146-R162 PolarHBondContact N-O 3.22Å; M146-R162 WeakPolarHBondContact O-CB 3.36Å; M146-P179 HydrophobicContact CE-CB 3.6Å; M146-P179 HydrophobicContact CG-CB 3.93Å; M146-P179 HydrophobicContact CG-CG 4.32Å; M146-P179 HydrophobicContact SD-CB 3.2Å; M146-P179 WeakPolarHBondContact SD-CB 3.5Å; M146-P179 HydrophobicContact SD-CG 4.12Å; M146-I180 HydrophobicContact CE-CD1 3.55Å; M146-I180 HydrophobicContact CE-CG1 4.12Å; M146-M183 HydrophobicContact CE-SD 4.08Å; M146-M183 HydrophobicContact SD-SD 3.97Å; M146-L337 HydrophobicContact CE-CD2 4.4Å; M146-F346 HydrophobicContact CB-CZ 4.38Å; M146-F346 HydrophobicContact CE-CE2 4.07Å; M146-F346 HydrophobicContact CE-CZ 3.63Å; M146-F346 HydrophobicContact SD-CE1 3.96Å; M146-F346 HydrophobicContact SD-CE2 4.31Å; M146-F346 HydrophobicContact SD-CZ 3.34Å; M146-F346 WeakPolarHBondContact SD-CZ 3.42Å; M146-L350 HydrophobicContact SD-CD2 4.27Å
147	N	94.4	Very high	97.4	Very high	53 Å²	53	36 Å²	36	28%	0.283	18%	0.182	S	C	.	.			trans	-150.8	168.5	174.5	-158.4	-6.9	0	0	0	109.7	M121 H149 M151 V158	M121-N147 CarbonylContact C-O 3.19Å; M121-N147 WeakPolarHBondContact CA-O 3.43Å; M121-N147 PolarHBondContact O-N 2.8Å; N147-H149 VanDerWaalsContact C-N 3.27Å; N147-H149 WeakPolarHBondContact CB-O 3.43Å; N147-H149 PolarHBondContact ND2-O 3.3Å; N147-H149 PolarHBondContact O-N 3.08Å; N147-M151 HydrophobicContact CB-CG 4.18Å; N147-M151 HydrophobicContact CB-SD 4.01Å; N147-V158 HydrophobicContact CB-CG1 4.28Å
148	R	92.6	Very high	97.4	Very high	102 Å²	102	34 Å²	34	39%	0.385	17%	0.174	S	C	.	.	S	Bend	trans	-70.8	-27.3	175.9	-67.9	-178.5	177.7	-79.9	-9.2	112.5	G338	R148-G338 PolarHBondContact NH1-O 2.97Å
149	H	96.4	Very high	97.3	Very high	61 Å²	61	29.8 Å²	29.8	28%	0.282	16%	0.161	S	C	.	.	S	Bend	trans	-164.1	178.4	175.9	57.5	80.8	0	0	0	108.4	L112 P113 V117 G120 N147	L112-H149 HydrophobicContact CD1-CB 3.89Å; P113-H149 VanDerWaalsContact CD-CD2 3.41Å; P113-H149 WeakPolarHBondContact CD-CD2 3.38Å; P113-H149 WeakPolarHBondContact CG-NE2 3.44Å; V117-H149 HydrophobicContact CG2-CB 4.48Å; G120-H149 CarbonylContact O-C 3.59Å; G120-H149 WeakPolarHBondContact O-CA 3.46Å; N147-H149 VanDerWaalsContact C-N 3.27Å; N147-H149 WeakPolarHBondContact CB-O 3.43Å; N147-H149 PolarHBondContact ND2-O 3.3Å; N147-H149 PolarHBondContact O-N 3.08Å
150	G	96.9	Very high	97.3	Very high	5 Å²	5	25.6 Å²	25.6	5%	0.052	14%	0.136	C	C	.	.			trans	81.9	18.6	172.9	0	0	0	0	0	115.5	T118 L119 G120 Q153	T118-G150 WeakPolarHBondContact O-CA 3.38Å; T118-G150 PolarHBondContact O-N 3.16Å; L119-G150 CarbonylContact O-C 3.47Å; L119-G150 PolarHBondContact O-N 3.04Å; G120-G150 PolarHBondContact O-N 3.16Å; G120-G150 VanDerWaalsContact O-N 3.14Å; G150-Q153 VanDerWaalsContact O-CG 3.26Å; G150-Q153 WeakPolarHBondContact O-CG 3.16Å; G150-Q153 PolarHBondContact O-NE2 2.84Å
151	M	98.4	Very high	97.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.136	C	C	.	.			trans	-87.9	-17.9	174	-65.6	-54.1	-57.3	0	0	113.8	V92 C95 L119 G120 A145 N147 Q153 A156 V158	V92-M151 HydrophobicContact CG2-CE 4.13Å; C95-M151 PolarHBondContact SG-O 2.87Å; L119-M151 PolarHBondContact O-N 3.07Å; L119-M151 VanDerWaalsContact O-N 3.07Å; G120-M151 WeakPolarHBondContact O-CB 3.48Å; G120-M151 PolarHBondContact O-N 3.13Å; A145-M151 HydrophobicContact CB-CE 3.69Å; N147-M151 HydrophobicContact CB-CG 4.18Å; N147-M151 HydrophobicContact CB-SD 4.01Å; M151-Q153 PolarHBondContact O-N 3.25Å; M151-A156 HydrophobicContact CE-CB 4.14Å; M151-A156 HydrophobicContact SD-CB 4.01Å; M151-V158 HydrophobicContact SD-CG1 3.83Å
152	W	98.5	Very high	97	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-83.3	60.5	177.6	-62.6	-0.4	0	0	0	111.8	A59 L60 C95 G96 L97 E101 L119 G120 F372 V375 M379 L393	A59-W152 WeakPolarHBondContact CA-O 3.42Å; L60-W152 HydrophobicContact CB-CB 3.98Å; L60-W152 HydrophobicContact CB-CE3 4.1Å; L60-W152 HydrophobicContact CD1-CB 4.23Å; L60-W152 HydrophobicContact CD1-CD2 4.43Å; L60-W152 HydrophobicContact CD1-CE3 3.93Å; L60-W152 PolarHBondContact N-O 3.47Å; C95-W152 VanDerWaalsContact CB-CD1 3.47Å; G96-W152 PolarHBondContact O-NE1 2.8Å; G96-W152 VanDerWaalsContact O-NE1 3.14Å; L97-W152 HydrophobicContact CB-CZ2 4.17Å; L97-W152 HydrophobicContact CD1-CH2 4.15Å; L97-W152 HydrophobicContact CD1-CZ2 4.23Å; L97-W152 HydrophobicContact CG-CH2 4.1Å; L97-W152 HydrophobicContact CG-CZ2 3.85Å; E101-W152 HydrophobicContact CB-CH2 3.73Å; E101-W152 HydrophobicContact CB-CZ2 3.97Å; E101-W152 HydrophobicContact CG-CH2 3.82Å; E101-W152 HydrophobicContact CG-CZ2 3.63Å; L119-W152 HydrophobicContact CB-CD2 3.83Å; L119-W152 HydrophobicContact CB-CE3 3.42Å; L119-W152 VanDerWaalsContact CB-CE3 3.42Å; L119-W152 HydrophobicContact CB-CG 4.4Å; L119-W152 HydrophobicContact CB-CH2 4.41Å; L119-W152 HydrophobicContact CB-CZ3 3.74Å; L119-W152 HydrophobicContact CD1-CE3 4Å; L119-W152 HydrophobicContact CD1-CH2 4.32Å; L119-W152 HydrophobicContact CD1-CZ3 3.56Å; L119-W152 HydrophobicContact CG-CE3 4.34Å; L119-W152 HydrophobicContact CG-CZ3 4.32Å; L119-W152 WeakPolarHBondContact O-CB 3.44Å; L119-W152 PolarHBondContact O-N 2.96Å; G120-W152 VanDerWaalsContact CA-CD1 3.41Å; W152-F372 HydrophobicContact CB-CZ 4.49Å; W152-V375 HydrophobicContact CE3-CG2 4.44Å; W152-V375 HydrophobicContact CZ3-CG2 4.01Å; W152-M379 HydrophobicContact CH2-CE 3.37Å; W152-M379 HydrophobicContact CZ3-CE 3.49Å; W152-M379 VanDerWaalsContact CZ3-CE 3.49Å; W152-L393 HydrophobicContact CD2-CD1 3.51Å; W152-L393 VanDerWaalsContact CE2-CD1 3.46Å; W152-L393 HydrophobicContact CE3-CD1 3.82Å; W152-L393 HydrophobicContact CG-CD1 4Å; W152-L393 HydrophobicContact CH2-CD1 4.09Å; W152-L393 HydrophobicContact CZ2-CD1 3.78Å; W152-L393 HydrophobicContact CZ3-CD1 4.11Å
153	Q	98.3	Very high	97	Very high	19 Å²	19	23.9 Å²	23.9	9%	0.089	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-151.8	154.8	175.8	52	-175.5	-9.1	0	0	109.8	Y57 R58 A59 V92 T118 G150 M151 L155 A156	Y57-Q153 HydrophobicContact CD2-CB 4.31Å; Y57-Q153 HydrophobicContact CE2-CB 4.23Å; Y57-Q153 VanDerWaalsContact CE2-OE1 3.29Å; R58-Q153 CarbonylContact O-C 3.59Å; R58-Q153 VanDerWaalsContact O-CA 3.26Å; R58-Q153 WeakPolarHBondContact O-CA 3.31Å; A59-Q153 HydrophobicContact CB-CB 3.58Å; V92-Q153 VanDerWaalsContact CB-O 3.29Å; V92-Q153 WeakPolarHBondContact CB-O 3.4Å; V92-Q153 VanDerWaalsContact CG2-O 3.27Å; V92-Q153 WeakPolarHBondContact CG2-O 3.46Å; T118-Q153 HydrophobicContact CG2-CB 4.1Å; T118-Q153 HydrophobicContact CG2-CG 4.09Å; G150-Q153 VanDerWaalsContact O-CG 3.26Å; G150-Q153 WeakPolarHBondContact O-CG 3.16Å; G150-Q153 PolarHBondContact O-NE2 2.84Å; M151-Q153 PolarHBondContact O-N 3.25Å; Q153-L155 VanDerWaalsContact C-N 3.26Å; Q153-L155 WeakPolarHBondContact CG-O 3.34Å; Q153-L155 PolarHBondContact NE2-O 3.31Å; Q153-L155 PolarHBondContact O-N 3.17Å; Q153-L155 PolarHBondContact OE1-O 3.5Å; Q153-A156 HydrophobicContact CG-CB 4.37Å
154	E	98.4	Very high	96.9	Very high	30 Å²	30	24.3 Å²	24.3	14%	0.14	12%	0.121	C	C	.	.	S	Bend	trans	-67.4	-28.7	-179.6	-68.8	171.6	160.4	0	0	112.6	Y57 R58 R91 V92 P395	Y57-E154 WeakPolarHBondContact CA-OE2 3.42Å; R58-E154 HydrophobicContact CB-CG 4.18Å; R58-E154 IonicContact CZ-OE1 3.59Å; R58-E154 PolarHBondContact N-OE2 2.87Å; R58-E154 IonicContact NE-OE1 2.84Å; R58-E154 PolarHBondContact NE-OE1 3.39Å; R58-E154 IonicContact NH2-OE1 3.64Å; R58-E154 PolarHBondContact O-N 2.7Å; R91-E154 CarbonylContact C-O 3.59Å; R91-E154 WeakPolarHBondContact CA-O 3.46Å; R91-E154 WeakPolarHBondContact CD-O 3.44Å; V92-E154 PolarHBondContact N-O 3.31Å; E154-P395 HydrophobicContact CB-CB 4.35Å; E154-P395 HydrophobicContact CG-CB 3.65Å
155	L	97.4	Very high	96.9	Very high	2 Å²	2	28 Å²	28	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	120.1	177.6	-77.3	-178.9	0	0	0	110.3	I55 Y57 M78 L89 R91 Q153	I55-L155 HydrophobicContact CG2-CD1 3.76Å; Y57-L155 HydrophobicContact CD1-CB 4.18Å; Y57-L155 HydrophobicContact CD1-CD1 4.01Å; Y57-L155 HydrophobicContact CD2-CB 4.13Å; Y57-L155 HydrophobicContact CG-CB 3.92Å; Y57-L155 HydrophobicContact CG-CD1 4.19Å; Y57-L155 HydrophobicContact CG-CG 4.32Å; M78-L155 HydrophobicContact CG-CD1 4.48Å; M78-L155 HydrophobicContact SD-CB 4.18Å; M78-L155 HydrophobicContact SD-CD1 3.98Å; L89-L155 HydrophobicContact CD1-CB 4.11Å; L89-L155 HydrophobicContact CD1-CD2 4.02Å; L89-L155 HydrophobicContact CD2-CD2 4.23Å; L89-L155 HydrophobicContact CG-CD2 4.08Å; R91-L155 HydrophobicContact CB-CD2 4.42Å; R91-L155 VanDerWaalsContact NH1-CG 3.33Å; R91-L155 VanDerWaalsContact NH2-CD2 3.32Å; Q153-L155 VanDerWaalsContact C-N 3.26Å; Q153-L155 WeakPolarHBondContact CG-O 3.34Å; Q153-L155 PolarHBondContact NE2-O 3.31Å; Q153-L155 PolarHBondContact O-N 3.17Å; Q153-L155 PolarHBondContact OE1-O 3.5Å
156	A	97.1	Very high	96.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.4	178.5	0	0	0	0	0	110.5	V90 V92 M151 Q153 V158	V90-A156 PolarHBondContact N-O 3.49Å; V90-A156 PolarHBondContact O-N 3.45Å; V92-A156 HydrophobicContact CG2-CB 3.82Å; M151-A156 HydrophobicContact CE-CB 4.14Å; M151-A156 HydrophobicContact SD-CB 4.01Å; Q153-A156 HydrophobicContact CG-CB 4.37Å; A156-V158 HydrophobicContact CB-CG1 4.32Å
157	V	96.6	Very high	96.9	Very high	41 Å²	41	28.8 Å²	28.8	25%	0.248	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	124.8	165.8	179.1	0	0	0	0	107.7	M78 L83 E87 V88 L89	M78-V157 HydrophobicContact CE-CG2 3.93Å; L83-V157 HydrophobicContact CD2-CB 4.44Å; L83-V157 HydrophobicContact CD2-CG1 3.8Å; L83-V157 HydrophobicContact CD2-CG2 3.84Å; E87-V157 HydrophobicContact CB-CG1 3.91Å; E87-V157 VanDerWaalsContact CD-CG1 3.49Å; E87-V157 HydrophobicContact CG-CG1 4.08Å; E87-V157 VanDerWaalsContact OE2-CG1 3.29Å; E87-V157 WeakPolarHBondContact OE2-CG1 3.43Å; V88-V157 WeakPolarHBondContact O-CA 3.45Å; L89-V157 HydrophobicContact CD1-CG2 3.92Å
158	V	96.6	Very high	96.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	150.5	-178	-63.7	0	0	0	0	110.6	E87 V88 V90 A145 N147 M151 A156 A160 T163	E87-V158 WeakPolarHBondContact CA-O 3.38Å; V88-V158 HydrophobicContact CG2-CG2 3.66Å; V88-V158 PolarHBondContact N-O 3.43Å; V88-V158 PolarHBondContact O-N 2.96Å; V90-V158 HydrophobicContact CG2-CG2 3.82Å; A145-V158 HydrophobicContact CB-CG2 4.34Å; N147-V158 HydrophobicContact CB-CG1 4.28Å; M151-V158 HydrophobicContact SD-CG1 3.83Å; A156-V158 HydrophobicContact CB-CG1 4.32Å; V158-A160 PolarHBondContact O-N 3.43Å; V158-T163 HydrophobicContact CG2-CG2 3.43Å; V158-T163 VanDerWaalsContact CG2-CG2 3.43Å
159	P	96.3	Very high	96.9	Very high	48 Å²	48	32.5 Å²	32.5	31%	0.312	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	135.1	168.7	-23.8	35	0	0	0	111	N161 R162	P159-N161 VanDerWaalsContact C-N 3.25Å; P159-N161 WeakPolarHBondContact CB-OD1 3Å; P159-N161 PolarHBondContact O-N 3.06Å; P159-R162 HydrophobicContact CB-CB 4.36Å; P159-R162 HydrophobicContact CB-CG 4.16Å; P159-R162 HydrophobicContact CG-CG 4.4Å; P159-R162 WeakPolarHBondContact O-CA 3.1Å; P159-R162 PolarHBondContact O-N 2.64Å
160	A	96.7	Very high	97	Very high	6 Å²	6	29.7 Å²	29.7	5%	0.05	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-58.2	-38.3	-178.9	0	0	0	0	0	112.1	G86 V88 V134 V158 R162 T163	G86-A160 WeakPolarHBondContact O-CB 3.39Å; G86-A160 PolarHBondContact O-N 3.3Å; V88-A160 HydrophobicContact CG1-CB 4.03Å; V134-A160 HydrophobicContact CB-CB 4.45Å; V134-A160 HydrophobicContact CG1-CB 3.69Å; V134-A160 HydrophobicContact CG2-CB 3.82Å; V158-A160 PolarHBondContact O-N 3.43Å; A160-R162 PolarHBondContact O-N 2.9Å; A160-R162 VanDerWaalsContact O-N 3.17Å; A160-T163 PolarHBondContact O-N 3.46Å; A160-T163 PolarHBondContact O-OG1 3.19Å
161	N	95	Very high	97.1	Very high	88 Å²	88	31.1 Å²	31.1	47%	0.471	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-69.2	-6.2	175.9	71.5	-12.9	0	0	0	114.4	P159	P159-N161 VanDerWaalsContact C-N 3.25Å; P159-N161 WeakPolarHBondContact CB-OD1 3Å; P159-N161 PolarHBondContact O-N 3.06Å
162	R	95.9	Very high	97.1	Very high	37 Å²	37	33.1 Å²	33.1	14%	0.14	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-104.9	17.8	170.3	-63	-64.5	-173.3	142.9	2.6	112.1	M146 P159 A160 E343 F346	M146-R162 PolarHBondContact N-O 3.22Å; M146-R162 WeakPolarHBondContact O-CB 3.36Å; P159-R162 HydrophobicContact CB-CB 4.36Å; P159-R162 HydrophobicContact CB-CG 4.16Å; P159-R162 HydrophobicContact CG-CG 4.4Å; P159-R162 WeakPolarHBondContact O-CA 3.1Å; P159-R162 PolarHBondContact O-N 2.64Å; A160-R162 PolarHBondContact O-N 2.9Å; A160-R162 VanDerWaalsContact O-N 3.17Å; R162-E343 IonicContact CZ-OE1 3.53Å; R162-E343 IonicContact CZ-OE2 3.07Å; R162-E343 IonicContact NE-OE1 2.76Å; R162-E343 IonicContact NE-OE2 3.63Å; R162-E343 PolarHBondContact NE-OE2 3.11Å; R162-E343 IonicContact NH2-OE1 2.69Å; R162-E343 PolarHBondContact NH2-OE1 3.36Å; R162-E343 IonicContact NH2-OE2 2.97Å; R162-E343 PolarHBondContact NH2-OE2 3.09Å; R162-F346 VanDerWaalsContact NH1-CE1 3.32Å
163	T	98.1	Very high	97.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.1	172	70.2	0	0	0	0	111.6	V88 R137 I144 A145 V158 A160	V88-T163 HydrophobicContact CG2-CG2 3.67Å; R137-T163 PolarHBondContact NE-O 2.95Å; R137-T163 PolarHBondContact NE-OG1 3.36Å; R137-T163 PolarHBondContact NH2-O 3.38Å; I144-T163 CarbonylContact O-C 3.59Å; I144-T163 WeakPolarHBondContact O-CA 3.23Å; A145-T163 HydrophobicContact CB-CG2 4.38Å; V158-T163 HydrophobicContact CG2-CG2 3.43Å; V158-T163 VanDerWaalsContact CG2-CG2 3.43Å; A160-T163 PolarHBondContact O-N 3.46Å; A160-T163 PolarHBondContact O-OG1 3.19Å
164	F	98.3	Very high	97.1	Very high	10 Å²	10	35.3 Å²	35.3	4%	0.044	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.2	-175	-63.3	-102.2	0	0	0	109.4	V143 I144 I166 F346 E347 L350 L354	V143-F164 CarbonylContact C-O 3.6Å; V143-F164 VanDerWaalsContact CA-O 3.25Å; V143-F164 WeakPolarHBondContact CA-O 3.18Å; I144-F164 HydrophobicContact CB-CB 4.29Å; I144-F164 PolarHBondContact N-O 3.2Å; I144-F164 PolarHBondContact O-N 2.7Å; F164-I166 PolarHBondContact O-N 3.46Å; F164-F346 HydrophobicContact CE2-CD1 4.46Å; F164-F346 HydrophobicContact CE2-CE1 4.01Å; F164-F346 HydrophobicContact CZ-CD1 4.19Å; F164-F346 HydrophobicContact CZ-CE1 4.19Å; F164-E347 HydrophobicContact CE1-CB 4.44Å; F164-E347 HydrophobicContact CE1-CG 4.08Å; F164-L350 HydrophobicContact CB-CD2 4.05Å; F164-L350 HydrophobicContact CD1-CB 4.28Å; F164-L350 HydrophobicContact CD1-CD2 3.73Å; F164-L350 HydrophobicContact CD1-CG 4Å; F164-L350 HydrophobicContact CD2-CD2 3.18Å; F164-L350 HydrophobicContact CD2-CG 4.29Å; F164-L350 HydrophobicContact CE1-CB 4.06Å; F164-L350 HydrophobicContact CE1-CD2 3.93Å; F164-L350 HydrophobicContact CE1-CG 4.24Å; F164-L350 HydrophobicContact CE2-CD2 3.45Å; F164-L350 VanDerWaalsContact CE2-CD2 3.45Å; F164-L350 HydrophobicContact CG-CD2 3.36Å; F164-L350 HydrophobicContact CG-CG 4.03Å; F164-L350 HydrophobicContact CZ-CB 4.32Å; F164-L350 HydrophobicContact CZ-CD2 3.81Å; F164-L354 HydrophobicContact CB-CD1 4.29Å
165	P	98.1	Very high	97.1	Very high	78 Å²	78	33.9 Å²	33.9	51%	0.506	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	136.5	178.9	-24.4	33.9	0	0	0	112.2	P167	P165-P167 WeakPolarHBondContact O-CD 3.31Å
166	I	98.6	Very high	97.2	Very high	12 Å²	12	33.8 Å²	33.8	6%	0.062	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-80	121.8	171.6	-63.2	175.6	0	0	0	108.1	R142 V143 I144 F164 M170 F172 A175	R142-I166 HydrophobicContact CB-CB 4.09Å; R142-I166 HydrophobicContact CB-CD1 4.16Å; R142-I166 HydrophobicContact CB-CG1 4.42Å; R142-I166 PolarHBondContact O-N 3.13Å; V143-I166 VanDerWaalsContact C-CG1 3.5Å; I144-I166 HydrophobicContact CG1-CG1 4.02Å; F164-I166 PolarHBondContact O-N 3.46Å; I166-M170 HydrophobicContact CG2-CB 3.71Å; I166-M170 HydrophobicContact CG2-CG 4.01Å; I166-M170 HydrophobicContact CG2-SD 4.06Å; I166-F172 HydrophobicContact CD1-CD1 3.6Å; I166-F172 HydrophobicContact CD1-CE1 3.71Å; I166-A175 HydrophobicContact CD1-CB 3.62Å; I166-A175 HydrophobicContact CG1-CB 3.82Å; I166-A175 HydrophobicContact CG2-CB 4.23Å
167	P	97	Very high	97.3	Very high	13 Å²	13	33.8 Å²	33.8	8%	0.084	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-57.5	152.8	174.3	-26.7	36.3	0	0	0	113.2	P165 G169 M170 L354 Q358	P165-P167 WeakPolarHBondContact O-CD 3.31Å; P167-G169 PolarHBondContact O-N 2.87Å; P167-M170 HydrophobicContact CG-CE 4.14Å; P167-M170 WeakPolarHBondContact O-CB 3.36Å; P167-M170 PolarHBondContact O-N 3.2Å; P167-M170 VanDerWaalsContact O-N 3.14Å; P167-L354 HydrophobicContact CG-CD2 3.94Å; P167-Q358 HydrophobicContact CB-CG 4Å; P167-Q358 HydrophobicContact CG-CG 4.16Å
168	D	92.8	Very high	97.4	Very high	156 Å²	156	31.9 Å²	31.9	83%	0.834	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	139.6	170.3	-69.1	-25.9	0	0	0	110.8	M170	D168-M170 PolarHBondContact O-N 3.34Å
169	G	93.2	Very high	97.5	Very high	76 Å²	76	31.9 Å²	31.9	78%	0.784	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.9	-14.7	-176.5	0	0	0	0	0	115.6	P167	P167-G169 PolarHBondContact O-N 2.87Å
170	M	98.4	Very high	97.6	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	18%	0.183	C	C	.	.			trans	-79.6	127.2	173.2	-173.9	-174.8	-70.7	0	0	110.7	R142 I166 P167 D168 E174 A175 L178 L354 Y357	R142-M170 PolarHBondContact NH2-O 3.23Å; I166-M170 HydrophobicContact CG2-CB 3.71Å; I166-M170 HydrophobicContact CG2-CG 4.01Å; I166-M170 HydrophobicContact CG2-SD 4.06Å; P167-M170 HydrophobicContact CG-CE 4.14Å; P167-M170 WeakPolarHBondContact O-CB 3.36Å; P167-M170 PolarHBondContact O-N 3.2Å; P167-M170 VanDerWaalsContact O-N 3.14Å; D168-M170 PolarHBondContact O-N 3.34Å; M170-E174 HydrophobicContact CG-CB 3.91Å; M170-A175 HydrophobicContact CG-CB 4.24Å; M170-A175 HydrophobicContact SD-CB 3.71Å; M170-L178 HydrophobicContact CE-CD2 4.38Å; M170-L354 HydrophobicContact CE-CD2 3.93Å; M170-Y357 WeakPolarHBondContact CA-OH 3.43Å; M170-Y357 HydrophobicContact CB-CE1 3.66Å; M170-Y357 HydrophobicContact CE-CD1 3.2Å; M170-Y357 HydrophobicContact CE-CD2 3.61Å; M170-Y357 HydrophobicContact CE-CE1 3.4Å; M170-Y357 VanDerWaalsContact CE-CE1 3.4Å; M170-Y357 HydrophobicContact CE-CE2 3.77Å; M170-Y357 HydrophobicContact CE-CG 3.31Å; M170-Y357 HydrophobicContact CG-CE1 4.03Å; M170-Y357 HydrophobicContact CG-CE2 4.35Å
171	S	98.8	Very high	97.7	Very high	35 Å²	35	30.9 Å²	30.9	25%	0.245	18%	0.183	C	C	.	.			trans	-72.4	162.3	174	61.9	0	0	0	0	112.3	E173 E174 A175	S171-E173 VanDerWaalsContact C-N 3.27Å; S171-E173 PolarHBondContact O-N 2.63Å; S171-E174 PolarHBondContact N-OE2 3.22Å; S171-E174 PolarHBondContact O-N 3.22Å; S171-E174 WeakPolarHBondContact OG-CB 3.49Å; S171-E174 VanDerWaalsContact OG-CD 3.29Å; S171-E174 WeakPolarHBondContact OG-CG 3.36Å; S171-E174 PolarHBondContact OG-N 2.91Å; S171-E174 VanDerWaalsContact OG-N 3.16Å; S171-E174 PolarHBondContact OG-OE2 3.22Å; S171-A175 VanDerWaalsContact O-CB 3.27Å; S171-A175 WeakPolarHBondContact O-CB 3.44Å; S171-A175 PolarHBondContact O-N 2.96Å
172	F	98.9	Very high	97.8	Very high	43 Å²	43	26.8 Å²	26.8	19%	0.189	16%	0.161	C	C	.	.	H	α-helix	trans	-63.4	-36.8	174.1	-74	-66.5	0	0	0	111.3	K93 A94 S124 G125 V126 R142 I166 A175 A176	K93-F172 HydrophobicContact CB-CB 3.95Å; K93-F172 HydrophobicContact CB-CD1 3.97Å; K93-F172 HydrophobicContact CB-CD2 3.92Å; K93-F172 HydrophobicContact CB-CE1 4.46Å; K93-F172 HydrophobicContact CB-CE2 4.4Å; K93-F172 HydrophobicContact CB-CG 3.67Å; K93-F172 HydrophobicContact CG-CD1 4.23Å; K93-F172 HydrophobicContact CG-CD2 4.09Å; K93-F172 HydrophobicContact CG-CE1 4.22Å; K93-F172 HydrophobicContact CG-CE2 4.06Å; K93-F172 HydrophobicContact CG-CG 4.17Å; K93-F172 HydrophobicContact CG-CZ 4.12Å; A94-F172 HydrophobicContact CB-CB 4.31Å; S124-F172 WeakPolarHBondContact CB-O 3.45Å; S124-F172 VanDerWaalsContact OG-C 3.22Å; S124-F172 WeakPolarHBondContact OG-CA 3.39Å; S124-F172 WeakPolarHBondContact OG-CB 3.36Å; S124-F172 PolarHBondContact OG-O 3.42Å; G125-F172 WeakPolarHBondContact O-CE1 3.35Å; V126-F172 HydrophobicContact CG2-CE1 4.26Å; V126-F172 HydrophobicContact CG2-CZ 3.78Å; R142-F172 HydrophobicContact CB-CE1 4.23Å; R142-F172 HydrophobicContact CB-CZ 4.42Å; R142-F172 HydrophobicContact CG-CE1 4.32Å; R142-F172 HydrophobicContact CG-CZ 4.01Å; I166-F172 HydrophobicContact CD1-CD1 3.6Å; I166-F172 HydrophobicContact CD1-CE1 3.71Å; F172-A175 WeakPolarHBondContact O-CB 3.49Å; F172-A175 PolarHBondContact O-N 3.45Å; F172-A176 WeakPolarHBondContact O-CB 3.42Å; F172-A176 PolarHBondContact O-N 3.4Å
173	E	98.8	Very high	98	Very high	42 Å²	42	25 Å²	25	20%	0.196	16%	0.155	C	C	.	.	H	α-helix	trans	-67.5	-42.5	179.4	-59.8	99.4	117.7	0	0	112.2	A94 S171 A175 A176 A177 I366 R369 I392 L394	A94-E173 HydrophobicContact CB-CG 4.17Å; S171-E173 VanDerWaalsContact C-N 3.27Å; S171-E173 PolarHBondContact O-N 2.63Å; E173-A175 VanDerWaalsContact C-N 3.35Å; E173-A176 PolarHBondContact O-N 2.65Å; E173-A177 VanDerWaalsContact O-CB 3.31Å; E173-A177 WeakPolarHBondContact O-CB 3.48Å; E173-A177 PolarHBondContact O-N 2.99Å; E173-I366 HydrophobicContact CB-CD1 4.26Å; E173-I366 HydrophobicContact CB-CG1 4.25Å; E173-I366 WeakPolarHBondContact O-CD1 3.27Å; E173-R369 IonicContact OE1-CZ 2.92Å; E173-R369 IonicContact OE1-NE 2.94Å; E173-R369 PolarHBondContact OE1-NE 2.96Å; E173-R369 IonicContact OE1-NH2 3.57Å; E173-I392 HydrophobicContact CB-CG1 4.27Å; E173-I392 HydrophobicContact CB-CG2 4.43Å; E173-I392 HydrophobicContact CG-CG2 4.04Å; E173-L394 HydrophobicContact CG-CD2 4.38Å
174	E	98.8	Very high	98	Very high	22 Å²	22	25.6 Å²	25.6	10%	0.103	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-44.1	172.4	-72.5	165.5	135.9	0	0	111.1	M170 S171 A176 A177 L178 Y357 K363 P364	M170-E174 HydrophobicContact CG-CB 3.91Å; S171-E174 PolarHBondContact N-OE2 3.22Å; S171-E174 PolarHBondContact O-N 3.22Å; S171-E174 WeakPolarHBondContact OG-CB 3.49Å; S171-E174 VanDerWaalsContact OG-CD 3.29Å; S171-E174 WeakPolarHBondContact OG-CG 3.36Å; S171-E174 PolarHBondContact OG-N 2.91Å; S171-E174 VanDerWaalsContact OG-N 3.16Å; S171-E174 PolarHBondContact OG-OE2 3.22Å; E174-A176 VanDerWaalsContact C-N 3.29Å; E174-A176 PolarHBondContact O-N 3.16Å; E174-A177 PolarHBondContact O-N 2.95Å; E174-L178 PolarHBondContact O-N 3.45Å; E174-Y357 PolarHBondContact OE2-OH 3.43Å; E174-K363 WeakPolarHBondContact OE1-CE 3.41Å; E174-P364 HydrophobicContact CB-CB 4.43Å; E174-P364 HydrophobicContact CB-CG 4.39Å
175	A	98.8	Very high	98	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.2	-35.8	176.4	0	0	0	0	0	112.7	I144 I166 M170 S171 F172 E173 A177 P179	I144-A175 HydrophobicContact CD1-CB 4.43Å; I144-A175 HydrophobicContact CG1-CB 3.82Å; I166-A175 HydrophobicContact CD1-CB 3.62Å; I166-A175 HydrophobicContact CG1-CB 3.82Å; I166-A175 HydrophobicContact CG2-CB 4.23Å; M170-A175 HydrophobicContact CG-CB 4.24Å; M170-A175 HydrophobicContact SD-CB 3.71Å; S171-A175 VanDerWaalsContact O-CB 3.27Å; S171-A175 WeakPolarHBondContact O-CB 3.44Å; S171-A175 PolarHBondContact O-N 2.96Å; F172-A175 WeakPolarHBondContact O-CB 3.49Å; F172-A175 PolarHBondContact O-N 3.45Å; E173-A175 VanDerWaalsContact C-N 3.35Å; A175-A177 VanDerWaalsContact C-N 3.35Å; A175-P179 VanDerWaalsContact O-CD 3.23Å; A175-P179 WeakPolarHBondContact O-CD 3.43Å
176	A	98.8	Very high	98.1	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-81.4	-11.8	175.3	0	0	0	0	0	113.6	A94 E122 F172 E173 E174 I392	A94-A176 HydrophobicContact CB-CB 3.79Å; A94-A176 WeakPolarHBondContact O-CB 3.2Å; E122-A176 WeakPolarHBondContact CG-O 3.39Å; F172-A176 WeakPolarHBondContact O-CB 3.42Å; F172-A176 PolarHBondContact O-N 3.4Å; E173-A176 PolarHBondContact O-N 2.65Å; E174-A176 VanDerWaalsContact C-N 3.29Å; E174-A176 PolarHBondContact O-N 3.16Å; A176-I392 HydrophobicContact CB-CD1 4.22Å
177	A	98.8	Very high	98.1	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-96.8	-19.9	178.6	0	0	0	0	0	113.8	E173 E174 A175 N181 P364 I366 K390 I392	E173-A177 VanDerWaalsContact O-CB 3.31Å; E173-A177 WeakPolarHBondContact O-CB 3.48Å; E173-A177 PolarHBondContact O-N 2.99Å; E174-A177 PolarHBondContact O-N 2.95Å; A175-A177 VanDerWaalsContact C-N 3.35Å; A177-N181 PolarHBondContact O-ND2 2.82Å; A177-P364 HydrophobicContact CB-CB 3.67Å; A177-I366 HydrophobicContact CB-CD1 3.41Å; A177-I366 VanDerWaalsContact CB-CD1 3.41Å; A177-K390 HydrophobicContact CB-CB 3.67Å; A177-K390 HydrophobicContact CB-CD 4.17Å; A177-K390 HydrophobicContact CB-CG 3.62Å; A177-I392 HydrophobicContact CB-CD1 4.23Å
178	L	98.8	Very high	98.2	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	-69.3	-55.2	-176.6	-170.8	76.1	0	0	0	113.2	I144 M170 E174 Y182 L350 L353 L354 I362 P364	I144-L178 HydrophobicContact CD1-CD2 4.1Å; M170-L178 HydrophobicContact CE-CD2 4.38Å; E174-L178 PolarHBondContact O-N 3.45Å; L178-Y182 HydrophobicContact CD1-CD1 4.2Å; L178-Y182 HydrophobicContact CD1-CD2 3.72Å; L178-Y182 HydrophobicContact CD1-CE2 4.12Å; L178-Y182 HydrophobicContact CD1-CG 3.74Å; L178-Y182 HydrophobicContact CG-CD2 4.4Å; L178-Y182 HydrophobicContact CG-CG 4.5Å; L178-Y182 VanDerWaalsContact O-CB 3.24Å; L178-Y182 WeakPolarHBondContact O-CB 3.37Å; L178-Y182 VanDerWaalsContact O-CD2 3.28Å; L178-Y182 WeakPolarHBondContact O-CD2 3.2Å; L178-Y182 PolarHBondContact O-N 2.94Å; L178-L350 HydrophobicContact CD2-CD1 4.25Å; L178-L353 HydrophobicContact CD2-CB 4.46Å; L178-L354 HydrophobicContact CD2-CD2 3.74Å; L178-I362 HydrophobicContact CD1-CD1 3.9Å; L178-P364 HydrophobicContact CB-CG 4Å; L178-P364 HydrophobicContact CD1-CG 3.71Å; L178-P364 HydrophobicContact CG-CG 4.49Å
179	P	98.1	Very high	98.4	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-68.8	-57.6	-152.3	-19.3	30.3	0	0	0	114.6	E122 I144 M146 A175 N181 M183 L350	E122-P179 VanDerWaalsContact OE2-CD 3.26Å; E122-P179 WeakPolarHBondContact OE2-CD 3.43Å; I144-P179 HydrophobicContact CG2-CB 4.33Å; I144-P179 HydrophobicContact CG2-CG 3.33Å; M146-P179 HydrophobicContact CE-CB 3.6Å; M146-P179 HydrophobicContact CG-CB 3.93Å; M146-P179 HydrophobicContact CG-CG 4.32Å; M146-P179 HydrophobicContact SD-CB 3.2Å; M146-P179 WeakPolarHBondContact SD-CB 3.5Å; M146-P179 HydrophobicContact SD-CG 4.12Å; A175-P179 VanDerWaalsContact O-CD 3.23Å; A175-P179 WeakPolarHBondContact O-CD 3.43Å; P179-N181 VanDerWaalsContact C-N 3.34Å; P179-N181 PolarHBondContact O-N 2.81Å; P179-M183 WeakPolarHBondContact O-CB 3.37Å; P179-M183 WeakPolarHBondContact O-CG 3.35Å; P179-M183 PolarHBondContact O-N 3.11Å; P179-L350 HydrophobicContact CB-CD1 4.46Å
180	I	98.3	Very high	98.7	Very high	22 Å²	22	13.2 Å²	13.2	11%	0.113	7%	0.065	C	C	.	.	H	α-helix	trans	-63.6	-42.6	-176.6	-64.6	-67.5	0	0	0	110.9	N98 M121 E122 M146 T184 L337	N98-I180 VanDerWaalsContact OD1-CG2 3.32Å; N98-I180 WeakPolarHBondContact OD1-CG2 3.44Å; M121-I180 HydrophobicContact CB-CD1 4.09Å; M121-I180 HydrophobicContact CB-CG1 4.37Å; M121-I180 HydrophobicContact CE-CD1 4.3Å; M121-I180 HydrophobicContact CE-CG1 4.41Å; M121-I180 HydrophobicContact CE-CG2 4.36Å; E122-I180 HydrophobicContact CB-CG1 3.98Å; E122-I180 HydrophobicContact CG-CG1 4.14Å; E122-I180 WeakPolarHBondContact OE1-CB 3.35Å; E122-I180 WeakPolarHBondContact OE1-CG1 3.28Å; E122-I180 WeakPolarHBondContact OE2-CB 3.34Å; E122-I180 VanDerWaalsContact OE2-CG1 3.29Å; E122-I180 WeakPolarHBondContact OE2-CG1 3.42Å; E122-I180 PolarHBondContact OE2-N 2.77Å; M146-I180 HydrophobicContact CE-CD1 3.55Å; M146-I180 HydrophobicContact CE-CG1 4.12Å; I180-T184 WeakPolarHBondContact O-CB 3.28Å; I180-T184 PolarHBondContact O-N 2.81Å; I180-T184 PolarHBondContact O-OG1 3.35Å; I180-L337 HydrophobicContact CD1-CD2 3.84Å
181	N	98.7	Very high	98.6	Very high	11 Å²	11	16.9 Å²	16.9	6%	0.059	8%	0.082	C	C	.	.	H	α-helix	trans	-68.9	-50.7	-176.5	-73.8	-18.3	0	0	0	112.2	A177 P179 A185 G209 V210 A213 K390	A177-N181 PolarHBondContact O-ND2 2.82Å; P179-N181 VanDerWaalsContact C-N 3.34Å; P179-N181 PolarHBondContact O-N 2.81Å; N181-A185 WeakPolarHBondContact O-CB 3.27Å; N181-A185 PolarHBondContact O-N 2.8Å; N181-G209 VanDerWaalsContact CG-C 3.46Å; N181-G209 VanDerWaalsContact ND2-CA 3.26Å; N181-G209 WeakPolarHBondContact ND2-CA 3.37Å; N181-V210 HydrophobicContact CB-CG2 4.4Å; N181-A213 HydrophobicContact CB-CB 4.29Å; N181-K390 WeakPolarHBondContact ND2-CD 3.38Å
182	Y	98.9	Very high	98.6	Very high	3 Å²	3	17.8 Å²	17.8	1%	0.012	8%	0.083	C	C	.	.	H	α-helix	trans	-80.4	-34.1	-172.3	-74.9	-101.9	0	0	0	112.3	L178 T184 A185 Y186 A213 Q216 L353 I362 K363 P364	L178-Y182 HydrophobicContact CD1-CD1 4.2Å; L178-Y182 HydrophobicContact CD1-CD2 3.72Å; L178-Y182 HydrophobicContact CD1-CE2 4.12Å; L178-Y182 HydrophobicContact CD1-CG 3.74Å; L178-Y182 HydrophobicContact CG-CD2 4.4Å; L178-Y182 HydrophobicContact CG-CG 4.5Å; L178-Y182 VanDerWaalsContact O-CB 3.24Å; L178-Y182 WeakPolarHBondContact O-CB 3.37Å; L178-Y182 VanDerWaalsContact O-CD2 3.28Å; L178-Y182 WeakPolarHBondContact O-CD2 3.2Å; L178-Y182 PolarHBondContact O-N 2.94Å; Y182-T184 VanDerWaalsContact C-N 3.32Å; Y182-A185 PolarHBondContact O-N 2.83Å; Y182-Y186 WeakPolarHBondContact O-CB 3.34Å; Y182-Y186 PolarHBondContact O-N 2.83Å; Y182-A213 HydrophobicContact CD1-CB 3.61Å; Y182-A213 HydrophobicContact CD2-CB 3.65Å; Y182-A213 HydrophobicContact CE1-CB 3.68Å; Y182-A213 HydrophobicContact CE2-CB 3.75Å; Y182-A213 HydrophobicContact CG-CB 3.61Å; Y182-Q216 PolarHBondContact OH-OE1 2.7Å; Y182-L353 HydrophobicContact CD1-CD2 4.38Å; Y182-I362 HydrophobicContact CD1-CB 4.32Å; Y182-I362 HydrophobicContact CD1-CD1 3.73Å; Y182-I362 HydrophobicContact CD1-CG2 4.4Å; Y182-I362 HydrophobicContact CE1-CB 3.72Å; Y182-I362 HydrophobicContact CE1-CD1 3.95Å; Y182-I362 HydrophobicContact CE1-CG1 4.33Å; Y182-I362 HydrophobicContact CE1-CG2 4.01Å; Y182-K363 VanDerWaalsContact OH-C 3.31Å; Y182-K363 PolarHBondContact OH-O 3.04Å; Y182-P364 HydrophobicContact CE2-CB 4.08Å; Y182-P364 HydrophobicContact CE2-CG 3.9Å; Y182-P364 WeakPolarHBondContact OH-CA 3.44Å
183	M	98.6	Very high	98.5	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-65	-40.9	172.8	-64.6	-179.3	78.2	0	0	110.8	M146 P179 Y186 M187 L337 F346 T349 L350 L353	M146-M183 HydrophobicContact CE-SD 4.08Å; M146-M183 HydrophobicContact SD-SD 3.97Å; P179-M183 WeakPolarHBondContact O-CB 3.37Å; P179-M183 WeakPolarHBondContact O-CG 3.35Å; P179-M183 PolarHBondContact O-N 3.11Å; M183-Y186 PolarHBondContact O-N 3.06Å; M183-M187 HydrophobicContact CE-CE 4.07Å; M183-M187 WeakPolarHBondContact O-CB 3.05Å; M183-M187 WeakPolarHBondContact O-CG 3.38Å; M183-M187 PolarHBondContact O-N 2.92Å; M183-L337 HydrophobicContact CB-CD1 4.24Å; M183-L337 HydrophobicContact CB-CD2 3.92Å; M183-F346 HydrophobicContact CE-CB 4.34Å; M183-F346 HydrophobicContact CE-CD1 3.93Å; M183-F346 HydrophobicContact CE-CD2 3.33Å; M183-F346 HydrophobicContact CE-CE1 4.02Å; M183-F346 HydrophobicContact CE-CE2 3.43Å; M183-F346 VanDerWaalsContact CE-CE2 3.43Å; M183-F346 HydrophobicContact CE-CG 3.61Å; M183-F346 HydrophobicContact CE-CZ 3.81Å; M183-F346 WeakPolarHBondContact CE-O 3.33Å; M183-F346 HydrophobicContact SD-CD2 4.34Å; M183-F346 HydrophobicContact SD-CE1 4.33Å; M183-F346 HydrophobicContact SD-CE2 3.83Å; M183-F346 HydrophobicContact SD-CZ 3.86Å; M183-T349 HydrophobicContact CB-CG2 4.23Å; M183-T349 HydrophobicContact CE-CG2 4.24Å; M183-T349 HydrophobicContact CG-CG2 4.08Å; M183-L350 HydrophobicContact CE-CB 4.22Å; M183-L350 HydrophobicContact CG-CD1 4.45Å; M183-L350 HydrophobicContact SD-CB 4.17Å; M183-L350 HydrophobicContact SD-CD1 4.35Å; M183-L350 HydrophobicContact SD-CD2 4.47Å; M183-L353 HydrophobicContact CB-CD1 4.34Å; M183-L353 HydrophobicContact CG-CD1 3.61Å
184	T	98.7	Very high	98.4	Very high	11 Å²	11	17.3 Å²	17.3	7%	0.067	9%	0.085	C	C	.	.	H	α-helix	trans	-59.6	-51.8	174.5	-62.9	0	0	0	0	111	I180 Y182 Y186 M188 V210 F294 F335	I180-T184 WeakPolarHBondContact O-CB 3.28Å; I180-T184 PolarHBondContact O-N 2.81Å; I180-T184 PolarHBondContact O-OG1 3.35Å; Y182-T184 VanDerWaalsContact C-N 3.32Å; T184-Y186 PolarHBondContact O-N 3.15Å; T184-M188 HydrophobicContact CG2-CE 3.7Å; T184-M188 HydrophobicContact CG2-SD 4.28Å; T184-M188 WeakPolarHBondContact O-CB 3.42Å; T184-M188 VanDerWaalsContact O-CG 3.22Å; T184-M188 WeakPolarHBondContact O-CG 3.45Å; T184-M188 PolarHBondContact O-N 3.02Å; T184-M188 VanDerWaalsContact O-N 3.14Å; T184-V210 HydrophobicContact CG2-CG1 4.09Å; T184-V210 HydrophobicContact CG2-CG2 4.37Å; T184-F294 HydrophobicContact CG2-CD2 3.96Å; T184-F294 HydrophobicContact CG2-CE2 4.42Å; T184-F335 HydrophobicContact CG2-CD1 3.87Å; T184-F335 HydrophobicContact CG2-CE1 3.62Å
185	A	98.9	Very high	98.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.7	-43.7	178.8	0	0	0	0	0	112.7	N181 Y182 L189 V210 A213 A214 L217	N181-A185 WeakPolarHBondContact O-CB 3.27Å; N181-A185 PolarHBondContact O-N 2.8Å; Y182-A185 PolarHBondContact O-N 2.83Å; A185-L189 WeakPolarHBondContact O-CB 3.47Å; A185-L189 VanDerWaalsContact O-CG 3.27Å; A185-L189 WeakPolarHBondContact O-CG 3.02Å; A185-L189 PolarHBondContact O-N 3.11Å; A185-V210 HydrophobicContact CB-CG1 4.39Å; A185-A213 HydrophobicContact CB-CB 3.94Å; A185-A214 HydrophobicContact CB-CB 3.93Å; A185-L217 HydrophobicContact CB-CD1 3.73Å
186	Y	98.9	Very high	98.4	Very high	35 Å²	35	23.5 Å²	23.5	14%	0.137	11%	0.108	C	C	.	.	H	α-helix	trans	-63.7	-51.1	-178.3	-174.1	-81	0	0	0	111.9	Y182 M183 T184 M188 L189 F190 L217 T349 K352 L353	Y182-Y186 WeakPolarHBondContact O-CB 3.34Å; Y182-Y186 PolarHBondContact O-N 2.83Å; M183-Y186 PolarHBondContact O-N 3.06Å; T184-Y186 PolarHBondContact O-N 3.15Å; Y186-M188 VanDerWaalsContact C-N 3.33Å; Y186-M188 PolarHBondContact O-N 2.75Å; Y186-L189 PolarHBondContact O-N 3.37Å; Y186-F190 HydrophobicContact CD1-CB 4.49Å; Y186-F190 HydrophobicContact CD1-CD2 4.22Å; Y186-F190 AromaticContact CD2-CD2 3.5Å; Y186-F190 HydrophobicContact CD2-CD2 3.5Å; Y186-F190 VanDerWaalsContact CD2-CD2 3.5Å; Y186-F190 AromaticContact CD2-CE2 3.81Å; Y186-F190 HydrophobicContact CD2-CE2 3.81Å; Y186-F190 HydrophobicContact CE1-CB 4.17Å; Y186-F190 HydrophobicContact CE1-CD2 4.3Å; Y186-F190 AromaticContact CE2-CD2 3.59Å; Y186-F190 HydrophobicContact CE2-CD2 3.59Å; Y186-F190 AromaticContact CE2-CE2 3.96Å; Y186-F190 HydrophobicContact CE2-CE2 3.96Å; Y186-F190 HydrophobicContact CE2-CG 4.31Å; Y186-F190 AromaticContact CG-CD2 3.83Å; Y186-F190 HydrophobicContact CG-CD2 3.83Å; Y186-F190 HydrophobicContact CG-CE2 4.47Å; Y186-F190 AromaticContact CZ-CD2 3.99Å; Y186-F190 WeakPolarHBondContact O-CB 3.35Å; Y186-F190 WeakPolarHBondContact O-CD2 3.48Å; Y186-F190 PolarHBondContact O-N 2.85Å; Y186-L217 HydrophobicContact CD2-CD1 4.47Å; Y186-L217 HydrophobicContact CD2-CD2 4.18Å; Y186-T349 HydrophobicContact CD1-CG2 3.66Å; Y186-T349 HydrophobicContact CE1-CG2 4.36Å; Y186-T349 HydrophobicContact CG-CG2 4.06Å; Y186-K352 HydrophobicContact CE2-CG 3.81Å; Y186-L353 HydrophobicContact CD2-CD2 4.04Å; Y186-L353 HydrophobicContact CG-CD2 4.42Å
187	M	98.7	Very high	98.4	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.015	13%	0.134	C	C	.	.	I	π-helix	trans	-64	-40.2	-179.2	-68.4	-178.7	178.1	0	0	111.4	M183 E191 M192 F335 L337 L345 T349	M183-M187 HydrophobicContact CE-CE 4.07Å; M183-M187 WeakPolarHBondContact O-CB 3.05Å; M183-M187 WeakPolarHBondContact O-CG 3.38Å; M183-M187 PolarHBondContact O-N 2.92Å; M187-E191 HydrophobicContact CB-CG 4.45Å; M187-E191 HydrophobicContact CG-CG 4.37Å; M187-E191 WeakPolarHBondContact O-CA 3.3Å; M187-E191 WeakPolarHBondContact O-CB 3.31Å; M187-E191 PolarHBondContact O-N 2.7Å; M187-E191 VanDerWaalsContact O-N 3.12Å; M187-M192 WeakPolarHBondContact O-CG 3.42Å; M187-M192 PolarHBondContact O-N 3.34Å; M187-F335 HydrophobicContact CB-CD2 4.41Å; M187-F335 HydrophobicContact CB-CE2 3.53Å; M187-F335 HydrophobicContact CB-CZ 3.76Å; M187-F335 HydrophobicContact CG-CE2 4.3Å; M187-F335 HydrophobicContact CG-CZ 4.35Å; M187-F335 HydrophobicContact SD-CE2 3.81Å; M187-F335 HydrophobicContact SD-CZ 3.8Å; M187-L337 HydrophobicContact CE-CD1 4.28Å; M187-L337 HydrophobicContact SD-CD1 3.96Å; M187-L345 HydrophobicContact CE-CD1 3.98Å; M187-L345 HydrophobicContact CE-CD2 4.27Å; M187-L345 HydrophobicContact CE-CG 3.73Å; M187-L345 HydrophobicContact SD-CD2 4.49Å; M187-T349 HydrophobicContact CE-CG2 3.94Å; M187-T349 VanDerWaalsContact CE-OG1 3.29Å; M187-T349 WeakPolarHBondContact CE-OG1 3.45Å; M187-T349 HydrophobicContact CG-CG2 4.22Å
188	M	98.7	Very high	98.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	I	π-helix	trans	-62.1	-47	174.9	-70.7	-169.1	-59.5	0	0	112.3	T184 Y186 A193 V210 L270 I292 F294 F335	T184-M188 HydrophobicContact CG2-CE 3.7Å; T184-M188 HydrophobicContact CG2-SD 4.28Å; T184-M188 WeakPolarHBondContact O-CB 3.42Å; T184-M188 VanDerWaalsContact O-CG 3.22Å; T184-M188 WeakPolarHBondContact O-CG 3.45Å; T184-M188 PolarHBondContact O-N 3.02Å; T184-M188 VanDerWaalsContact O-N 3.14Å; Y186-M188 VanDerWaalsContact C-N 3.33Å; Y186-M188 PolarHBondContact O-N 2.75Å; M188-A193 WeakPolarHBondContact O-CB 3.3Å; M188-A193 PolarHBondContact O-N 3.39Å; M188-V210 HydrophobicContact CE-CG1 4.02Å; M188-L270 HydrophobicContact CB-CD2 4.07Å; M188-L270 HydrophobicContact CE-CD1 4.16Å; M188-L270 HydrophobicContact CE-CD2 4.23Å; M188-L270 HydrophobicContact SD-CD2 4.19Å; M188-I292 HydrophobicContact CB-CD1 3.86Å; M188-I292 HydrophobicContact CG-CD1 4.33Å; M188-I292 HydrophobicContact CG-CG2 3.87Å; M188-I292 WeakPolarHBondContact O-CD1 3.35Å; M188-I292 HydrophobicContact SD-CB 4.4Å; M188-I292 HydrophobicContact SD-CG2 3.79Å; M188-F294 HydrophobicContact CE-CD1 3.87Å; M188-F294 HydrophobicContact CE-CD2 4.2Å; M188-F294 HydrophobicContact CE-CE1 3.95Å; M188-F294 HydrophobicContact CE-CE2 4.28Å; M188-F294 HydrophobicContact CE-CG 3.99Å; M188-F294 HydrophobicContact CE-CZ 4.14Å; M188-F294 HydrophobicContact SD-CB 3.6Å; M188-F294 VanDerWaalsContact SD-CB 3.6Å; M188-F294 HydrophobicContact SD-CD1 3.39Å; M188-F294 WeakPolarHBondContact SD-CD1 3.12Å; M188-F294 HydrophobicContact SD-CD2 4.21Å; M188-F294 HydrophobicContact SD-CE1 4.06Å; M188-F294 HydrophobicContact SD-CG 3.46Å; M188-F294 WeakPolarHBondContact SD-CG 3.4Å; M188-F335 HydrophobicContact CG-CB 3.93Å; M188-F335 HydrophobicContact CG-CD1 3.77Å; M188-F335 HydrophobicContact CG-CD2 4.4Å; M188-F335 HydrophobicContact CG-CE1 4.44Å; M188-F335 HydrophobicContact CG-CG 3.74Å; M188-F335 HydrophobicContact SD-CB 4.36Å; M188-F335 HydrophobicContact SD-CD1 4.21Å; M188-F335 HydrophobicContact SD-CG 4.49Å
189	L	98.8	Very high	98.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.167	C	C	.	.	I	π-helix	trans	-74.5	-46.1	-174.6	-71.4	168.1	0	0	0	112.5	A185 Y186 A193 N194 L195 V201 A214 L217 L270	A185-L189 WeakPolarHBondContact O-CB 3.47Å; A185-L189 VanDerWaalsContact O-CG 3.27Å; A185-L189 WeakPolarHBondContact O-CG 3.02Å; A185-L189 PolarHBondContact O-N 3.11Å; Y186-L189 PolarHBondContact O-N 3.37Å; L189-A193 CarbonylContact O-C 3.59Å; L189-N194 PolarHBondContact O-N 2.67Å; L189-L195 HydrophobicContact CB-CB 4.35Å; L189-L195 HydrophobicContact CB-CD2 4.45Å; L189-L195 HydrophobicContact CD2-CD2 4.33Å; L189-L195 WeakPolarHBondContact O-CB 3.46Å; L189-L195 PolarHBondContact O-N 3.27Å; L189-V201 HydrophobicContact CD2-CG1 4.23Å; L189-A214 HydrophobicContact CD1-CB 4.06Å; L189-L217 HydrophobicContact CD1-CB 3.93Å; L189-L270 HydrophobicContact CD2-CD1 4.17Å; L189-L270 HydrophobicContact CG-CD1 4.47Å
190	F	98.6	Very high	98.4	Very high	48 Å²	48	32 Å²	32	21%	0.211	17%	0.168	C	C	.	.	I	π-helix	trans	-99.7	-47	-169.5	-61.5	-71.3	0	0	0	113.2	Y186 L195 L217 V221	Y186-F190 HydrophobicContact CD1-CB 4.49Å; Y186-F190 HydrophobicContact CD1-CD2 4.22Å; Y186-F190 AromaticContact CD2-CD2 3.5Å; Y186-F190 HydrophobicContact CD2-CD2 3.5Å; Y186-F190 VanDerWaalsContact CD2-CD2 3.5Å; Y186-F190 AromaticContact CD2-CE2 3.81Å; Y186-F190 HydrophobicContact CD2-CE2 3.81Å; Y186-F190 HydrophobicContact CE1-CB 4.17Å; Y186-F190 HydrophobicContact CE1-CD2 4.3Å; Y186-F190 AromaticContact CE2-CD2 3.59Å; Y186-F190 HydrophobicContact CE2-CD2 3.59Å; Y186-F190 AromaticContact CE2-CE2 3.96Å; Y186-F190 HydrophobicContact CE2-CE2 3.96Å; Y186-F190 HydrophobicContact CE2-CG 4.31Å; Y186-F190 AromaticContact CG-CD2 3.83Å; Y186-F190 HydrophobicContact CG-CD2 3.83Å; Y186-F190 HydrophobicContact CG-CE2 4.47Å; Y186-F190 AromaticContact CZ-CD2 3.99Å; Y186-F190 WeakPolarHBondContact O-CB 3.35Å; Y186-F190 WeakPolarHBondContact O-CD2 3.48Å; Y186-F190 PolarHBondContact O-N 2.85Å; F190-L195 HydrophobicContact CD1-CB 4.3Å; F190-L195 HydrophobicContact CE1-CB 4.23Å; F190-L195 HydrophobicContact CE1-CD2 4.15Å; F190-L195 HydrophobicContact CZ-CD2 4.23Å; F190-L217 HydrophobicContact CE2-CB 4.09Å; F190-L217 HydrophobicContact CE2-CD2 4.26Å; F190-V221 HydrophobicContact CE1-CG2 3.74Å; F190-V221 HydrophobicContact CZ-CG2 4.08Å
191	E	97.1	Very high	98.4	Very high	78 Å²	78	31 Å²	31	36%	0.364	16%	0.163	S	C	.	.	I	π-helix	trans	-77	-35.2	-177.7	-57.2	-72.1	151.9	0	0	111.7	M187 L345 R348	M187-E191 HydrophobicContact CB-CG 4.45Å; M187-E191 HydrophobicContact CG-CG 4.37Å; M187-E191 WeakPolarHBondContact O-CA 3.3Å; M187-E191 WeakPolarHBondContact O-CB 3.31Å; M187-E191 PolarHBondContact O-N 2.7Å; M187-E191 VanDerWaalsContact O-N 3.12Å; E191-L345 HydrophobicContact CG-CD1 4.16Å; E191-R348 IonicContact OE1-CZ 3.58Å; E191-R348 IonicContact OE1-NH1 3.89Å; E191-R348 PolarHBondContact OE1-NH1 3.04Å; E191-R348 IonicContact OE1-NH2 2.63Å; E191-R348 IonicContact OE2-CZ 3.42Å; E191-R348 IonicContact OE2-NH1 2.61Å; E191-R348 IonicContact OE2-NH2 2.64Å; E191-R348 PolarHBondContact OE2-NH2 2.74Å
192	M	97.1	Very high	98.4	Very high	55 Å²	55	30.4 Å²	30.4	27%	0.271	16%	0.16	S	C	.	.	I	π-helix	trans	-100	-59.6	-177.6	-56.6	-175.2	97.4	0	0	113.3	M187 N194 M290 I292 S333 F335	M187-M192 WeakPolarHBondContact O-CG 3.42Å; M187-M192 PolarHBondContact O-N 3.34Å; M192-N194 VanDerWaalsContact C-N 3.31Å; M192-N194 PolarHBondContact O-N 3.49Å; M192-M290 HydrophobicContact CB-SD 4.2Å; M192-M290 VanDerWaalsContact O-CE 3.32Å; M192-M290 WeakPolarHBondContact O-CE 3.42Å; M192-I292 HydrophobicContact CB-CD1 3.78Å; M192-I292 HydrophobicContact SD-CD1 4.36Å; M192-I292 HydrophobicContact SD-CG2 4.31Å; M192-S333 WeakPolarHBondContact CE-OG 3.31Å; M192-F335 HydrophobicContact SD-CB 3.81Å; M192-F335 HydrophobicContact SD-CD2 3.62Å; M192-F335 HydrophobicContact SD-CG 4.08Å
193	A	98.1	Very high	98.4	Very high	6 Å²	6	30.4 Å²	30.4	5%	0.05	16%	0.16	C	C	.	.	S	Bend	trans	-82.5	-10.1	-172.3	0	0	0	0	0	114.1	M188 L189 L195 K199 I268 M290 I292	M188-A193 WeakPolarHBondContact O-CB 3.3Å; M188-A193 PolarHBondContact O-N 3.39Å; L189-A193 CarbonylContact O-C 3.59Å; A193-L195 PolarHBondContact O-N 2.75Å; A193-K199 PolarHBondContact O-NZ 2.81Å; A193-I268 HydrophobicContact CB-CB 4.48Å; A193-I268 HydrophobicContact CB-CD1 3.56Å; A193-I268 HydrophobicContact CB-CG1 3.84Å; A193-I268 HydrophobicContact CB-CG2 3.8Å; A193-M290 HydrophobicContact CB-SD 4.29Å; A193-I292 HydrophobicContact CB-CD1 3.9Å
194	N	97.3	Very high	98.4	Very high	69 Å²	69	30.6 Å²	30.6	37%	0.369	16%	0.161	S	C	.	.			trans	50.9	58.2	178.4	178.8	21.3	0	0	0	110.5	L189 M192 R196 K199	L189-N194 PolarHBondContact O-N 2.67Å; M192-N194 VanDerWaalsContact C-N 3.31Å; M192-N194 PolarHBondContact O-N 3.49Å; N194-R196 PolarHBondContact ND2-NE 3.12Å; N194-R196 PolarHBondContact ND2-NH2 3.06Å; N194-R196 WeakPolarHBondContact O-CG 3.36Å; N194-R196 PolarHBondContact O-N 3.43Å; N194-R196 PolarHBondContact OD1-NE 2.97Å; N194-R196 PolarHBondContact OD1-NH2 3.23Å; N194-K199 PolarHBondContact O-NZ 3.3Å
195	L	98.7	Very high	98.4	Very high	12 Å²	12	32.4 Å²	32.4	6%	0.063	17%	0.169	C	C	.	.			trans	-57	132.7	177.6	-178.7	68.8	0	0	0	110	L189 F190 A193 K199 V201 C218 V221 V224 I268	L189-L195 HydrophobicContact CB-CB 4.35Å; L189-L195 HydrophobicContact CB-CD2 4.45Å; L189-L195 HydrophobicContact CD2-CD2 4.33Å; L189-L195 WeakPolarHBondContact O-CB 3.46Å; L189-L195 PolarHBondContact O-N 3.27Å; F190-L195 HydrophobicContact CD1-CB 4.3Å; F190-L195 HydrophobicContact CE1-CB 4.23Å; F190-L195 HydrophobicContact CE1-CD2 4.15Å; F190-L195 HydrophobicContact CZ-CD2 4.23Å; A193-L195 PolarHBondContact O-N 2.75Å; L195-K199 HydrophobicContact CD1-CB 4.01Å; L195-K199 HydrophobicContact CD1-CD 4.46Å; L195-V201 HydrophobicContact CD1-CG2 3.76Å; L195-C218 HydrophobicContact CD2-CB 4.39Å; L195-V221 HydrophobicContact CD2-CB 4.29Å; L195-V221 HydrophobicContact CD2-CG2 3.82Å; L195-V221 HydrophobicContact CG-CG2 4.19Å; L195-V224 HydrophobicContact CD1-CG1 4.17Å; L195-V224 HydrophobicContact CD1-CG2 4.03Å; L195-V224 HydrophobicContact CD2-CG2 4.5Å; L195-V224 HydrophobicContact CG-CG2 4.41Å; L195-I268 HydrophobicContact CB-CD1 4.18Å; L195-I268 HydrophobicContact CD1-CD1 3.76Å
196	R	98.3	Very high	98.4	Very high	139 Å²	139	32.4 Å²	32.4	53%	0.525	17%	0.169	S	C	.	.			trans	-143.1	162.7	-174.3	-72.9	176.4	-173.7	-170.3	-6	109.8	N194 K199 V221	N194-R196 PolarHBondContact ND2-NE 3.12Å; N194-R196 PolarHBondContact ND2-NH2 3.06Å; N194-R196 WeakPolarHBondContact O-CG 3.36Å; N194-R196 PolarHBondContact O-N 3.43Å; N194-R196 PolarHBondContact OD1-NE 2.97Å; N194-R196 PolarHBondContact OD1-NH2 3.23Å; R196-K199 HydrophobicContact CB-CD 4.4Å; R196-K199 HydrophobicContact CB-CG 4.5Å; R196-K199 WeakPolarHBondContact O-CB 3.19Å; R196-K199 PolarHBondContact O-N 2.8Å; R196-V221 VanDerWaalsContact C-CG1 3.45Å
197	P	98.7	Very high	98.4	Very high	85 Å²	85	30.9 Å²	30.9	55%	0.552	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	142.1	177	-28.4	36.2	0	0	0	113.6	K199 V221 Q222	P197-K199 VanDerWaalsContact C-N 3.26Å; P197-K199 PolarHBondContact O-N 2.62Å; P197-V221 HydrophobicContact CG-CG1 4.03Å; P197-Q222 WeakPolarHBondContact CA-O 3.47Å; P197-Q222 HydrophobicContact CB-CB 4.25Å; P197-Q222 HydrophobicContact CG-CB 4.46Å
198	G	98.1	Very high	98.3	Very high	51 Å²	51	31.5 Å²	31.5	53%	0.526	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	-3.5	179.1	0	0	0	0	0	115.9	Q222 D223	G198-Q222 PolarHBondContact N-O 3.29Å; G198-D223 CarbonylContact C-O 3.55Å; G198-D223 WeakPolarHBondContact CA-O 3.46Å; G198-D223 PolarHBondContact N-O 2.82Å
199	K	98.6	Very high	98.3	Very high	40 Å²	40	32.1 Å²	32.1	17%	0.174	18%	0.177	C	C	.	.			trans	-73.1	158.1	178	-79	-166.4	170.9	-175	0	111.9	A193 N194 L195 R196 P197 V224 T225 D267 I268	A193-K199 PolarHBondContact O-NZ 2.81Å; N194-K199 PolarHBondContact O-NZ 3.3Å; L195-K199 HydrophobicContact CD1-CB 4.01Å; L195-K199 HydrophobicContact CD1-CD 4.46Å; R196-K199 HydrophobicContact CB-CD 4.4Å; R196-K199 HydrophobicContact CB-CG 4.5Å; R196-K199 WeakPolarHBondContact O-CB 3.19Å; R196-K199 PolarHBondContact O-N 2.8Å; P197-K199 VanDerWaalsContact C-N 3.26Å; P197-K199 PolarHBondContact O-N 2.62Å; K199-V224 VanDerWaalsContact O-CA 3.28Å; K199-V224 WeakPolarHBondContact O-CA 3.32Å; K199-T225 PolarHBondContact O-N 2.84Å; K199-D267 HydrophobicContact CB-CB 4.14Å; K199-D267 HydrophobicContact CD-CB 4.15Å; K199-D267 HydrophobicContact CG-CB 4.08Å; K199-I268 HydrophobicContact CD-CD1 4.14Å
200	S	98.9	Very high	98.3	Very high	4 Å²	4	33.4 Å²	33.4	3%	0.028	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.6	173.5	54.6	0	0	0	0	112	T225 V266 D267 I268 K286	S200-T225 CarbonylContact C-O 3.53Å; S200-T225 VanDerWaalsContact CA-O 3.24Å; S200-T225 WeakPolarHBondContact CA-O 3.48Å; S200-V266 VanDerWaalsContact OG-CA 3.31Å; S200-V266 WeakPolarHBondContact OG-CA 3.23Å; S200-D267 PolarHBondContact N-OD2 3.26Å; S200-D267 WeakPolarHBondContact O-CA 3.1Å; S200-D267 WeakPolarHBondContact O-CB 3.01Å; S200-D267 PolarHBondContact O-N 2.96Å; S200-D267 PolarHBondContact OG-N 3.06Å; S200-D267 VanDerWaalsContact OG-N 3.16Å; S200-D267 PolarHBondContact OG-OD2 3.37Å; S200-I268 PolarHBondContact O-N 3.27Å; S200-K286 PolarHBondContact OG-NZ 3.41Å
201	V	98.9	Very high	98.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	130	-174.8	-170.6	0	0	0	0	110	L189 L195 I203 V224 T225 F227 I268 L270	L189-V201 HydrophobicContact CD2-CG1 4.23Å; L195-V201 HydrophobicContact CD1-CG2 3.76Å; V201-I203 HydrophobicContact CG1-CD1 4.42Å; V201-I203 HydrophobicContact CG1-CG1 3.78Å; V201-V224 HydrophobicContact CG2-CG1 3.92Å; V201-T225 PolarHBondContact N-O 2.92Å; V201-F227 PolarHBondContact O-N 2.86Å; V201-I268 CarbonylContact C-O 3.43Å; V201-I268 WeakPolarHBondContact CA-O 3.22Å; V201-I268 HydrophobicContact CB-CB 4.44Å; V201-I268 HydrophobicContact CG1-CB 4.09Å; V201-I268 HydrophobicContact CG1-CG2 4.13Å; V201-I268 HydrophobicContact CG2-CB 4.16Å; V201-I268 HydrophobicContact CG2-CD1 4.17Å; V201-L270 HydrophobicContact CG1-CG 4.39Å
202	L	98.9	Very high	98.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.5	165.9	175.6	61.2	0	0	0	109.4	F227 T229 Y254 V258 V266 I268 V269 L270 L284	L202-F227 CarbonylContact C-O 3.48Å; L202-F227 WeakPolarHBondContact CA-O 3.27Å; L202-F227 HydrophobicContact CD1-CB 3.78Å; L202-T229 HydrophobicContact CD1-CG2 4.08Å; L202-Y254 HydrophobicContact CD2-CD2 4.34Å; L202-Y254 HydrophobicContact CD2-CE2 4.45Å; L202-V258 HydrophobicContact CD1-CG2 4.38Å; L202-V266 HydrophobicContact CB-CG1 4.5Å; L202-V266 HydrophobicContact CB-CG2 3.99Å; L202-I268 PolarHBondContact N-O 2.99Å; L202-V269 HydrophobicContact CB-CG2 4.2Å; L202-V269 HydrophobicContact CD2-CG1 4.23Å; L202-V269 HydrophobicContact CD2-CG2 4.32Å; L202-L270 PolarHBondContact O-N 2.94Å; L202-L284 HydrophobicContact CD2-CD1 3.93Å
203	I	98.9	Very high	98.5	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	106.6	178.5	-53.5	179.6	0	0	0	108.4	V201 A206 A214 I226 F227 G228 T229 L270	V201-I203 HydrophobicContact CG1-CD1 4.42Å; V201-I203 HydrophobicContact CG1-CG1 3.78Å; I203-A206 HydrophobicContact CG2-CB 4.26Å; I203-A214 HydrophobicContact CD1-CB 3.89Å; I203-A214 HydrophobicContact CG2-CB 4.39Å; I203-I226 HydrophobicContact CD1-CG2 3.65Å; I203-I226 HydrophobicContact CG1-CG2 4.18Å; I203-F227 PolarHBondContact N-O 2.83Å; I203-G228 WeakPolarHBondContact O-CA 3.46Å; I203-T229 PolarHBondContact O-N 3.41Å; I203-L270 HydrophobicContact CG1-CD1 4.34Å
204	H	98.7	Very high	98.6	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.019	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	149.9	170.3	-76.5	-54.9	0	0	0	111.6	A206 T229 Y254 L270 P272 L273	H204-A206 VanDerWaalsContact C-N 3.28Å; H204-A206 PolarHBondContact O-N 3.3Å; H204-T229 WeakPolarHBondContact CA-OG1 3.21Å; H204-T229 WeakPolarHBondContact ND1-CG2 3.43Å; H204-T229 PolarHBondContact ND1-OG1 3.5Å; H204-Y254 AromaticContact CE1-CD2 3.99Å; H204-Y254 AromaticContact CE1-CE2 3.76Å; H204-Y254 AromaticContact CE1-CZ 3.78Å; H204-L270 PolarHBondContact N-O 2.86Å; H204-P272 VanDerWaalsContact CB-CD 3.47Å; H204-P272 HydrophobicContact CB-CG 3.91Å; H204-L273 HydrophobicContact CB-CD1 4.18Å; H204-L273 HydrophobicContact CB-CG 4.3Å
205	M	97.8	Very high	98.6	Very high	50 Å²	50	22.8 Å²	22.8	25%	0.246	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	46.8	-174.3	-60	178.5	62.5	0	0	112.4	A207 G208 T229 P272 L273 A297	M205-A207 PolarHBondContact O-N 2.86Å; M205-G208 PolarHBondContact O-N 2.72Å; M205-T229 WeakPolarHBondContact CA-O 3.4Å; M205-T229 PolarHBondContact N-O 3.44Å; M205-T229 PolarHBondContact N-OG1 3.28Å; M205-P272 HydrophobicContact CB-CG 4.38Å; M205-P272 HydrophobicContact CG-CG 4.16Å; M205-P272 HydrophobicContact SD-CB 4.38Å; M205-P272 HydrophobicContact SD-CG 3.99Å; M205-L273 HydrophobicContact CG-CD2 4.04Å; M205-L273 HydrophobicContact SD-CD2 3.84Å; M205-A297 HydrophobicContact SD-CB 4.08Å
206	A	98.6	Very high	98.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-24.8	-170.7	0	0	0	0	0	114.4	I203 H204 G211 I212 T229 I238 V243	I203-A206 HydrophobicContact CG2-CB 4.26Å; H204-A206 VanDerWaalsContact C-N 3.28Å; H204-A206 PolarHBondContact O-N 3.3Å; A206-G211 CarbonylContact O-C 3.11Å; A206-I212 PolarHBondContact O-N 2.92Å; A206-T229 PolarHBondContact N-O 2.94Å; A206-T229 VanDerWaalsContact N-O 3.11Å; A206-I238 HydrophobicContact CB-CD1 4.23Å; A206-V243 HydrophobicContact CB-CG2 4.21Å
207	A	98.5	Very high	98.7	Very high	3 Å²	3	17 Å²	17	3%	0.025	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.9	175.7	0	0	0	0	0	114.1	M205 A230 K234 I238 I388 G389	M205-A207 PolarHBondContact O-N 2.86Å; A207-A230 HydrophobicContact CB-CB 4.25Å; A207-K234 HydrophobicContact CB-CB 4.08Å; A207-K234 HydrophobicContact CB-CD 3.63Å; A207-K234 HydrophobicContact CB-CG 4.42Å; A207-I238 HydrophobicContact CB-CG2 3.63Å; A207-I388 HydrophobicContact CB-CG2 4.39Å; A207-I388 CarbonylContact O-C 3.6Å; A207-I388 VanDerWaalsContact O-CA 3.31Å; A207-I388 WeakPolarHBondContact O-CA 3.36Å; A207-G389 PolarHBondContact O-N 3.29Å
208	G	98.3	Very high	98.7	Very high	15 Å²	15	13 Å²	13	16%	0.155	9%	0.087	C	C	.	.	B	Isolated β-bridge	trans	-75.9	170.2	177	0	0	0	0	0	112.1	M205 V210 G211 I212	M205-G208 PolarHBondContact O-N 2.72Å; G208-V210 PolarHBondContact O-N 3.14Å; G208-G211 PolarHBondContact O-N 3.47Å; G208-I212 PolarHBondContact O-N 2.84Å
209	G	98.4	Very high	98.7	Very high	13 Å²	13	15.7 Å²	15.7	13%	0.134	9%	0.086	C	C	.	.	H	α-helix	trans	-52.9	-52.6	-178	0	0	0	0	0	114.8	N181 G211 A213	N181-G209 VanDerWaalsContact CG-C 3.46Å; N181-G209 VanDerWaalsContact ND2-CA 3.26Å; N181-G209 WeakPolarHBondContact ND2-CA 3.37Å; G209-G211 VanDerWaalsContact C-N 3.33Å; G209-G211 PolarHBondContact O-N 3.25Å; G209-A213 WeakPolarHBondContact O-CB 3.41Å; G209-A213 PolarHBondContact O-N 3.44Å
210	V	98.7	Very high	98.7	Very high	28 Å²	28	16.3 Å²	16.3	17%	0.17	9%	0.093	C	C	.	.	H	α-helix	trans	-65.3	-36.6	175.5	179.9	0	0	0	0	111.6	N181 T184 A185 M188 G208 A213 A214 F294	N181-V210 HydrophobicContact CB-CG2 4.4Å; T184-V210 HydrophobicContact CG2-CG1 4.09Å; T184-V210 HydrophobicContact CG2-CG2 4.37Å; A185-V210 HydrophobicContact CB-CG1 4.39Å; M188-V210 HydrophobicContact CE-CG1 4.02Å; G208-V210 PolarHBondContact O-N 3.14Å; V210-A213 PolarHBondContact O-N 3.06Å; V210-A214 VanDerWaalsContact O-CB 3.3Å; V210-A214 WeakPolarHBondContact O-CB 3.48Å; V210-A214 PolarHBondContact O-N 2.77Å; V210-F294 HydrophobicContact CB-CE2 4.17Å; V210-F294 HydrophobicContact CG1-CE2 3.69Å; V210-F294 HydrophobicContact CG1-CZ 3.88Å; V210-F294 HydrophobicContact CG2-CE2 4.28Å
211	G	98.8	Very high	98.7	Very high	5 Å²	5	17.2 Å²	17.2	5%	0.052	10%	0.098	C	C	.	.	H	α-helix	trans	-64.4	-44.2	179.9	0	0	0	0	0	112.8	A206 G208 G209 A214 T215	A206-G211 CarbonylContact O-C 3.11Å; G208-G211 PolarHBondContact O-N 3.47Å; G209-G211 VanDerWaalsContact C-N 3.33Å; G209-G211 PolarHBondContact O-N 3.25Å; G211-A214 PolarHBondContact O-N 3.02Å; G211-T215 WeakPolarHBondContact O-CB 3.42Å; G211-T215 PolarHBondContact O-N 3.16Å; G211-T215 PolarHBondContact O-OG1 3.5Å
212	I	98.8	Very high	98.7	Very high	23 Å²	23	24.3 Å²	24.3	12%	0.118	13%	0.131	C	C	.	.	H	α-helix	trans	-65	-45.1	174.3	-68.6	-178.2	0	0	0	110.2	A206 G208 A214 T215 Q216 H365 I388	A206-I212 PolarHBondContact O-N 2.92Å; G208-I212 PolarHBondContact O-N 2.84Å; I212-A214 PolarHBondContact O-N 2.76Å; I212-T215 PolarHBondContact O-N 3.47Å; I212-Q216 WeakPolarHBondContact O-CG 3.43Å; I212-Q216 PolarHBondContact O-N 3.46Å; I212-H365 HydrophobicContact CD1-CB 3.94Å; I212-H365 HydrophobicContact CG2-CB 4.15Å; I212-I388 HydrophobicContact CD1-CG2 4.07Å
213	A	98.9	Very high	98.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.7	-47.5	177.3	0	0	0	0	0	112	N181 Y182 A185 G209 V210 T215 Q216 L217	N181-A213 HydrophobicContact CB-CB 4.29Å; Y182-A213 HydrophobicContact CD1-CB 3.61Å; Y182-A213 HydrophobicContact CD2-CB 3.65Å; Y182-A213 HydrophobicContact CE1-CB 3.68Å; Y182-A213 HydrophobicContact CE2-CB 3.75Å; Y182-A213 HydrophobicContact CG-CB 3.61Å; A185-A213 HydrophobicContact CB-CB 3.94Å; G209-A213 WeakPolarHBondContact O-CB 3.41Å; G209-A213 PolarHBondContact O-N 3.44Å; V210-A213 PolarHBondContact O-N 3.06Å; A213-T215 VanDerWaalsContact C-N 3.33Å; A213-T215 PolarHBondContact O-N 2.84Å; A213-Q216 PolarHBondContact O-N 2.93Å; A213-L217 WeakPolarHBondContact O-CB 3.31Å; A213-L217 VanDerWaalsContact O-CG 3.28Å; A213-L217 WeakPolarHBondContact O-CG 3.49Å; A213-L217 PolarHBondContact O-N 3.45Å
214	A	98.9	Very high	98.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-39.4	176.6	0	0	0	0	0	112.2	A185 L189 I203 V210 G211 I212 L217 C218 L270	A185-A214 HydrophobicContact CB-CB 3.93Å; L189-A214 HydrophobicContact CD1-CB 4.06Å; I203-A214 HydrophobicContact CD1-CB 3.89Å; I203-A214 HydrophobicContact CG2-CB 4.39Å; V210-A214 VanDerWaalsContact O-CB 3.3Å; V210-A214 WeakPolarHBondContact O-CB 3.48Å; V210-A214 PolarHBondContact O-N 2.77Å; G211-A214 PolarHBondContact O-N 3.02Å; I212-A214 PolarHBondContact O-N 2.76Å; A214-L217 PolarHBondContact O-N 2.81Å; A214-C218 WeakPolarHBondContact O-CB 3.32Å; A214-C218 PolarHBondContact O-N 3.07Å; A214-C218 PolarHBondContact O-SG 2.97Å; A214-L270 HydrophobicContact CB-CD1 3.78Å
215	T	98.9	Very high	98.6	Very high	4 Å²	4	33.6 Å²	33.6	3%	0.025	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-50.1	176.9	-56.8	0	0	0	0	110.9	G211 I212 A213 L217 C218 Q219 I226 G241 V243	G211-T215 WeakPolarHBondContact O-CB 3.42Å; G211-T215 PolarHBondContact O-N 3.16Å; G211-T215 PolarHBondContact O-OG1 3.5Å; I212-T215 PolarHBondContact O-N 3.47Å; A213-T215 VanDerWaalsContact C-N 3.33Å; A213-T215 PolarHBondContact O-N 2.84Å; T215-L217 VanDerWaalsContact C-N 3.34Å; T215-L217 PolarHBondContact O-N 2.85Å; T215-C218 WeakPolarHBondContact O-CB 3.48Å; T215-C218 PolarHBondContact O-N 3.37Å; T215-Q219 WeakPolarHBondContact O-CG 3.5Å; T215-Q219 PolarHBondContact O-N 2.87Å; T215-Q219 VanDerWaalsContact O-N 3.13Å; T215-I226 HydrophobicContact CG2-CD1 4Å; T215-G241 VanDerWaalsContact CG2-O 3.29Å; T215-G241 WeakPolarHBondContact CG2-O 3.18Å; T215-V243 HydrophobicContact CG2-CG2 3.88Å
216	Q	98.9	Very high	98.7	Very high	30 Å²	30	31.3 Å²	31.3	14%	0.14	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-41.2	178.3	-69.8	-178.8	-4.6	0	0	112.1	Y182 I212 A213 Q219 T220 I362 K363	Y182-Q216 PolarHBondContact OH-OE1 2.7Å; I212-Q216 WeakPolarHBondContact O-CG 3.43Å; I212-Q216 PolarHBondContact O-N 3.46Å; A213-Q216 PolarHBondContact O-N 2.93Å; Q216-Q219 WeakPolarHBondContact O-CB 3.15Å; Q216-Q219 PolarHBondContact O-N 3.21Å; Q216-T220 PolarHBondContact O-N 3.04Å; Q216-I362 HydrophobicContact CB-CG2 4.08Å; Q216-K363 PolarHBondContact NE2-O 3.09Å; Q216-K363 PolarHBondContact OE1-O 2.92Å
217	L	98.9	Very high	98.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-38.8	176.5	-72.5	172.6	0	0	0	112.2	A185 Y186 L189 F190 A213 A214 T215 Q219 T220 L353 L356 I362	A185-L217 HydrophobicContact CB-CD1 3.73Å; Y186-L217 HydrophobicContact CD2-CD1 4.47Å; Y186-L217 HydrophobicContact CD2-CD2 4.18Å; L189-L217 HydrophobicContact CD1-CB 3.93Å; F190-L217 HydrophobicContact CE2-CB 4.09Å; F190-L217 HydrophobicContact CE2-CD2 4.26Å; A213-L217 WeakPolarHBondContact O-CB 3.31Å; A213-L217 VanDerWaalsContact O-CG 3.28Å; A213-L217 WeakPolarHBondContact O-CG 3.49Å; A213-L217 PolarHBondContact O-N 3.45Å; A214-L217 PolarHBondContact O-N 2.81Å; T215-L217 VanDerWaalsContact C-N 3.34Å; T215-L217 PolarHBondContact O-N 2.85Å; L217-Q219 VanDerWaalsContact C-N 3.27Å; L217-Q219 PolarHBondContact O-N 3.18Å; L217-T220 WeakPolarHBondContact O-CB 3.36Å; L217-T220 PolarHBondContact O-N 3.4Å; L217-T220 VanDerWaalsContact O-N 3.11Å; L217-T220 PolarHBondContact O-OG1 2.95Å; L217-L353 HydrophobicContact CD2-CD2 4.14Å; L217-L356 HydrophobicContact CD2-CD1 3.79Å; L217-I362 HydrophobicContact CD2-CG2 4Å; L217-I362 HydrophobicContact CG-CG2 4.48Å
218	C	98.9	Very high	98.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.8	-37.3	172.6	-75	0	0	0	0	112.3	L195 A214 T215 T220 V221 V224 I226	L195-C218 HydrophobicContact CD2-CB 4.39Å; A214-C218 WeakPolarHBondContact O-CB 3.32Å; A214-C218 PolarHBondContact O-N 3.07Å; A214-C218 PolarHBondContact O-SG 2.97Å; T215-C218 WeakPolarHBondContact O-CB 3.48Å; T215-C218 PolarHBondContact O-N 3.37Å; C218-T220 PolarHBondContact O-N 2.93Å; C218-V221 PolarHBondContact O-N 3.34Å; C218-V224 HydrophobicContact CB-CG1 3.92Å; C218-I226 HydrophobicContact CB-CD1 3.43Å; C218-I226 VanDerWaalsContact CB-CD1 3.43Å; C218-I226 HydrophobicContact CB-CG1 3.96Å
219	Q	98.7	Very high	98.7	Very high	108 Å²	108	30.7 Å²	30.7	51%	0.505	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-13.1	177.2	-66.2	179.7	-59.3	0	0	114	T215 Q216 L217 V221 G241	T215-Q219 WeakPolarHBondContact O-CG 3.5Å; T215-Q219 PolarHBondContact O-N 2.87Å; T215-Q219 VanDerWaalsContact O-N 3.13Å; Q216-Q219 WeakPolarHBondContact O-CB 3.15Å; Q216-Q219 PolarHBondContact O-N 3.21Å; L217-Q219 VanDerWaalsContact C-N 3.27Å; L217-Q219 PolarHBondContact O-N 3.18Å; Q219-V221 PolarHBondContact O-N 3.49Å; Q219-G241 PolarHBondContact OE1-O 3.06Å
220	T	98.7	Very high	98.7	Very high	54 Å²	54	30.3 Å²	30.3	33%	0.331	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-10.5	171.8	72.6	0	0	0	0	112.9	Q216 L217 C218 L356 K361	Q216-T220 PolarHBondContact O-N 3.04Å; L217-T220 WeakPolarHBondContact O-CB 3.36Å; L217-T220 PolarHBondContact O-N 3.4Å; L217-T220 VanDerWaalsContact O-N 3.11Å; L217-T220 PolarHBondContact O-OG1 2.95Å; C218-T220 PolarHBondContact O-N 2.93Å; T220-L356 HydrophobicContact CG2-CD2 4.46Å; T220-K361 HydrophobicContact CG2-CB 4.14Å
221	V	98.8	Very high	98.7	Very high	23 Å²	23	29.4 Å²	29.4	14%	0.139	16%	0.156	C	C	.	.	S	Bend	trans	-112.4	136.2	-179.5	-176	0	0	0	0	109.1	F190 L195 R196 P197 C218 Q219 V224	F190-V221 HydrophobicContact CE1-CG2 3.74Å; F190-V221 HydrophobicContact CZ-CG2 4.08Å; L195-V221 HydrophobicContact CD2-CB 4.29Å; L195-V221 HydrophobicContact CD2-CG2 3.82Å; L195-V221 HydrophobicContact CG-CG2 4.19Å; R196-V221 VanDerWaalsContact C-CG1 3.45Å; P197-V221 HydrophobicContact CG-CG1 4.03Å; C218-V221 PolarHBondContact O-N 3.34Å; Q219-V221 PolarHBondContact O-N 3.49Å; V221-V224 HydrophobicContact CB-CG2 3.72Å; V221-V224 HydrophobicContact CG1-CG2 3.7Å
222	Q	98.3	Very high	98.6	Very high	148 Å²	148	31.7 Å²	31.7	69%	0.692	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	143.3	-176.2	-63.8	174.4	19.3	0	0	111.7	P197 G198 V224	P197-Q222 WeakPolarHBondContact CA-O 3.47Å; P197-Q222 HydrophobicContact CB-CB 4.25Å; P197-Q222 HydrophobicContact CG-CB 4.46Å; G198-Q222 PolarHBondContact N-O 3.29Å; Q222-V224 PolarHBondContact O-N 2.94Å; Q222-V224 VanDerWaalsContact O-N 3.11Å
223	D	98.1	Very high	98.6	Very high	132 Å²	132	35.4 Å²	35.4	71%	0.706	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	33.8	170.2	-54	-29.9	0	0	0	115.4	G198	G198-D223 CarbonylContact C-O 3.55Å; G198-D223 WeakPolarHBondContact CA-O 3.46Å; G198-D223 PolarHBondContact N-O 2.82Å
224	V	98.8	Very high	98.5	Very high	20 Å²	20	36.2 Å²	36.2	12%	0.121	21%	0.206	C	C	.	.			trans	-84.2	123.4	173.8	176.8	0	0	0	0	110.6	L195 K199 V201 C218 V221 Q222 I226	L195-V224 HydrophobicContact CD1-CG1 4.17Å; L195-V224 HydrophobicContact CD1-CG2 4.03Å; L195-V224 HydrophobicContact CD2-CG2 4.5Å; L195-V224 HydrophobicContact CG-CG2 4.41Å; K199-V224 VanDerWaalsContact O-CA 3.28Å; K199-V224 WeakPolarHBondContact O-CA 3.32Å; V201-V224 HydrophobicContact CG2-CG1 3.92Å; C218-V224 HydrophobicContact CB-CG1 3.92Å; V221-V224 HydrophobicContact CB-CG2 3.72Å; V221-V224 HydrophobicContact CG1-CG2 3.7Å; Q222-V224 PolarHBondContact O-N 2.94Å; Q222-V224 VanDerWaalsContact O-N 3.11Å; V224-I226 HydrophobicContact CG1-CG1 4.06Å
225	T	98.8	Very high	98.5	Very high	49 Å²	49	37.9 Å²	37.9	30%	0.301	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121.2	174.7	-57.1	0	0	0	0	110.7	K199 S200 V201 F227 T244	K199-T225 PolarHBondContact O-N 2.84Å; S200-T225 CarbonylContact C-O 3.53Å; S200-T225 VanDerWaalsContact CA-O 3.24Å; S200-T225 WeakPolarHBondContact CA-O 3.48Å; V201-T225 PolarHBondContact N-O 2.92Å; T225-F227 HydrophobicContact CG2-CD2 4.38Å; T225-F227 HydrophobicContact CG2-CE2 3.74Å; T225-F227 HydrophobicContact CG2-CZ 4.1Å; T225-T244 HydrophobicContact CG2-CG2 4.38Å
226	I	98.9	Very high	98.5	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.015	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117.2	-174.5	-54.3	173	0	0	0	110.5	I203 T215 C218 V224 V243 T244 H245	I203-I226 HydrophobicContact CD1-CG2 3.65Å; I203-I226 HydrophobicContact CG1-CG2 4.18Å; T215-I226 HydrophobicContact CG2-CD1 4Å; C218-I226 HydrophobicContact CB-CD1 3.43Å; C218-I226 VanDerWaalsContact CB-CD1 3.43Å; C218-I226 HydrophobicContact CB-CG1 3.96Å; V224-I226 HydrophobicContact CG1-CG1 4.06Å; I226-V243 HydrophobicContact CG2-CB 4.49Å; I226-V243 HydrophobicContact CG2-CG1 4.47Å; I226-V243 HydrophobicContact CG2-CG2 4.17Å; I226-T244 PolarHBondContact N-OG1 3.05Å; I226-T244 WeakPolarHBondContact O-CA 3.46Å; I226-T244 WeakPolarHBondContact O-CB 3.31Å; I226-T244 PolarHBondContact O-N 3.03Å; I226-H245 PolarHBondContact O-N 3.26Å
227	F	98.9	Very high	98.4	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.6	167	-62.2	-91.4	0	0	0	108.8	V201 L202 I203 T225 H245 I247 V258 I261 V266	V201-F227 PolarHBondContact O-N 2.86Å; L202-F227 CarbonylContact C-O 3.48Å; L202-F227 WeakPolarHBondContact CA-O 3.27Å; L202-F227 HydrophobicContact CD1-CB 3.78Å; I203-F227 PolarHBondContact N-O 2.83Å; T225-F227 HydrophobicContact CG2-CD2 4.38Å; T225-F227 HydrophobicContact CG2-CE2 3.74Å; T225-F227 HydrophobicContact CG2-CZ 4.1Å; F227-H245 HydrophobicContact CD1-CB 3.61Å; F227-H245 AromaticContact CD1-CD2 3.93Å; F227-H245 HydrophobicContact CE1-CB 3.93Å; F227-H245 AromaticContact CE1-CD2 3.48Å; F227-H245 VanDerWaalsContact CE1-CD2 3.48Å; F227-H245 WeakPolarHBondContact CE1-CD2 3.41Å; F227-H245 AromaticContact CE1-CG 3.92Å; F227-H245 HydrophobicContact CG-CB 4.39Å; F227-H245 AromaticContact CZ-CD2 3.74Å; F227-I247 HydrophobicContact CB-CD1 4.48Å; F227-I247 HydrophobicContact CD1-CD1 4.25Å; F227-V258 HydrophobicContact CB-CG2 4.25Å; F227-V258 HydrophobicContact CD1-CB 4.45Å; F227-V258 HydrophobicContact CD1-CG1 4.5Å; F227-V258 HydrophobicContact CD1-CG2 3.85Å; F227-V258 HydrophobicContact CE1-CG1 4.42Å; F227-V258 HydrophobicContact CE1-CG2 4.42Å; F227-V258 HydrophobicContact CG-CG2 4.07Å; F227-V258 HydrophobicContact CZ-CG1 4.49Å; F227-I261 HydrophobicContact CE1-CB 3.9Å; F227-I261 HydrophobicContact CE1-CD1 3.92Å; F227-I261 HydrophobicContact CE1-CG2 3.96Å; F227-I261 HydrophobicContact CZ-CB 4.15Å; F227-I261 HydrophobicContact CZ-CG2 3.89Å; F227-V266 HydrophobicContact CD2-CG1 3.68Å; F227-V266 HydrophobicContact CE2-CG1 3.82Å
228	G	98.8	Very high	98.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.5	-175.9	0	0	0	0	0	112.1	I203 H245 P246 I247	I203-G228 WeakPolarHBondContact O-CA 3.46Å; G228-H245 PolarHBondContact N-O 2.87Å; G228-P246 CarbonylContact O-C 3.52Å; G228-P246 WeakPolarHBondContact O-CA 3.5Å; G228-I247 PolarHBondContact O-N 3.22Å
229	T	98.8	Very high	98.4	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.1	175.4	70.8	0	0	0	0	111.3	L202 I203 H204 M205 A206 I247 Y254	L202-T229 HydrophobicContact CD1-CG2 4.08Å; I203-T229 PolarHBondContact O-N 3.41Å; H204-T229 WeakPolarHBondContact CA-OG1 3.21Å; H204-T229 WeakPolarHBondContact ND1-CG2 3.43Å; H204-T229 PolarHBondContact ND1-OG1 3.5Å; M205-T229 WeakPolarHBondContact CA-O 3.4Å; M205-T229 PolarHBondContact N-O 3.44Å; M205-T229 PolarHBondContact N-OG1 3.28Å; A206-T229 PolarHBondContact N-O 2.94Å; A206-T229 VanDerWaalsContact N-O 3.11Å; T229-I247 WeakPolarHBondContact CA-O 3.35Å; T229-I247 HydrophobicContact CG2-CB 4.41Å; T229-Y254 HydrophobicContact CG2-CG 4.31Å
230	A	98.1	Very high	98.4	Very high	6 Å²	6	49.6 Å²	49.6	5%	0.05	28%	0.277	C	S	.	.			trans	-157.9	166.7	173.2	0	0	0	0	0	110.1	A207 K234 H235 I238 I247 D248	A207-A230 HydrophobicContact CB-CB 4.25Å; A230-K234 HydrophobicContact CB-CB 4.2Å; A230-H235 PolarHBondContact O-NE2 3.48Å; A230-I238 HydrophobicContact CB-CD1 3.89Å; A230-I247 PolarHBondContact N-O 3.44Å; A230-D248 WeakPolarHBondContact O-CA 3.38Å
231	S	97.4	Very high	98.3	Very high	8 Å²	8	48.6 Å²	48.6	6%	0.056	28%	0.277	C	S	.	.			trans	-62.2	147.6	171.5	54.7	0	0	0	0	111.2	S233 K234 H235	S231-S233 PolarHBondContact O-N 3.45Å; S231-S233 VanDerWaalsContact O-N 3.09Å; S231-S233 PolarHBondContact OG-OG 3Å; S231-K234 WeakPolarHBondContact O-CB 3.35Å; S231-K234 PolarHBondContact O-N 3.03Å; S231-H235 PolarHBondContact O-CD2 2.8Å; S231-H235 VanDerWaalsContact O-CD2 3.23Å
232	A	97.6	Very high	98.3	Very high	54 Å²	54	48.2 Å²	48.2	45%	0.446	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-50.3	-38.1	-178.2	0	0	0	0	0	114.1	K234 H235 D248	A232-K234 PolarHBondContact O-N 3.02Å; A232-H235 WeakPolarHBondContact O-CB 3.23Å; A232-H235 PolarHBondContact O-N 3.19Å; A232-D248 HydrophobicContact CB-CB 4.29Å
233	S	97.4	Very high	98.3	Very high	100 Å²	100	41.5 Å²	41.5	70%	0.699	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-59.3	-12.4	176.8	60	0	0	0	0	115.2	S231	S231-S233 PolarHBondContact O-N 3.45Å; S231-S233 VanDerWaalsContact O-N 3.09Å; S231-S233 PolarHBondContact OG-OG 3Å
234	K	98.3	Very high	98.3	Very high	17 Å²	17	38.5 Å²	38.5	7%	0.074	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-109	-3.7	-179.6	-56.8	-176.3	171.2	-165.4	0	112.9	A207 A230 S231 A232 E236 T237 I238 R385 Q386 N387 I388	A207-K234 HydrophobicContact CB-CB 4.08Å; A207-K234 HydrophobicContact CB-CD 3.63Å; A207-K234 HydrophobicContact CB-CG 4.42Å; A230-K234 HydrophobicContact CB-CB 4.2Å; S231-K234 WeakPolarHBondContact O-CB 3.35Å; S231-K234 PolarHBondContact O-N 3.03Å; A232-K234 PolarHBondContact O-N 3.02Å; K234-E236 PolarHBondContact O-N 3.08Å; K234-T237 PolarHBondContact O-N 3.09Å; K234-I238 WeakPolarHBondContact O-CG1 3.34Å; K234-I238 PolarHBondContact O-N 2.94Å; K234-R385 PolarHBondContact NZ-O 3.35Å; K234-Q386 WeakPolarHBondContact CE-O 3.47Å; K234-Q386 PolarHBondContact NZ-O 3.4Å; K234-N387 PolarHBondContact NZ-O 3.39Å; K234-I388 HydrophobicContact CB-CD1 4.35Å; K234-I388 HydrophobicContact CD-CD1 4.39Å; K234-I388 HydrophobicContact CD-CG1 3.91Å; K234-I388 HydrophobicContact CG-CD1 3.93Å; K234-I388 HydrophobicContact CG-CG1 4.03Å
235	H	98.5	Very high	98.3	Very high	36 Å²	36	40 Å²	40	17%	0.167	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-42.3	-171.9	-77.7	-163.5	0	0	0	112.4	A230 S231 A232 T237 I238 S239 P246 I247 D248	A230-H235 PolarHBondContact O-NE2 3.48Å; S231-H235 PolarHBondContact O-CD2 2.8Å; S231-H235 VanDerWaalsContact O-CD2 3.23Å; A232-H235 WeakPolarHBondContact O-CB 3.23Å; A232-H235 PolarHBondContact O-N 3.19Å; H235-T237 PolarHBondContact O-N 3.05Å; H235-I238 WeakPolarHBondContact O-CG1 3.26Å; H235-I238 PolarHBondContact O-N 3.48Å; H235-S239 VanDerWaalsContact O-CB 3.26Å; H235-S239 WeakPolarHBondContact O-CB 3.24Å; H235-S239 PolarHBondContact O-N 3.41Å; H235-S239 PolarHBondContact O-OG 2.98Å; H235-P246 HydrophobicContact CB-CB 4.04Å; H235-P246 HydrophobicContact CB-CG 4.33Å; H235-I247 VanDerWaalsContact CE1-C 3.47Å; H235-I247 PolarHBondContact NE2-O 2.99Å; H235-D248 PolarHBondContact CE1-N 2.63Å; H235-D248 PolarHBondContact NE2-N 2.65Å
236	E	98.3	Very high	98.3	Very high	140 Å²	140	39.7 Å²	39.7	65%	0.654	24%	0.239	S	C	*	.	H	α-helix	trans	-57.4	-51.6	176.4	-177.4	176.5	-175.3	0	0	110.9	K234 I238 S239 Q240	K234-E236 PolarHBondContact O-N 3.08Å; E236-I238 PolarHBondContact O-N 3.28Å; E236-S239 PolarHBondContact O-N 3.14Å; E236-Q240 WeakPolarHBondContact O-CG 3.15Å; E236-Q240 PolarHBondContact O-N 2.64Å; E236-Q240 PolarHBondContact OE1-NE2 3.28Å
237	T	98.1	Very high	98.3	Very high	48 Å²	48	39.9 Å²	39.9	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-61.5	-44.7	-178.7	-46.4	0	0	0	0	112.6	K234 H235 S239 G241 I388	K234-T237 PolarHBondContact O-N 3.09Å; H235-T237 PolarHBondContact O-N 3.05Å; T237-S239 VanDerWaalsContact C-N 3.33Å; T237-S239 PolarHBondContact O-N 3.21Å; T237-G241 PolarHBondContact O-N 2.98Å; T237-I388 HydrophobicContact CG2-CG2 3.79Å
238	I	98.5	Very high	98.3	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.036	24%	0.244	C	C	.	.	H	α-helix	trans	-71.7	-29.9	179.4	66.7	177.8	0	0	0	112.3	A206 A207 A230 K234 H235 E236 G241 G242 V243 P246	A206-I238 HydrophobicContact CB-CD1 4.23Å; A207-I238 HydrophobicContact CB-CG2 3.63Å; A230-I238 HydrophobicContact CB-CD1 3.89Å; K234-I238 WeakPolarHBondContact O-CG1 3.34Å; K234-I238 PolarHBondContact O-N 2.94Å; H235-I238 WeakPolarHBondContact O-CG1 3.26Å; H235-I238 PolarHBondContact O-N 3.48Å; E236-I238 PolarHBondContact O-N 3.28Å; I238-G241 CarbonylContact O-C 3.57Å; I238-G241 PolarHBondContact O-N 3.3Å; I238-G242 PolarHBondContact O-N 3.17Å; I238-G242 VanDerWaalsContact O-N 3.16Å; I238-V243 HydrophobicContact CB-CB 4.26Å; I238-V243 HydrophobicContact CB-CG2 3.85Å; I238-V243 HydrophobicContact CD1-CG1 4.38Å; I238-V243 HydrophobicContact CD1-CG2 4.38Å; I238-V243 HydrophobicContact CG1-CB 4.22Å; I238-V243 HydrophobicContact CG1-CG2 4.22Å; I238-V243 VanDerWaalsContact O-CB 3.3Å; I238-V243 WeakPolarHBondContact O-CB 3.22Å; I238-V243 WeakPolarHBondContact O-CG2 3.45Å; I238-V243 PolarHBondContact O-N 2.98Å; I238-P246 HydrophobicContact CD1-CB 3.78Å; I238-P246 HydrophobicContact CG1-CB 4.11Å
239	S	98.6	Very high	98	Very high	49 Å²	49	44.5 Å²	44.5	34%	0.343	26%	0.259	S	S	.	.	H	α-helix	trans	-69.4	-46.4	176.2	-55.1	0	0	0	0	110.7	H235 E236 T237 G241 G242 P246	H235-S239 VanDerWaalsContact O-CB 3.26Å; H235-S239 WeakPolarHBondContact O-CB 3.24Å; H235-S239 PolarHBondContact O-N 3.41Å; H235-S239 PolarHBondContact O-OG 2.98Å; E236-S239 PolarHBondContact O-N 3.14Å; T237-S239 VanDerWaalsContact C-N 3.33Å; T237-S239 PolarHBondContact O-N 3.21Å; S239-G241 PolarHBondContact O-N 3.18Å; S239-G242 PolarHBondContact O-N 2.98Å; S239-P246 WeakPolarHBondContact OG-CG 3.34Å
240	Q	98.1	Very high	97.7	Very high	143 Å²	143	51.6 Å²	51.6	67%	0.668	29%	0.285	S	S	*	.	H	α-helix	trans	-59.2	-34	171.5	-70.7	172.5	-1	0	0	111.7	E236 G242	E236-Q240 WeakPolarHBondContact O-CG 3.15Å; E236-Q240 PolarHBondContact O-N 2.64Å; E236-Q240 PolarHBondContact OE1-NE2 3.28Å; Q240-G242 VanDerWaalsContact C-N 3.27Å; Q240-G242 PolarHBondContact O-N 3.13Å
241	G	97.2	Very high	97.6	Very high	33 Å²	33	56.3 Å²	56.3	34%	0.34	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-2.8	174.7	0	0	0	0	0	115.6	T215 Q219 T237 I238 S239	T215-G241 VanDerWaalsContact CG2-O 3.29Å; T215-G241 WeakPolarHBondContact CG2-O 3.18Å; Q219-G241 PolarHBondContact OE1-O 3.06Å; T237-G241 PolarHBondContact O-N 2.98Å; I238-G241 CarbonylContact O-C 3.57Å; I238-G241 PolarHBondContact O-N 3.3Å; S239-G241 PolarHBondContact O-N 3.18Å
242	G	98.3	Very high	97.4	Very high	16 Å²	16	61 Å²	61	17%	0.165	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	114.5	-3.3	173.1	0	0	0	0	0	117.1	I238 S239 Q240 T244	I238-G242 PolarHBondContact O-N 3.17Å; I238-G242 VanDerWaalsContact O-N 3.16Å; S239-G242 PolarHBondContact O-N 2.98Å; Q240-G242 VanDerWaalsContact C-N 3.27Å; Q240-G242 PolarHBondContact O-N 3.13Å; G242-T244 PolarHBondContact O-N 3.42Å
243	V	98.8	Very high	97.4	Very high	7 Å²	7	61.5 Å²	61.5	4%	0.042	33%	0.328	C	S	.	.			trans	-66	118.9	174.9	173.6	0	0	0	0	109.5	A206 T215 I226 I238 P246	A206-V243 HydrophobicContact CB-CG2 4.21Å; T215-V243 HydrophobicContact CG2-CG2 3.88Å; I226-V243 HydrophobicContact CG2-CB 4.49Å; I226-V243 HydrophobicContact CG2-CG1 4.47Å; I226-V243 HydrophobicContact CG2-CG2 4.17Å; I238-V243 HydrophobicContact CB-CB 4.26Å; I238-V243 HydrophobicContact CB-CG2 3.85Å; I238-V243 HydrophobicContact CD1-CG1 4.38Å; I238-V243 HydrophobicContact CD1-CG2 4.38Å; I238-V243 HydrophobicContact CG1-CB 4.22Å; I238-V243 HydrophobicContact CG1-CG2 4.22Å; I238-V243 VanDerWaalsContact O-CB 3.3Å; I238-V243 WeakPolarHBondContact O-CB 3.22Å; I238-V243 WeakPolarHBondContact O-CG2 3.45Å; I238-V243 PolarHBondContact O-N 2.98Å; V243-P246 HydrophobicContact CG1-CB 4.34Å
244	T	98.6	Very high	97.5	Very high	68 Å²	68	57.3 Å²	57.3	42%	0.417	30%	0.297	S	S	.	.	S	Bend	trans	-68.3	-40.6	-179.9	-38.1	0	0	0	0	112.1	T225 I226 G242	T225-T244 HydrophobicContact CG2-CG2 4.38Å; I226-T244 PolarHBondContact N-OG1 3.05Å; I226-T244 WeakPolarHBondContact O-CA 3.46Å; I226-T244 WeakPolarHBondContact O-CB 3.31Å; I226-T244 PolarHBondContact O-N 3.03Å; G242-T244 PolarHBondContact O-N 3.42Å
245	H	98.8	Very high	97.5	Very high	51 Å²	51	57.7 Å²	57.7	24%	0.236	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	89.8	-175.6	-58	-55.8	0	0	0	110.7	I226 F227 G228 I261	I226-H245 PolarHBondContact O-N 3.26Å; F227-H245 HydrophobicContact CD1-CB 3.61Å; F227-H245 AromaticContact CD1-CD2 3.93Å; F227-H245 HydrophobicContact CE1-CB 3.93Å; F227-H245 AromaticContact CE1-CD2 3.48Å; F227-H245 VanDerWaalsContact CE1-CD2 3.48Å; F227-H245 WeakPolarHBondContact CE1-CD2 3.41Å; F227-H245 AromaticContact CE1-CG 3.92Å; F227-H245 HydrophobicContact CG-CB 4.39Å; F227-H245 AromaticContact CZ-CD2 3.74Å; G228-H245 PolarHBondContact N-O 2.87Å; H245-I261 HydrophobicContact CB-CD1 4.1Å
246	P	98.7	Very high	97.4	Very high	44 Å²	44	59.2 Å²	59.2	29%	0.286	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	137.8	173.8	32.7	-38.6	0	0	0	110.7	G228 H235 I238 S239 V243	G228-P246 CarbonylContact O-C 3.52Å; G228-P246 WeakPolarHBondContact O-CA 3.5Å; H235-P246 HydrophobicContact CB-CB 4.04Å; H235-P246 HydrophobicContact CB-CG 4.33Å; I238-P246 HydrophobicContact CD1-CB 3.78Å; I238-P246 HydrophobicContact CG1-CB 4.11Å; S239-P246 WeakPolarHBondContact OG-CG 3.34Å; V243-P246 HydrophobicContact CG1-CB 4.34Å
247	I	98.8	Very high	97.5	Very high	7 Å²	7	54.1 Å²	54.1	4%	0.036	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	125.6	-177.6	-60	169.5	0	0	0	109.6	F227 G228 T229 A230 H235 Y249 E257 V258	F227-I247 HydrophobicContact CB-CD1 4.48Å; F227-I247 HydrophobicContact CD1-CD1 4.25Å; G228-I247 PolarHBondContact O-N 3.22Å; T229-I247 WeakPolarHBondContact CA-O 3.35Å; T229-I247 HydrophobicContact CG2-CB 4.41Å; A230-I247 PolarHBondContact N-O 3.44Å; H235-I247 VanDerWaalsContact CE1-C 3.47Å; H235-I247 PolarHBondContact NE2-O 2.99Å; I247-Y249 PolarHBondContact O-N 2.98Å; I247-E257 HydrophobicContact CD1-CB 4.05Å; I247-E257 HydrophobicContact CG1-CB 4.24Å; I247-E257 HydrophobicContact CG2-CB 4.16Å; I247-E257 HydrophobicContact CG2-CG 4.22Å; I247-V258 HydrophobicContact CD1-CG2 3.71Å
248	D	98.1	Very high	97.5	Very high	17 Å²	17	51.9 Å²	51.9	9%	0.091	28%	0.275	C	S	.	.			trans	-84.3	96.9	172.8	-176.4	14.6	0	0	0	110.3	A230 A232 H235 R250 T251 K252	A230-D248 WeakPolarHBondContact O-CA 3.38Å; A232-D248 HydrophobicContact CB-CB 4.29Å; H235-D248 PolarHBondContact CE1-N 2.63Å; H235-D248 PolarHBondContact NE2-N 2.65Å; D248-R250 PolarHBondContact O-N 3.28Å; D248-R250 VanDerWaalsContact O-N 3.16Å; D248-R250 WeakPolarHBondContact OD1-CB 3.26Å; D248-R250 PolarHBondContact OD1-N 3.42Å; D248-R250 VanDerWaalsContact OD1-N 3.08Å; D248-T251 VanDerWaalsContact CG-OG1 3.27Å; D248-T251 PolarHBondContact O-N 2.96Å; D248-T251 WeakPolarHBondContact OD2-CG2 3.16Å; D248-T251 PolarHBondContact OD2-OG1 2.84Å; D248-K252 WeakPolarHBondContact O-CB 3.18Å; D248-K252 PolarHBondContact O-N 3.12Å
249	Y	93.9	Very high	97.5	Very high	80 Å²	80	56.9 Å²	56.9	31%	0.314	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-12.3	-179.2	72.3	-88.3	0	0	0	113.4	I247	I247-Y249 PolarHBondContact O-N 2.98Å
250	R	92.3	Very high	97.5	Very high	152 Å²	152	61.3 Å²	61.3	57%	0.574	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-29.6	179	-61.2	-179.5	174.1	-176.6	-4.1	112.3	D248	D248-R250 PolarHBondContact O-N 3.28Å; D248-R250 VanDerWaalsContact O-N 3.16Å; D248-R250 WeakPolarHBondContact OD1-CB 3.26Å; D248-R250 PolarHBondContact OD1-N 3.42Å; D248-R250 VanDerWaalsContact OD1-N 3.08Å
251	T	94.7	Very high	97.5	Very high	105 Å²	105	58.7 Å²	58.7	64%	0.644	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-17.7	-174.9	56.5	0	0	0	0	112.5	D248	D248-T251 VanDerWaalsContact CG-OG1 3.27Å; D248-T251 PolarHBondContact O-N 2.96Å; D248-T251 WeakPolarHBondContact OD2-CG2 3.16Å; D248-T251 PolarHBondContact OD2-OG1 2.84Å
252	K	94.9	Very high	97.5	Very high	107 Å²	107	58.2 Å²	58.2	47%	0.465	29%	0.287	S	S	.	.	S	Bend	trans	-132.1	148.3	-177.2	-56.4	-176.6	173.9	-172.6	0	112.1	D248 Y254 E257	D248-K252 WeakPolarHBondContact O-CB 3.18Å; D248-K252 PolarHBondContact O-N 3.12Å; K252-Y254 PolarHBondContact O-N 3.33Å; K252-E257 HydrophobicContact CB-CG 3.91Å; K252-E257 HydrophobicContact CD-CG 3.79Å; K252-E257 VanDerWaalsContact CD-OE2 3.3Å; K252-E257 WeakPolarHBondContact CD-OE2 3.36Å; K252-E257 IonicContact NZ-OE2 2.88Å; K252-E257 PolarHBondContact NZ-OE2 3.46Å
253	D	97.4	Very high	97.5	Very high	64 Å²	64	61.9 Å²	61.9	34%	0.342	31%	0.308	S	S	.	.			trans	-75.1	112.4	166.5	174.4	60.1	0	0	0	110	V255 T256 E257 K280	D253-V255 PolarHBondContact O-N 2.9Å; D253-V255 WeakPolarHBondContact OD2-CB 3.33Å; D253-T256 WeakPolarHBondContact O-CB 3.39Å; D253-T256 PolarHBondContact O-N 2.57Å; D253-T256 WeakPolarHBondContact OD2-CB 3.47Å; D253-T256 PolarHBondContact OD2-N 3Å; D253-T256 PolarHBondContact OD2-OG1 3.36Å; D253-E257 PolarHBondContact O-N 2.86Å; D253-E257 VanDerWaalsContact O-N 3.12Å; D253-K280 IonicContact OD1-NZ 3.69Å
254	Y	98.1	Very high	97.5	Very high	12 Å²	12	69.8 Å²	69.8	5%	0.047	34%	0.342	C	S	.	.	H	α-helix	trans	-64.8	-27.2	-175.3	64.5	-100.1	0	0	0	113.1	L202 H204 T229 K252 E257 V258 D277 K280 L284	L202-Y254 HydrophobicContact CD2-CD2 4.34Å; L202-Y254 HydrophobicContact CD2-CE2 4.45Å; H204-Y254 AromaticContact CE1-CD2 3.99Å; H204-Y254 AromaticContact CE1-CE2 3.76Å; H204-Y254 AromaticContact CE1-CZ 3.78Å; T229-Y254 HydrophobicContact CG2-CG 4.31Å; K252-Y254 PolarHBondContact O-N 3.33Å; Y254-E257 PolarHBondContact O-N 3.43Å; Y254-V258 WeakPolarHBondContact O-CB 3.23Å; Y254-V258 VanDerWaalsContact O-CG2 3.23Å; Y254-V258 WeakPolarHBondContact O-CG2 3.37Å; Y254-V258 PolarHBondContact O-N 3.05Å; Y254-D277 WeakPolarHBondContact CE1-OD1 3.42Å; Y254-D277 PolarHBondContact OH-OD1 2.68Å; Y254-K280 HydrophobicContact CE1-CD 4.27Å; Y254-K280 HydrophobicContact CE2-CB 4.28Å; Y254-K280 WeakPolarHBondContact OH-CB 3.46Å; Y254-K280 VanDerWaalsContact OH-CD 3.22Å; Y254-K280 WeakPolarHBondContact OH-CD 3.39Å; Y254-L284 HydrophobicContact CD2-CD1 4Å; Y254-L284 HydrophobicContact CE2-CD1 3.82Å
255	V	98.3	Very high	97.5	Very high	25 Å²	25	66.6 Å²	66.6	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-63.1	-47	176.4	176.7	0	0	0	0	109.9	D253 R259 K280 L284	D253-V255 PolarHBondContact O-N 2.9Å; D253-V255 WeakPolarHBondContact OD2-CB 3.33Å; V255-R259 WeakPolarHBondContact O-CB 3.44Å; V255-R259 WeakPolarHBondContact O-CG 3.48Å; V255-R259 PolarHBondContact O-N 3.27Å; V255-K280 HydrophobicContact CG2-CB 3.95Å; V255-K280 HydrophobicContact CG2-CD 4.17Å; V255-K280 HydrophobicContact CG2-CG 4.22Å; V255-L284 HydrophobicContact CB-CD1 4.23Å; V255-L284 HydrophobicContact CB-CD2 4.45Å; V255-L284 HydrophobicContact CB-CG 4.39Å; V255-L284 HydrophobicContact CG1-CD1 4.38Å; V255-L284 HydrophobicContact CG1-CD2 3.93Å; V255-L284 HydrophobicContact CG1-CG 3.99Å; V255-L284 HydrophobicContact CG2-CD1 3.74Å; V255-L284 HydrophobicContact CG2-CG 4.17Å
256	T	98.3	Very high	97.5	Very high	69 Å²	69	64.1 Å²	64.1	42%	0.423	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-46.4	176.9	-59.9	0	0	0	0	111.5	D253 V258 R259 K260	D253-T256 WeakPolarHBondContact O-CB 3.39Å; D253-T256 PolarHBondContact O-N 2.57Å; D253-T256 WeakPolarHBondContact OD2-CB 3.47Å; D253-T256 PolarHBondContact OD2-N 3Å; D253-T256 PolarHBondContact OD2-OG1 3.36Å; T256-V258 PolarHBondContact O-N 2.91Å; T256-R259 PolarHBondContact O-N 2.95Å; T256-K260 WeakPolarHBondContact O-CG 3.34Å; T256-K260 PolarHBondContact O-N 3.41Å
257	E	98.5	Very high	97.5	Very high	33 Å²	33	63.4 Å²	63.4	15%	0.154	31%	0.305	C	S	.	.	H	α-helix	trans	-64.5	-41.2	-180	-64.9	-61.1	101	0	0	112.5	I247 K252 D253 Y254 R259 K260	I247-E257 HydrophobicContact CD1-CB 4.05Å; I247-E257 HydrophobicContact CG1-CB 4.24Å; I247-E257 HydrophobicContact CG2-CB 4.16Å; I247-E257 HydrophobicContact CG2-CG 4.22Å; K252-E257 HydrophobicContact CB-CG 3.91Å; K252-E257 HydrophobicContact CD-CG 3.79Å; K252-E257 VanDerWaalsContact CD-OE2 3.3Å; K252-E257 WeakPolarHBondContact CD-OE2 3.36Å; K252-E257 IonicContact NZ-OE2 2.88Å; K252-E257 PolarHBondContact NZ-OE2 3.46Å; D253-E257 PolarHBondContact O-N 2.86Å; D253-E257 VanDerWaalsContact O-N 3.12Å; Y254-E257 PolarHBondContact O-N 3.43Å; E257-R259 PolarHBondContact O-N 3.31Å; E257-K260 PolarHBondContact O-N 3.04Å; E257-K260 WeakPolarHBondContact OE1-CE 3.31Å; E257-K260 IonicContact OE1-NZ 3.68Å; E257-K260 PolarHBondContact OE1-NZ 3.03Å
258	V	98.7	Very high	97.5	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-45.5	173.9	170.6	0	0	0	0	110.5	L202 F227 I247 Y254 T256 K260 I261 S262 V266 L284	L202-V258 HydrophobicContact CD1-CG2 4.38Å; F227-V258 HydrophobicContact CB-CG2 4.25Å; F227-V258 HydrophobicContact CD1-CB 4.45Å; F227-V258 HydrophobicContact CD1-CG1 4.5Å; F227-V258 HydrophobicContact CD1-CG2 3.85Å; F227-V258 HydrophobicContact CE1-CG1 4.42Å; F227-V258 HydrophobicContact CE1-CG2 4.42Å; F227-V258 HydrophobicContact CG-CG2 4.07Å; F227-V258 HydrophobicContact CZ-CG1 4.49Å; I247-V258 HydrophobicContact CD1-CG2 3.71Å; Y254-V258 WeakPolarHBondContact O-CB 3.23Å; Y254-V258 VanDerWaalsContact O-CG2 3.23Å; Y254-V258 WeakPolarHBondContact O-CG2 3.37Å; Y254-V258 PolarHBondContact O-N 3.05Å; T256-V258 PolarHBondContact O-N 2.91Å; V258-K260 VanDerWaalsContact C-N 3.29Å; V258-K260 PolarHBondContact O-N 3.47Å; V258-I261 PolarHBondContact O-N 3.44Å; V258-I261 VanDerWaalsContact O-N 3.15Å; V258-S262 PolarHBondContact O-N 3.14Å; V258-V266 HydrophobicContact CG1-CG1 3.79Å; V258-L284 HydrophobicContact CB-CD2 4.03Å; V258-L284 HydrophobicContact CG1-CD2 3.82Å
259	R	98.5	Very high	97.5	Very high	113 Å²	113	62.3 Å²	62.3	43%	0.426	30%	0.299	S	S	.	.	H	α-helix	trans	-67	-25.6	-178.4	-75.8	178.3	179.2	-91.7	0.6	114	V255 T256 E257 I261 S262 P263 G283 L284	V255-R259 WeakPolarHBondContact O-CB 3.44Å; V255-R259 WeakPolarHBondContact O-CG 3.48Å; V255-R259 PolarHBondContact O-N 3.27Å; T256-R259 PolarHBondContact O-N 2.95Å; E257-R259 PolarHBondContact O-N 3.31Å; R259-I261 VanDerWaalsContact C-N 3.25Å; R259-I261 PolarHBondContact O-N 2.97Å; R259-S262 CarbonylContact O-C 3.56Å; R259-P263 WeakPolarHBondContact O-CA 3.33Å; R259-P263 WeakPolarHBondContact O-CG 3.42Å; R259-G283 PolarHBondContact NH2-O 2.81Å; R259-G283 VanDerWaalsContact NH2-O 3.15Å; R259-L284 HydrophobicContact CG-CD2 4.26Å
260	K	98.4	Very high	97.8	Very high	142 Å²	142	58.6 Å²	58.6	62%	0.617	29%	0.285	S	S	*	.	H	α-helix	trans	-62.5	-35	172.9	-74.8	172.6	-179.6	171.2	0	112.2	T256 E257 V258	T256-K260 WeakPolarHBondContact O-CG 3.34Å; T256-K260 PolarHBondContact O-N 3.41Å; E257-K260 PolarHBondContact O-N 3.04Å; E257-K260 WeakPolarHBondContact OE1-CE 3.31Å; E257-K260 IonicContact OE1-NZ 3.68Å; E257-K260 PolarHBondContact OE1-NZ 3.03Å; V258-K260 VanDerWaalsContact C-N 3.29Å; V258-K260 PolarHBondContact O-N 3.47Å
261	I	98.2	Very high	98	Very high	88 Å²	88	51.4 Å²	51.4	45%	0.451	26%	0.258	S	S	.	.	H	α-helix	trans	-97.1	-42	-175.7	-60.7	162.4	0	0	0	110.8	F227 H245 V258 R259	F227-I261 HydrophobicContact CE1-CB 3.9Å; F227-I261 HydrophobicContact CE1-CD1 3.92Å; F227-I261 HydrophobicContact CE1-CG2 3.96Å; F227-I261 HydrophobicContact CZ-CB 4.15Å; F227-I261 HydrophobicContact CZ-CG2 3.89Å; H245-I261 HydrophobicContact CB-CD1 4.1Å; V258-I261 PolarHBondContact O-N 3.44Å; V258-I261 VanDerWaalsContact O-N 3.15Å; R259-I261 VanDerWaalsContact C-N 3.25Å; R259-I261 PolarHBondContact O-N 2.97Å
262	S	98.3	Very high	98.1	Very high	22 Å²	22	47 Å²	47	15%	0.154	23%	0.231	C	C	.	.			trans	-125.9	85.4	176.7	-172.3	0	0	0	0	110.1	V258 R259 K264 G265	V258-S262 PolarHBondContact O-N 3.14Å; R259-S262 CarbonylContact O-C 3.56Å; S262-K264 PolarHBondContact O-N 2.94Å; S262-G265 WeakPolarHBondContact CB-O 3.4Å; S262-G265 PolarHBondContact O-N 3.4Å; S262-G265 PolarHBondContact OG-O 3.44Å
263	P	98	Very high	98	Very high	93 Å²	93	42.5 Å²	42.5	60%	0.604	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.9	-174.9	-27.9	35.1	0	0	0	114.8	R259 G265	R259-P263 WeakPolarHBondContact O-CA 3.33Å; R259-P263 WeakPolarHBondContact O-CG 3.42Å; P263-G265 VanDerWaalsContact C-N 3.33Å
264	K	97.4	Very high	97.5	Very high	174 Å²	174	39.8 Å²	39.8	76%	0.757	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-6.5	178.5	-63.3	-177.4	-179.1	177.9	0	113.6	S262 K286	S262-K264 PolarHBondContact O-N 2.94Å; K264-K286 HydrophobicContact CB-CG 4.28Å; K264-K286 WeakPolarHBondContact O-CG 3.27Å
265	G	98.4	Very high	97	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.2	C	C	.	.			trans	99.2	-154.6	-177.4	0	0	0	0	0	114.1	S262 P263 L284 K286	S262-G265 WeakPolarHBondContact CB-O 3.4Å; S262-G265 PolarHBondContact O-N 3.4Å; S262-G265 PolarHBondContact OG-O 3.44Å; P263-G265 VanDerWaalsContact C-N 3.33Å; G265-L284 CarbonylContact C-O 3.59Å; G265-L284 WeakPolarHBondContact CA-O 3.38Å; G265-K286 WeakPolarHBondContact O-CE 3.26Å
266	V	98.9	Very high	96.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	160.2	179.3	-65	0	0	0	0	112.4	S200 L202 F227 V258 V269 L284 L285 K286	S200-V266 VanDerWaalsContact OG-CA 3.31Å; S200-V266 WeakPolarHBondContact OG-CA 3.23Å; L202-V266 HydrophobicContact CB-CG1 4.5Å; L202-V266 HydrophobicContact CB-CG2 3.99Å; F227-V266 HydrophobicContact CD2-CG1 3.68Å; F227-V266 HydrophobicContact CE2-CG1 3.82Å; V258-V266 HydrophobicContact CG1-CG1 3.79Å; V266-V269 HydrophobicContact CG2-CG2 3.52Å; V266-L284 PolarHBondContact N-O 3.23Å; V266-L285 CarbonylContact O-C 3.55Å; V266-L285 WeakPolarHBondContact O-CA 3.37Å; V266-K286 PolarHBondContact O-N 3.1Å
267	D	98.9	Very high	96.3	Very high	29 Å²	29	38.5 Å²	38.5	16%	0.155	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-33.9	179.4	-58.1	-81.9	0	0	0	111.9	K199 S200 K286 G289 M290	K199-D267 HydrophobicContact CB-CB 4.14Å; K199-D267 HydrophobicContact CD-CB 4.15Å; K199-D267 HydrophobicContact CG-CB 4.08Å; S200-D267 PolarHBondContact N-OD2 3.26Å; S200-D267 WeakPolarHBondContact O-CA 3.1Å; S200-D267 WeakPolarHBondContact O-CB 3.01Å; S200-D267 PolarHBondContact O-N 2.96Å; S200-D267 PolarHBondContact OG-N 3.06Å; S200-D267 VanDerWaalsContact OG-N 3.16Å; S200-D267 PolarHBondContact OG-OD2 3.37Å; D267-K286 WeakPolarHBondContact OD1-CD 3.39Å; D267-K286 IonicContact OD1-NZ 2.86Å; D267-K286 IonicContact OD2-NZ 2.69Å; D267-K286 PolarHBondContact OD2-NZ 3.24Å; D267-G289 CarbonylContact O-C 3.45Å; D267-G289 WeakPolarHBondContact O-CA 3.42Å; D267-M290 PolarHBondContact O-N 3.37Å
268	I	98.9	Very high	96.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	135.7	-176.9	-55	171.6	0	0	0	109.7	A193 L195 K199 S200 V201 L202 L270 M290	A193-I268 HydrophobicContact CB-CB 4.48Å; A193-I268 HydrophobicContact CB-CD1 3.56Å; A193-I268 HydrophobicContact CB-CG1 3.84Å; A193-I268 HydrophobicContact CB-CG2 3.8Å; L195-I268 HydrophobicContact CB-CD1 4.18Å; L195-I268 HydrophobicContact CD1-CD1 3.76Å; K199-I268 HydrophobicContact CD-CD1 4.14Å; S200-I268 PolarHBondContact O-N 3.27Å; V201-I268 CarbonylContact C-O 3.43Å; V201-I268 WeakPolarHBondContact CA-O 3.22Å; V201-I268 HydrophobicContact CB-CB 4.44Å; V201-I268 HydrophobicContact CG1-CB 4.09Å; V201-I268 HydrophobicContact CG1-CG2 4.13Å; V201-I268 HydrophobicContact CG2-CB 4.16Å; V201-I268 HydrophobicContact CG2-CD1 4.17Å; L202-I268 PolarHBondContact N-O 2.99Å; I268-L270 HydrophobicContact CG2-CD2 3.92Å; I268-L270 HydrophobicContact CG2-CG 4.45Å; I268-M290 WeakPolarHBondContact CA-O 3.35Å
269	V	98.9	Very high	95.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	122.7	169.6	178.5	0	0	0	0	109.2	L202 V266 L285 M290 L291 I292	L202-V269 HydrophobicContact CB-CG2 4.2Å; L202-V269 HydrophobicContact CD2-CG1 4.23Å; L202-V269 HydrophobicContact CD2-CG2 4.32Å; V266-V269 HydrophobicContact CG2-CG2 3.52Å; V269-L285 HydrophobicContact CB-CD2 4.34Å; V269-L285 HydrophobicContact CG2-CD2 3.72Å; V269-M290 PolarHBondContact N-O 3.1Å; V269-L291 HydrophobicContact CB-CB 4.29Å; V269-L291 HydrophobicContact CB-CD1 4.16Å; V269-L291 HydrophobicContact CB-CG 4.14Å; V269-L291 HydrophobicContact CG1-CD1 3.96Å; V269-L291 HydrophobicContact CG1-CG 4.23Å; V269-L291 WeakPolarHBondContact O-CA 3.21Å; V269-I292 PolarHBondContact O-N 3.1Å
270	L	98.9	Very high	95.8	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.4	172.2	-54.8	-175.1	0	0	0	109	M188 L189 V201 L202 I203 H204 A214 I268 P272 I292 F294	M188-L270 HydrophobicContact CB-CD2 4.07Å; M188-L270 HydrophobicContact CE-CD1 4.16Å; M188-L270 HydrophobicContact CE-CD2 4.23Å; M188-L270 HydrophobicContact SD-CD2 4.19Å; L189-L270 HydrophobicContact CD2-CD1 4.17Å; L189-L270 HydrophobicContact CG-CD1 4.47Å; V201-L270 HydrophobicContact CG1-CG 4.39Å; L202-L270 PolarHBondContact O-N 2.94Å; I203-L270 HydrophobicContact CG1-CD1 4.34Å; H204-L270 PolarHBondContact N-O 2.86Å; A214-L270 HydrophobicContact CB-CD1 3.78Å; I268-L270 HydrophobicContact CG2-CD2 3.92Å; I268-L270 HydrophobicContact CG2-CG 4.45Å; L270-P272 VanDerWaalsContact O-CD 3.31Å; L270-P272 WeakPolarHBondContact O-CD 3.32Å; L270-I292 HydrophobicContact CD2-CB 4.42Å; L270-I292 HydrophobicContact CD2-CD1 4.33Å; L270-F294 HydrophobicContact CB-CE1 3.9Å
271	D	98	Very high	95.7	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	98.5	-173.1	-179.1	15.3	0	0	0	112.4	L273 G274 T278 L291 I292 V293 F294	D271-L273 VanDerWaalsContact C-N 3.34Å; D271-L273 WeakPolarHBondContact OD1-CA 3.24Å; D271-L273 WeakPolarHBondContact OD1-CB 3.47Å; D271-L273 PolarHBondContact OD1-N 3.47Å; D271-G274 PolarHBondContact OD1-N 3.38Å; D271-T278 VanDerWaalsContact OD2-CA 3.24Å; D271-T278 WeakPolarHBondContact OD2-CA 3.25Å; D271-T278 WeakPolarHBondContact OD2-CB 3.48Å; D271-T278 PolarHBondContact OD2-N 3.02Å; D271-T278 PolarHBondContact OD2-OG1 2.92Å; D271-L291 HydrophobicContact CB-CD2 4.48Å; D271-I292 PolarHBondContact N-O 3.04Å; D271-V293 WeakPolarHBondContact O-CA 3.3Å; D271-F294 WeakPolarHBondContact O-CD1 3.21Å; D271-F294 PolarHBondContact O-N 3.43Å
272	P	96	Very high	95.7	Very high	12 Å²	12	31.2 Å²	31.2	8%	0.078	17%	0.168	C	C	.	.	S	Bend	trans	-85.8	-4.5	168.5	32.7	-29.3	0	0	0	113.2	H204 M205 L270 F294 G295 A296 A297	H204-P272 VanDerWaalsContact CB-CD 3.47Å; H204-P272 HydrophobicContact CB-CG 3.91Å; M205-P272 HydrophobicContact CB-CG 4.38Å; M205-P272 HydrophobicContact CG-CG 4.16Å; M205-P272 HydrophobicContact SD-CB 4.38Å; M205-P272 HydrophobicContact SD-CG 3.99Å; L270-P272 VanDerWaalsContact O-CD 3.31Å; L270-P272 WeakPolarHBondContact O-CD 3.32Å; P272-F294 HydrophobicContact CB-CD2 4.48Å; P272-F294 HydrophobicContact CB-CE1 3.87Å; P272-F294 HydrophobicContact CB-CE2 3.8Å; P272-F294 HydrophobicContact CB-CZ 3.47Å; P272-F294 VanDerWaalsContact CB-CZ 3.47Å; P272-F294 HydrophobicContact CG-CE1 4.13Å; P272-F294 HydrophobicContact CG-CZ 3.86Å; P272-G295 CarbonylContact C-O 3.56Å; P272-G295 CarbonylContact O-C 3.5Å; P272-G295 WeakPolarHBondContact O-CA 3.2Å; P272-A296 PolarHBondContact O-N 2.61Å; P272-A297 VanDerWaalsContact O-CB 3.25Å; P272-A297 WeakPolarHBondContact O-CB 2.97Å; P272-A297 PolarHBondContact O-N 2.65Å
273	L	92.6	Very high	95.6	Very high	14 Å²	14	31.9 Å²	31.9	7%	0.073	18%	0.178	C	C	.	.	S	Bend	trans	-90.9	-52.4	-165.2	-57.1	178.4	0	0	0	111.5	H204 M205 D271 D277 A296 A297 N298	H204-L273 HydrophobicContact CB-CD1 4.18Å; H204-L273 HydrophobicContact CB-CG 4.3Å; M205-L273 HydrophobicContact CG-CD2 4.04Å; M205-L273 HydrophobicContact SD-CD2 3.84Å; D271-L273 VanDerWaalsContact C-N 3.34Å; D271-L273 WeakPolarHBondContact OD1-CA 3.24Å; D271-L273 WeakPolarHBondContact OD1-CB 3.47Å; D271-L273 PolarHBondContact OD1-N 3.47Å; L273-D277 HydrophobicContact CB-CB 3.99Å; L273-D277 HydrophobicContact CD1-CB 3.94Å; L273-A296 CarbonylContact O-C 3.56Å; L273-A296 WeakPolarHBondContact O-CA 3.31Å; L273-A297 HydrophobicContact CD2-CB 4.29Å; L273-A297 PolarHBondContact O-N 3.44Å; L273-N298 WeakPolarHBondContact O-CB 3.3Å; L273-N298 PolarHBondContact O-N 2.85Å
274	G	88.3	Confident	95.6	Very high	6 Å²	6	27.4 Å²	27.4	6%	0.062	15%	0.149	C	C	.	.			trans	79.6	172.9	-176.7	0	0	0	0	0	114.6	D271 T278 N298	D271-G274 PolarHBondContact OD1-N 3.38Å; G274-T278 WeakPolarHBondContact CA-OG1 3.23Å; G274-N298 PolarHBondContact O-ND2 2.86Å
275	G	86.9	Confident	95.6	Very high	8 Å²	8	19.4 Å²	19.4	8%	0.082	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	-129.6	177.9	0	0	0	0	0	112.7	D277 T278 N316	G275-D277 PolarHBondContact O-N 2.86Å; G275-T278 PolarHBondContact N-OG1 3.07Å; G275-T278 VanDerWaalsContact O-CB 3.3Å; G275-T278 WeakPolarHBondContact O-CB 3.33Å; G275-T278 PolarHBondContact O-N 2.89Å; G275-T278 VanDerWaalsContact O-N 3.1Å; G275-T278 PolarHBondContact O-OG1 3.07Å; G275-N316 CarbonylContact C-O 3.59Å
276	A	88.9	Confident	95.6	Very high	44 Å²	44	21.5 Å²	21.5	36%	0.364	12%	0.123	S	C	.	.	H	α-helix	trans	-62.3	-28.9	-176.5	0	0	0	0	0	113.4	T278 Q279 K280 N316	A276-T278 VanDerWaalsContact C-N 3.32Å; A276-Q279 PolarHBondContact O-N 2.82Å; A276-K280 PolarHBondContact O-N 2.88Å; A276-K280 VanDerWaalsContact O-N 3.08Å; A276-N316 HydrophobicContact CB-CB 4.22Å; A276-N316 PolarHBondContact N-O 2.79Å
277	D	93.6	Very high	95.5	Very high	27 Å²	27	26 Å²	26	14%	0.144	15%	0.152	C	C	.	.	H	α-helix	trans	-68	-32.6	177	-72.1	-58.3	0	0	0	111.9	Y254 L273 G275 Q279 K280 G281 N298	Y254-D277 WeakPolarHBondContact CE1-OD1 3.42Å; Y254-D277 PolarHBondContact OH-OD1 2.68Å; L273-D277 HydrophobicContact CB-CB 3.99Å; L273-D277 HydrophobicContact CD1-CB 3.94Å; G275-D277 PolarHBondContact O-N 2.86Å; D277-Q279 VanDerWaalsContact C-N 3.31Å; D277-Q279 PolarHBondContact O-N 3.06Å; D277-K280 PolarHBondContact O-N 2.6Å; D277-G281 PolarHBondContact O-N 3.46Å; D277-N298 PolarHBondContact OD2-ND2 3.01Å
278	T	94.1	Very high	95.5	Very high	12 Å²	12	31.7 Å²	31.7	7%	0.074	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-42.4	172.7	-50.8	0	0	0	0	111.1	D271 G274 G275 A276 F282 L291 V293 L318 I332	D271-T278 VanDerWaalsContact OD2-CA 3.24Å; D271-T278 WeakPolarHBondContact OD2-CA 3.25Å; D271-T278 WeakPolarHBondContact OD2-CB 3.48Å; D271-T278 PolarHBondContact OD2-N 3.02Å; D271-T278 PolarHBondContact OD2-OG1 2.92Å; G274-T278 WeakPolarHBondContact CA-OG1 3.23Å; G275-T278 PolarHBondContact N-OG1 3.07Å; G275-T278 VanDerWaalsContact O-CB 3.3Å; G275-T278 WeakPolarHBondContact O-CB 3.33Å; G275-T278 PolarHBondContact O-N 2.89Å; G275-T278 VanDerWaalsContact O-N 3.1Å; G275-T278 PolarHBondContact O-OG1 3.07Å; A276-T278 VanDerWaalsContact C-N 3.32Å; T278-F282 WeakPolarHBondContact O-CB 3.35Å; T278-F282 PolarHBondContact O-N 3.47Å; T278-L291 HydrophobicContact CG2-CD1 4.5Å; T278-L291 HydrophobicContact CG2-CD2 3.87Å; T278-L291 WeakPolarHBondContact O-CD1 3.1Å; T278-V293 HydrophobicContact CG2-CG2 3.66Å; T278-L318 HydrophobicContact CG2-CB 4.04Å; T278-L318 HydrophobicContact CG2-CD2 3.95Å; T278-I332 HydrophobicContact CG2-CD1 4.17Å
279	Q	93.8	Very high	95.4	Very high	112 Å²	112	31.7 Å²	31.7	52%	0.523	18%	0.182	S	C	.	.	H	α-helix	trans	-66.4	-43.8	176.8	178.7	171.7	-3.3	0	0	112.2	A276 D277 F282 G283 L318	A276-Q279 PolarHBondContact O-N 2.82Å; D277-Q279 VanDerWaalsContact C-N 3.31Å; D277-Q279 PolarHBondContact O-N 3.06Å; Q279-F282 PolarHBondContact O-N 3.45Å; Q279-G283 PolarHBondContact O-N 3.32Å; Q279-L318 HydrophobicContact CB-CB 4.33Å; Q279-L318 HydrophobicContact CB-CD1 4.11Å; Q279-L318 HydrophobicContact CG-CD1 4.1Å
280	K	95.8	Very high	95.4	Very high	90 Å²	90	33.6 Å²	33.6	39%	0.391	19%	0.192	S	C	.	.	H	α-helix	trans	-61.1	-46.5	175.7	-73.6	-179.8	176.3	-167.5	0	111.6	D253 Y254 V255 A276 D277 F282 G283 L284	D253-K280 IonicContact OD1-NZ 3.69Å; Y254-K280 HydrophobicContact CE1-CD 4.27Å; Y254-K280 HydrophobicContact CE2-CB 4.28Å; Y254-K280 WeakPolarHBondContact OH-CB 3.46Å; Y254-K280 VanDerWaalsContact OH-CD 3.22Å; Y254-K280 WeakPolarHBondContact OH-CD 3.39Å; V255-K280 HydrophobicContact CG2-CB 3.95Å; V255-K280 HydrophobicContact CG2-CD 4.17Å; V255-K280 HydrophobicContact CG2-CG 4.22Å; A276-K280 PolarHBondContact O-N 2.88Å; A276-K280 VanDerWaalsContact O-N 3.08Å; D277-K280 PolarHBondContact O-N 2.6Å; K280-F282 PolarHBondContact O-N 3.25Å; K280-G283 PolarHBondContact O-N 2.92Å; K280-L284 PolarHBondContact O-N 3.38Å
281	G	97.2	Very high	95.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.4	-45.5	176.3	0	0	0	0	0	112.2	D277 G283 L284 L285 L291	D277-G281 PolarHBondContact O-N 3.46Å; G281-G283 VanDerWaalsContact C-N 3.31Å; G281-G283 PolarHBondContact O-N 2.72Å; G281-L284 WeakPolarHBondContact O-CA 3.34Å; G281-L284 WeakPolarHBondContact O-CB 3.25Å; G281-L284 PolarHBondContact O-N 3.48Å; G281-L285 PolarHBondContact O-N 3.28Å; G281-L291 VanDerWaalsContact C-CD1 3.41Å
282	F	97.3	Very high	95.4	Very high	10 Å²	10	33.5 Å²	33.5	4%	0.044	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-39.1	176.9	-174.7	-92.2	0	0	0	112	T278 Q279 K280 L284 L285 L291 L318 L320 L325 K330	T278-F282 WeakPolarHBondContact O-CB 3.35Å; T278-F282 PolarHBondContact O-N 3.47Å; Q279-F282 PolarHBondContact O-N 3.45Å; K280-F282 PolarHBondContact O-N 3.25Å; F282-L284 PolarHBondContact O-N 3.05Å; F282-L285 HydrophobicContact CD2-CD1 4.01Å; F282-L285 HydrophobicContact CE2-CD1 4.42Å; F282-L285 PolarHBondContact O-N 2.84Å; F282-L291 HydrophobicContact CB-CD1 4.34Å; F282-L291 VanDerWaalsContact N-CD1 3.26Å; F282-L318 HydrophobicContact CB-CD2 3.66Å; F282-L318 HydrophobicContact CD2-CD2 4.27Å; F282-L318 HydrophobicContact CG-CD2 3.93Å; F282-L320 HydrophobicContact CD1-CD2 4.28Å; F282-L320 HydrophobicContact CD2-CD1 4.35Å; F282-L320 HydrophobicContact CE1-CD2 3.89Å; F282-L320 HydrophobicContact CE2-CD1 4.21Å; F282-L320 HydrophobicContact CE2-CD2 4.24Å; F282-L320 HydrophobicContact CZ-CD2 3.87Å; F282-L325 HydrophobicContact CE2-CD2 3.73Å; F282-L325 HydrophobicContact CZ-CD2 3.78Å; F282-K330 HydrophobicContact CD1-CD 4.5Å; F282-K330 HydrophobicContact CE1-CD 3.97Å; F282-K330 HydrophobicContact CE2-CB 3.71Å; F282-K330 HydrophobicContact CE2-CD 4.23Å; F282-K330 HydrophobicContact CZ-CB 3.72Å; F282-K330 HydrophobicContact CZ-CD 3.81Å; F282-K330 HydrophobicContact CZ-CG 4.41Å; F282-K330 PolarHBondContact O-NZ 3.3Å
283	G	96.6	Very high	95.5	Very high	35 Å²	35	34.9 Å²	34.9	36%	0.361	20%	0.199	S	C	.	.	H	α-helix	trans	-65.1	-22.6	173.5	0	0	0	0	0	114.3	R259 Q279 K280 G281	R259-G283 PolarHBondContact NH2-O 2.81Å; R259-G283 VanDerWaalsContact NH2-O 3.15Å; Q279-G283 PolarHBondContact O-N 3.32Å; K280-G283 PolarHBondContact O-N 2.92Å; G281-G283 VanDerWaalsContact C-N 3.31Å; G281-G283 PolarHBondContact O-N 2.72Å
284	L	98.1	Very high	95.6	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-8.8	177	-87.7	165.9	0	0	0	114.1	L202 Y254 V255 V258 R259 G265 V266 K280 G281 F282	L202-L284 HydrophobicContact CD2-CD1 3.93Å; Y254-L284 HydrophobicContact CD2-CD1 4Å; Y254-L284 HydrophobicContact CE2-CD1 3.82Å; V255-L284 HydrophobicContact CB-CD1 4.23Å; V255-L284 HydrophobicContact CB-CD2 4.45Å; V255-L284 HydrophobicContact CB-CG 4.39Å; V255-L284 HydrophobicContact CG1-CD1 4.38Å; V255-L284 HydrophobicContact CG1-CD2 3.93Å; V255-L284 HydrophobicContact CG1-CG 3.99Å; V255-L284 HydrophobicContact CG2-CD1 3.74Å; V255-L284 HydrophobicContact CG2-CG 4.17Å; V258-L284 HydrophobicContact CB-CD2 4.03Å; V258-L284 HydrophobicContact CG1-CD2 3.82Å; R259-L284 HydrophobicContact CG-CD2 4.26Å; G265-L284 CarbonylContact C-O 3.59Å; G265-L284 WeakPolarHBondContact CA-O 3.38Å; V266-L284 PolarHBondContact N-O 3.23Å; K280-L284 PolarHBondContact O-N 3.38Å; G281-L284 WeakPolarHBondContact O-CA 3.34Å; G281-L284 WeakPolarHBondContact O-CB 3.25Å; G281-L284 PolarHBondContact O-N 3.48Å; F282-L284 PolarHBondContact O-N 3.05Å
285	L	98.7	Very high	95.7	Very high	6 Å²	6	37 Å²	37	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	138.9	179.2	-65	173.8	0	0	0	112	V266 V269 G281 F282 M290 L291 K330	V266-L285 CarbonylContact O-C 3.55Å; V266-L285 WeakPolarHBondContact O-CA 3.37Å; V269-L285 HydrophobicContact CB-CD2 4.34Å; V269-L285 HydrophobicContact CG2-CD2 3.72Å; G281-L285 PolarHBondContact O-N 3.28Å; F282-L285 HydrophobicContact CD2-CD1 4.01Å; F282-L285 HydrophobicContact CE2-CD1 4.42Å; F282-L285 PolarHBondContact O-N 2.84Å; L285-M290 WeakPolarHBondContact CD2-O 3.25Å; L285-L291 HydrophobicContact CD1-CB 3.95Å; L285-L291 HydrophobicContact CD2-CB 4.49Å; L285-K330 HydrophobicContact CB-CD 3.86Å; L285-K330 HydrophobicContact CB-CG 4.08Å; L285-K330 HydrophobicContact CD1-CB 4.22Å; L285-K330 HydrophobicContact CD1-CD 4.3Å; L285-K330 HydrophobicContact CD1-CG 4.32Å; L285-K330 WeakPolarHBondContact O-CE 3.48Å; L285-K330 PolarHBondContact O-NZ 2.8Å
286	K	98.4	Very high	95.6	Very high	44 Å²	44	38.1 Å²	38.1	19%	0.191	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	165.8	159.6	-69.1	174.7	-169	172	0	110.3	S200 K264 G265 V266 D267 G289	S200-K286 PolarHBondContact OG-NZ 3.41Å; K264-K286 HydrophobicContact CB-CG 4.28Å; K264-K286 WeakPolarHBondContact O-CG 3.27Å; G265-K286 WeakPolarHBondContact O-CE 3.26Å; V266-K286 PolarHBondContact O-N 3.1Å; D267-K286 WeakPolarHBondContact OD1-CD 3.39Å; D267-K286 IonicContact OD1-NZ 2.86Å; D267-K286 IonicContact OD2-NZ 2.69Å; D267-K286 PolarHBondContact OD2-NZ 3.24Å; K286-G289 PolarHBondContact O-N 3.06Å
287	P	96.9	Very high	95.4	Very high	94 Å²	94	36.1 Å²	36.1	61%	0.61	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-52.9	141.7	163.1	-24.2	34.9	0	0	0	111.1	G289	P287-G289 PolarHBondContact O-N 3.28Å
288	L	97.1	Very high	94.9	Very high	148 Å²	148	37 Å²	37	78%	0.775	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	62.2	10.5	-172.6	-49.4	178.9	0	0	0	114.8	N329	L288-N329 VanDerWaalsContact CA-O 3.31Å; L288-N329 WeakPolarHBondContact CA-O 3.13Å; L288-N329 HydrophobicContact CD2-CB 4.39Å; L288-N329 PolarHBondContact N-O 2.9Å
289	G	98.3	Very high	94.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	156.7	176.4	0	0	0	0	0	112.9	D267 K286 P287 A331	D267-G289 CarbonylContact O-C 3.45Å; D267-G289 WeakPolarHBondContact O-CA 3.42Å; K286-G289 PolarHBondContact O-N 3.06Å; P287-G289 PolarHBondContact O-N 3.28Å; G289-A331 PolarHBondContact O-N 3.22Å
290	M	98.5	Very high	93.3	Very high	41 Å²	41	32.4 Å²	32.4	20%	0.202	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.9	178.9	-174.3	177	-71	0	0	111.8	M192 A193 D267 I268 V269 L285 I292 A331	M192-M290 HydrophobicContact CB-SD 4.2Å; M192-M290 VanDerWaalsContact O-CE 3.32Å; M192-M290 WeakPolarHBondContact O-CE 3.42Å; A193-M290 HydrophobicContact CB-SD 4.29Å; D267-M290 PolarHBondContact O-N 3.37Å; I268-M290 WeakPolarHBondContact CA-O 3.35Å; V269-M290 PolarHBondContact N-O 3.1Å; L285-M290 WeakPolarHBondContact CD2-O 3.25Å; M290-I292 HydrophobicContact CG-CG1 3.93Å; M290-I292 HydrophobicContact SD-CD1 4Å; M290-I292 HydrophobicContact SD-CG1 3.89Å; M290-A331 WeakPolarHBondContact CA-O 3.28Å; M290-A331 HydrophobicContact CB-CB 4.27Å; M290-A331 HydrophobicContact CE-CB 3.94Å; M290-A331 HydrophobicContact CG-CB 4.13Å
291	L	98.4	Very high	92.2	Very high	0 Å²	0	32 Å²	32	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132	165	-179.8	147.4	0	0	0	109.5	V269 D271 T278 G281 F282 L285 V293 A331 I332 S333	V269-L291 HydrophobicContact CB-CB 4.29Å; V269-L291 HydrophobicContact CB-CD1 4.16Å; V269-L291 HydrophobicContact CB-CG 4.14Å; V269-L291 HydrophobicContact CG1-CD1 3.96Å; V269-L291 HydrophobicContact CG1-CG 4.23Å; V269-L291 WeakPolarHBondContact O-CA 3.21Å; D271-L291 HydrophobicContact CB-CD2 4.48Å; T278-L291 HydrophobicContact CG2-CD1 4.5Å; T278-L291 HydrophobicContact CG2-CD2 3.87Å; T278-L291 WeakPolarHBondContact O-CD1 3.1Å; G281-L291 VanDerWaalsContact C-CD1 3.41Å; F282-L291 HydrophobicContact CB-CD1 4.34Å; F282-L291 VanDerWaalsContact N-CD1 3.26Å; L285-L291 HydrophobicContact CD1-CB 3.95Å; L285-L291 HydrophobicContact CD2-CB 4.49Å; L291-V293 HydrophobicContact CD2-CG2 3.43Å; L291-V293 VanDerWaalsContact CD2-CG2 3.43Å; L291-A331 PolarHBondContact N-O 3.34Å; L291-I332 HydrophobicContact CD2-CD1 3.85Å; L291-I332 HydrophobicContact CD2-CG1 3.84Å; L291-I332 CarbonylContact O-C 3.38Å; L291-I332 WeakPolarHBondContact O-CA 3.21Å; L291-S333 PolarHBondContact O-N 2.76Å
292	I	98.6	Very high	90.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	113.6	176.7	-55	174.3	0	0	0	109.2	M188 M192 A193 V269 L270 D271 M290 S333 F335	M188-I292 HydrophobicContact CB-CD1 3.86Å; M188-I292 HydrophobicContact CG-CD1 4.33Å; M188-I292 HydrophobicContact CG-CG2 3.87Å; M188-I292 WeakPolarHBondContact O-CD1 3.35Å; M188-I292 HydrophobicContact SD-CB 4.4Å; M188-I292 HydrophobicContact SD-CG2 3.79Å; M192-I292 HydrophobicContact CB-CD1 3.78Å; M192-I292 HydrophobicContact SD-CD1 4.36Å; M192-I292 HydrophobicContact SD-CG2 4.31Å; A193-I292 HydrophobicContact CB-CD1 3.9Å; V269-I292 PolarHBondContact O-N 3.1Å; L270-I292 HydrophobicContact CD2-CB 4.42Å; L270-I292 HydrophobicContact CD2-CD1 4.33Å; D271-I292 PolarHBondContact N-O 3.04Å; M290-I292 HydrophobicContact CG-CG1 3.93Å; M290-I292 HydrophobicContact SD-CD1 4Å; M290-I292 HydrophobicContact SD-CG1 3.89Å; I292-S333 WeakPolarHBondContact CA-O 3.29Å; I292-F335 HydrophobicContact CG2-CB 3.7Å
293	V	96.9	Very high	89.5	Confident	41 Å²	41	35.9 Å²	35.9	25%	0.248	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122.1	172.3	-173.8	0	0	0	0	108.6	D271 T278 L291 S333 G334 F335	D271-V293 WeakPolarHBondContact O-CA 3.3Å; T278-V293 HydrophobicContact CG2-CG2 3.66Å; L291-V293 HydrophobicContact CD2-CG2 3.43Å; L291-V293 VanDerWaalsContact CD2-CG2 3.43Å; V293-S333 PolarHBondContact N-O 3.38Å; V293-G334 CarbonylContact O-C 3.5Å; V293-G334 WeakPolarHBondContact O-CA 3.44Å; V293-F335 PolarHBondContact O-N 3.41Å
294	F	96.1	Very high	88.3	Confident	37 Å²	37	41.2 Å²	41.2	16%	0.162	23%	0.233	C	C	.	.			trans	-132.9	6.8	-179.1	73.2	-83.2	0	0	0	114.8	T184 M188 V210 L270 D271 P272 F335	T184-F294 HydrophobicContact CG2-CD2 3.96Å; T184-F294 HydrophobicContact CG2-CE2 4.42Å; M188-F294 HydrophobicContact CE-CD1 3.87Å; M188-F294 HydrophobicContact CE-CD2 4.2Å; M188-F294 HydrophobicContact CE-CE1 3.95Å; M188-F294 HydrophobicContact CE-CE2 4.28Å; M188-F294 HydrophobicContact CE-CG 3.99Å; M188-F294 HydrophobicContact CE-CZ 4.14Å; M188-F294 HydrophobicContact SD-CB 3.6Å; M188-F294 VanDerWaalsContact SD-CB 3.6Å; M188-F294 HydrophobicContact SD-CD1 3.39Å; M188-F294 WeakPolarHBondContact SD-CD1 3.12Å; M188-F294 HydrophobicContact SD-CD2 4.21Å; M188-F294 HydrophobicContact SD-CE1 4.06Å; M188-F294 HydrophobicContact SD-CG 3.46Å; M188-F294 WeakPolarHBondContact SD-CG 3.4Å; V210-F294 HydrophobicContact CB-CE2 4.17Å; V210-F294 HydrophobicContact CG1-CE2 3.69Å; V210-F294 HydrophobicContact CG1-CZ 3.88Å; V210-F294 HydrophobicContact CG2-CE2 4.28Å; L270-F294 HydrophobicContact CB-CE1 3.9Å; D271-F294 WeakPolarHBondContact O-CD1 3.21Å; D271-F294 PolarHBondContact O-N 3.43Å; P272-F294 HydrophobicContact CB-CD2 4.48Å; P272-F294 HydrophobicContact CB-CE1 3.87Å; P272-F294 HydrophobicContact CB-CE2 3.8Å; P272-F294 HydrophobicContact CB-CZ 3.47Å; P272-F294 VanDerWaalsContact CB-CZ 3.47Å; P272-F294 HydrophobicContact CG-CE1 4.13Å; P272-F294 HydrophobicContact CG-CZ 3.86Å; F294-F335 WeakPolarHBondContact CA-O 3.49Å; F294-F335 HydrophobicContact CB-CB 4.22Å; F294-F335 HydrophobicContact CB-CD1 4.29Å; F294-F335 VanDerWaalsContact CB-O 3.29Å; F294-F335 WeakPolarHBondContact CB-O 3.39Å
295	G	89.6	Confident	87.1	Confident	27 Å²	27	46.1 Å²	46.1	28%	0.278	26%	0.255	S	S	.	.			trans	-161.3	172.4	177.3	0	0	0	0	0	112.4	P272	P272-G295 CarbonylContact C-O 3.56Å; P272-G295 CarbonylContact O-C 3.5Å; P272-G295 WeakPolarHBondContact O-CA 3.2Å
296	A	85.4	Confident	86	Confident	33 Å²	33	48.6 Å²	48.6	27%	0.273	27%	0.268	S	S	.	.			trans	-133	49.8	176.7	0	0	0	0	0	110	P272 L273 N298 C299	P272-A296 PolarHBondContact O-N 2.61Å; L273-A296 CarbonylContact O-C 3.56Å; L273-A296 WeakPolarHBondContact O-CA 3.31Å; A296-N298 PolarHBondContact O-N 3.01Å; A296-N298 VanDerWaalsContact O-N 3.11Å; A296-C299 HydrophobicContact CB-CB 4.38Å; A296-C299 VanDerWaalsContact O-CB 3.31Å; A296-C299 WeakPolarHBondContact O-CB 3.14Å; A296-C299 PolarHBondContact O-N 3.43Å
297	A	83.8	Confident	85	Confident	2 Å²	2	52.4 Å²	52.4	2%	0.017	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-60.7	-23	-174.8	0	0	0	0	0	113.6	F99 M205 P272 L273 C299 V300 R385	F99-A297 HydrophobicContact CE1-CB 3.94Å; F99-A297 HydrophobicContact CE2-CB 4.19Å; F99-A297 HydrophobicContact CZ-CB 3.62Å; M205-A297 HydrophobicContact SD-CB 4.08Å; P272-A297 VanDerWaalsContact O-CB 3.25Å; P272-A297 WeakPolarHBondContact O-CB 2.97Å; P272-A297 PolarHBondContact O-N 2.65Å; L273-A297 HydrophobicContact CD2-CB 4.29Å; L273-A297 PolarHBondContact O-N 3.44Å; A297-C299 VanDerWaalsContact C-N 3.28Å; A297-C299 PolarHBondContact O-N 2.95Å; A297-V300 PolarHBondContact O-N 3.46Å; A297-R385 PolarHBondContact O-NH2 3.4Å
298	N	83.8	Confident	83.8	Confident	46 Å²	46	54.5 Å²	54.5	25%	0.246	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-71.8	-18.1	173.9	-72.3	-18.9	0	0	0	113.4	L273 G274 D277 A296 V300 T301	L273-N298 WeakPolarHBondContact O-CB 3.3Å; L273-N298 PolarHBondContact O-N 2.85Å; G274-N298 PolarHBondContact O-ND2 2.86Å; D277-N298 PolarHBondContact OD2-ND2 3.01Å; A296-N298 PolarHBondContact O-N 3.01Å; A296-N298 VanDerWaalsContact O-N 3.11Å; N298-V300 VanDerWaalsContact C-N 3.3Å; N298-T301 WeakPolarHBondContact O-CG2 3.33Å
299	C	77.6	Confident	82.5	Confident	16 Å²	16	48 Å²	48	11%	0.108	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-74.7	-20.6	173.7	-69.2	0	0	0	0	112.8	A296 A297	A296-C299 HydrophobicContact CB-CB 4.38Å; A296-C299 VanDerWaalsContact O-CB 3.31Å; A296-C299 WeakPolarHBondContact O-CB 3.14Å; A296-C299 PolarHBondContact O-N 3.43Å; A297-C299 VanDerWaalsContact C-N 3.28Å; A297-C299 PolarHBondContact O-N 2.95Å
300	V	75.6	Confident	81.3	Confident	10 Å²	10	51 Å²	51	6%	0.061	28%	0.278	C	S	.	.			trans	-99.9	91.1	-178.1	179.6	0	0	0	0	108.8	F99 L103 A297 N298 H383	F99-V300 HydrophobicContact CE1-CB 4.05Å; F99-V300 HydrophobicContact CE1-CG2 3.64Å; F99-V300 HydrophobicContact CZ-CB 3.74Å; F99-V300 HydrophobicContact CZ-CG1 4.16Å; F99-V300 HydrophobicContact CZ-CG2 3.88Å; L103-V300 HydrophobicContact CD2-CG2 3.39Å; L103-V300 HydrophobicContact CG-CG2 4.15Å; A297-V300 PolarHBondContact O-N 3.46Å; N298-V300 VanDerWaalsContact C-N 3.3Å; V300-H383 VanDerWaalsContact CG1-CE1 3.42Å; V300-H383 WeakPolarHBondContact CG1-CE1 3.45Å; V300-H383 WeakPolarHBondContact CG1-ND1 3.38Å
301	T	72.8	Confident	80.1	Confident	83 Å²	83	51.7 Å²	51.7	51%	0.509	29%	0.29	S	S	.	.			trans	-110.2	-5.1	-177.5	53.1	0	0	0	0	113.9	N298 N306 A309	N298-T301 WeakPolarHBondContact O-CG2 3.33Å; T301-N306 PolarHBondContact OG1-ND2 3.18Å; T301-A309 HydrophobicContact CG2-CB 4.05Å
302	G	70.1	Confident	78.8	Confident	23 Å²	23	58.5 Å²	58.5	24%	0.237	32%	0.32	C	S	.	.	S	Bend	trans	-167.1	-174.1	179.1	0	0	0	0	0	112.1	Q106 K304 H383	Q106-G302 PolarHBondContact NE2-O 3.29Å; G302-K304 VanDerWaalsContact C-N 3.3Å; G302-K304 PolarHBondContact O-N 2.87Å; G302-H383 VanDerWaalsContact CA-NE2 3.35Å; G302-H383 WeakPolarHBondContact CA-NE2 3.33Å; G302-H383 PolarHBondContact O-CE1 3.38Å
303	Q	67.3	Low	77.5	Confident	68 Å²	68	59.7 Å²	59.7	32%	0.318	33%	0.327	S	S	.	.	S	Bend	trans	-71.4	-20.9	-173	-70.8	-61.7	-29.5	0	0	114.7	G66 G67 K105	G66-Q303 CarbonylContact C-O 3.57Å; G66-Q303 VanDerWaalsContact O-O 3.06Å; G67-Q303 WeakPolarHBondContact CA-O 3.46Å; K105-Q303 PolarHBondContact NZ-O 3.21Å
304	K	72.4	Confident	76.4	Confident	146 Å²	146	66.9 Å²	66.9	64%	0.635	35%	0.35	S	S	*	.	S	Bend	trans	-120.6	162	-178.5	-63.2	-179.1	-178.7	178	0	110.5	Q106 G302 N306	Q106-K304 PolarHBondContact OE1-O 3.28Å; G302-K304 VanDerWaalsContact C-N 3.3Å; G302-K304 PolarHBondContact O-N 2.87Å; K304-N306 PolarHBondContact O-N 3.22Å
305	K	73.1	Confident	75.2	Confident	103 Å²	103	74.2 Å²	74.2	45%	0.448	38%	0.378	S	S	.	.			trans	-52.1	122.8	174	-176.1	170	179.5	169.5	0	110.3	Q106 L108 L307 M310	Q106-K305 HydrophobicContact CB-CB 4.48Å; L108-K305 HydrophobicContact CD2-CD 3.91Å; L108-K305 HydrophobicContact CD2-CG 4.09Å; K305-L307 HydrophobicContact CD-CD2 4.44Å; K305-M310 HydrophobicContact CD-SD 4.44Å; K305-M310 VanDerWaalsContact CE-SD 3.56Å; K305-M310 HydrophobicContact CG-SD 4.14Å
306	N	75.1	Confident	74.5	Confident	59 Å²	59	75.6 Å²	75.6	32%	0.316	38%	0.379	S	S	.	.			trans	-109.1	95.9	178.3	-174.3	-19	0	0	0	109.8	T301 K304 L308 A309 M310	T301-N306 PolarHBondContact OG1-ND2 3.18Å; K304-N306 PolarHBondContact O-N 3.22Å; N306-L308 PolarHBondContact O-N 3.34Å; N306-L308 WeakPolarHBondContact OD1-CB 3.5Å; N306-L308 PolarHBondContact OD1-N 3.35Å; N306-L308 VanDerWaalsContact OD1-N 3.15Å; N306-A309 HydrophobicContact CB-CB 3.86Å; N306-A309 PolarHBondContact O-N 3.48Å; N306-A309 VanDerWaalsContact O-N 3.17Å; N306-A309 PolarHBondContact OD1-N 2.87Å; N306-M310 WeakPolarHBondContact O-CG 3.5Å; N306-M310 PolarHBondContact O-N 2.93Å
307	L	76.6	Confident	74.1	Confident	124 Å²	124	79.4 Å²	79.4	65%	0.649	39%	0.391	S	S	*	.	H	α-helix	trans	-59.8	-33.5	-179	-67.7	171.7	0	0	0	112.6	K305 M310 A311	K305-L307 HydrophobicContact CD-CD2 4.44Å; L307-M310 PolarHBondContact O-N 3.41Å; L307-A311 WeakPolarHBondContact O-CB 3.05Å; L307-A311 PolarHBondContact O-N 2.85Å
308	L	72.1	Confident	74	Confident	137 Å²	137	80.4 Å²	80.4	72%	0.717	40%	0.396	S	S	*	.	H	α-helix	trans	-68.6	-42.7	177.2	-175.4	68.4	0	0	0	111.3	N306 M310 A311 K312	N306-L308 PolarHBondContact O-N 3.34Å; N306-L308 WeakPolarHBondContact OD1-CB 3.5Å; N306-L308 PolarHBondContact OD1-N 3.35Å; N306-L308 VanDerWaalsContact OD1-N 3.15Å; L308-M310 VanDerWaalsContact C-N 3.3Å; L308-M310 PolarHBondContact O-N 3.32Å; L308-A311 PolarHBondContact O-N 3.46Å; L308-K312 VanDerWaalsContact O-CB 3.26Å; L308-K312 WeakPolarHBondContact O-CB 3.36Å; L308-K312 PolarHBondContact O-N 2.68Å
309	A	69.4	Low	74	Confident	13 Å²	13	84 Å²	84	11%	0.107	42%	0.42	C	S	.	.	H	α-helix	trans	-62.6	-38.9	175	0	0	0	0	0	111.5	T301 N306 T313	T301-A309 HydrophobicContact CG2-CB 4.05Å; N306-A309 HydrophobicContact CB-CB 3.86Å; N306-A309 PolarHBondContact O-N 3.48Å; N306-A309 VanDerWaalsContact O-N 3.17Å; N306-A309 PolarHBondContact OD1-N 2.87Å; A309-T313 WeakPolarHBondContact O-CB 3.29Å; A309-T313 PolarHBondContact O-N 3.15Å; A309-T313 PolarHBondContact O-OG1 2.69Å
310	M	73.4	Confident	74.4	Confident	62 Å²	62	85.6 Å²	85.6	31%	0.305	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-49.7	174.5	-67.6	-177.7	70.9	0	0	112.1	L108 K305 N306 L307 L308 K312 T313 W314	L108-M310 HydrophobicContact CD1-SD 4.36Å; L108-M310 HydrophobicContact CD2-CE 3.66Å; L108-M310 HydrophobicContact CD2-SD 3.48Å; L108-M310 WeakPolarHBondContact CD2-SD 3.29Å; K305-M310 HydrophobicContact CD-SD 4.44Å; K305-M310 VanDerWaalsContact CE-SD 3.56Å; K305-M310 HydrophobicContact CG-SD 4.14Å; N306-M310 WeakPolarHBondContact O-CG 3.5Å; N306-M310 PolarHBondContact O-N 2.93Å; L307-M310 PolarHBondContact O-N 3.41Å; L308-M310 VanDerWaalsContact C-N 3.3Å; L308-M310 PolarHBondContact O-N 3.32Å; M310-K312 VanDerWaalsContact C-N 3.3Å; M310-K312 PolarHBondContact O-N 3.36Å; M310-T313 PolarHBondContact O-N 3.41Å; M310-T313 VanDerWaalsContact O-N 3.13Å; M310-W314 PolarHBondContact O-N 2.92Å
311	A	73.6	Confident	75	Confident	56 Å²	56	89.6 Å²	89.6	46%	0.463	45%	0.448	S	S	.	.	H	α-helix	trans	-59.7	-41.5	177.8	0	0	0	0	0	111.5	L307 L308 W314 Y315	L307-A311 WeakPolarHBondContact O-CB 3.05Å; L307-A311 PolarHBondContact O-N 2.85Å; L308-A311 PolarHBondContact O-N 3.46Å; A311-W314 PolarHBondContact O-N 2.94Å; A311-Y315 WeakPolarHBondContact O-CB 3.38Å; A311-Y315 PolarHBondContact O-N 3.42Å
312	K	71.6	Confident	75.9	Confident	142 Å²	142	91.1 Å²	91.1	62%	0.617	46%	0.457	S	S	*	.	H	α-helix	trans	-63.7	-40.4	174.7	-175.3	178.1	179.9	-179.2	0	112.3	L308 M310 N316	L308-K312 VanDerWaalsContact O-CB 3.26Å; L308-K312 WeakPolarHBondContact O-CB 3.36Å; L308-K312 PolarHBondContact O-N 2.68Å; M310-K312 VanDerWaalsContact C-N 3.3Å; M310-K312 PolarHBondContact O-N 3.36Å; K312-N316 WeakPolarHBondContact CG-ND2 3.32Å; K312-N316 WeakPolarHBondContact O-CB 3.44Å; K312-N316 PolarHBondContact O-N 2.92Å; K312-N316 VanDerWaalsContact O-N 3.09Å; K312-N316 PolarHBondContact O-ND2 3.18Å
313	T	71.9	Confident	77	Confident	25 Å²	25	94.8 Å²	94.8	15%	0.153	47%	0.471	C	S	.	.	H	α-helix	trans	-65.5	-42.7	177.4	-56.5	0	0	0	0	110.7	A309 M310 N316 Q317	A309-T313 WeakPolarHBondContact O-CB 3.29Å; A309-T313 PolarHBondContact O-N 3.15Å; A309-T313 PolarHBondContact O-OG1 2.69Å; M310-T313 PolarHBondContact O-N 3.41Å; M310-T313 VanDerWaalsContact O-N 3.13Å; T313-N316 CarbonylContact O-C 3.49Å; T313-N316 PolarHBondContact O-N 2.89Å; T313-Q317 PolarHBondContact O-N 3.11Å
314	W	73.4	Confident	78.2	Confident	193 Å²	193	95.4 Å²	95.4	73%	0.731	47%	0.473	S	S	*	.	H	α-helix	trans	-65.9	-44.3	176.5	-172.5	79.3	0	0	0	112.6	M310 A311 N316 Q317	M310-W314 PolarHBondContact O-N 2.92Å; A311-W314 PolarHBondContact O-N 2.94Å; W314-N316 VanDerWaalsContact C-N 3.29Å; W314-N316 PolarHBondContact O-N 2.93Å; W314-Q317 WeakPolarHBondContact O-CB 3.15Å; W314-Q317 PolarHBondContact O-N 2.85Å; W314-Q317 VanDerWaalsContact O-N 3.14Å
315	Y	71.1	Confident	79.2	Confident	190 Å²	190	90.6 Å²	90.6	75%	0.745	45%	0.454	S	S	*	.	H	α-helix	trans	-62.9	-35.8	178	-175.9	-96.2	0	0	0	112.7	A311 Q317	A311-Y315 WeakPolarHBondContact O-CB 3.38Å; A311-Y315 PolarHBondContact O-N 3.42Å; Y315-Q317 VanDerWaalsContact C-N 3.28Å
316	N	74.6	Confident	80.3	Confident	56 Å²	56	91.6 Å²	91.6	30%	0.299	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	19.9	178	-62.8	-60.1	0	0	0	112.7	G275 A276 K312 T313 W314	G275-N316 CarbonylContact C-O 3.59Å; A276-N316 HydrophobicContact CB-CB 4.22Å; A276-N316 PolarHBondContact N-O 2.79Å; K312-N316 WeakPolarHBondContact CG-ND2 3.32Å; K312-N316 WeakPolarHBondContact O-CB 3.44Å; K312-N316 PolarHBondContact O-N 2.92Å; K312-N316 VanDerWaalsContact O-N 3.09Å; K312-N316 PolarHBondContact O-ND2 3.18Å; T313-N316 CarbonylContact O-C 3.49Å; T313-N316 PolarHBondContact O-N 2.89Å; W314-N316 VanDerWaalsContact C-N 3.29Å; W314-N316 PolarHBondContact O-N 2.93Å
317	Q	77.6	Confident	81.2	Confident	114 Å²	114	95.6 Å²	95.6	53%	0.533	48%	0.478	S	S	.	.			trans	-70.9	141.7	178.9	-169	168.9	-37.2	0	0	110.1	T313 W314 Y315 T319	T313-Q317 PolarHBondContact O-N 3.11Å; W314-Q317 WeakPolarHBondContact O-CB 3.15Å; W314-Q317 PolarHBondContact O-N 2.85Å; W314-Q317 VanDerWaalsContact O-N 3.14Å; Y315-Q317 VanDerWaalsContact C-N 3.28Å; Q317-T319 PolarHBondContact O-N 2.94Å; Q317-T319 VanDerWaalsContact O-N 3.16Å
318	L	81.9	Confident	82.1	Confident	22 Å²	22	92 Å²	92	12%	0.115	46%	0.462	C	S	.	.			trans	-64.9	115.1	176	174.1	59.8	0	0	0	110.3	T278 Q279 F282 L320 I332	T278-L318 HydrophobicContact CG2-CB 4.04Å; T278-L318 HydrophobicContact CG2-CD2 3.95Å; Q279-L318 HydrophobicContact CB-CB 4.33Å; Q279-L318 HydrophobicContact CB-CD1 4.11Å; Q279-L318 HydrophobicContact CG-CD1 4.1Å; F282-L318 HydrophobicContact CB-CD2 3.66Å; F282-L318 HydrophobicContact CD2-CD2 4.27Å; F282-L318 HydrophobicContact CG-CD2 3.93Å; L318-L320 HydrophobicContact CD1-CD2 4.08Å; L318-L320 HydrophobicContact CD1-CG 4.12Å; L318-L320 HydrophobicContact CD2-CD1 3.67Å; L318-L320 HydrophobicContact CD2-CD2 4.37Å; L318-L320 HydrophobicContact CD2-CG 4.02Å; L318-L320 HydrophobicContact CG-CD1 3.97Å; L318-L320 HydrophobicContact CG-CD2 4.27Å; L318-L320 HydrophobicContact CG-CG 3.8Å; L318-I332 HydrophobicContact CD2-CD1 3.83Å
319	T	82.5	Confident	83.3	Confident	123 Å²	123	90.1 Å²	90.1	76%	0.755	45%	0.452	S	S	*	.			trans	-90.2	122.9	170.3	-52.4	0	0	0	0	110.1	Q317	Q317-T319 PolarHBondContact O-N 2.94Å; Q317-T319 VanDerWaalsContact O-N 3.16Å
320	L	85.6	Confident	84.7	Confident	49 Å²	49	91.3 Å²	91.3	26%	0.257	46%	0.455	S	S	.	.			trans	-125.7	146.7	177.5	-68.8	167.3	0	0	0	110.3	F282 L318 K324 L325 I332	F282-L320 HydrophobicContact CD1-CD2 4.28Å; F282-L320 HydrophobicContact CD2-CD1 4.35Å; F282-L320 HydrophobicContact CE1-CD2 3.89Å; F282-L320 HydrophobicContact CE2-CD1 4.21Å; F282-L320 HydrophobicContact CE2-CD2 4.24Å; F282-L320 HydrophobicContact CZ-CD2 3.87Å; L318-L320 HydrophobicContact CD1-CD2 4.08Å; L318-L320 HydrophobicContact CD1-CG 4.12Å; L318-L320 HydrophobicContact CD2-CD1 3.67Å; L318-L320 HydrophobicContact CD2-CD2 4.37Å; L318-L320 HydrophobicContact CD2-CG 4.02Å; L318-L320 HydrophobicContact CG-CD1 3.97Å; L318-L320 HydrophobicContact CG-CD2 4.27Å; L318-L320 HydrophobicContact CG-CG 3.8Å; L320-K324 HydrophobicContact CD2-CD 3.97Å; L320-K324 HydrophobicContact CD2-CG 4.47Å; L320-L325 HydrophobicContact CD1-CD2 4.19Å; L320-L325 HydrophobicContact CD2-CD2 4.42Å; L320-I332 HydrophobicContact CD1-CB 4.19Å; L320-I332 HydrophobicContact CD1-CD1 3.87Å; L320-I332 HydrophobicContact CD1-CG2 3.64Å
321	N	88.9	Confident	85.8	Confident	93 Å²	93	90 Å²	90	50%	0.497	45%	0.454	S	S	.	.			trans	-120.9	161.1	164.2	66.3	40.5	0	0	0	108.9	L323 K324 L325	N321-L323 VanDerWaalsContact C-N 3.3Å; N321-L323 PolarHBondContact O-N 2.88Å; N321-L323 PolarHBondContact OD1-N 3.26Å; N321-K324 PolarHBondContact O-N 2.77Å; N321-K324 WeakPolarHBondContact OD1-CB 3.33Å; N321-K324 PolarHBondContact OD1-N 2.85Å; N321-L325 PolarHBondContact O-N 2.84Å
322	T	92.4	Very high	86.9	Confident	115 Å²	115	90.1 Å²	90.1	71%	0.706	45%	0.446	S	S	*	.	H	α-helix	trans	-63	-35.2	-176.4	49.7	0	0	0	0	112.5	K324 L325 M326	T322-K324 VanDerWaalsContact C-N 3.35Å; T322-K324 PolarHBondContact O-N 3.1Å; T322-L325 PolarHBondContact O-N 2.99Å; T322-M326 PolarHBondContact O-N 3.33Å
323	L	93.1	Very high	88	Confident	100 Å²	100	85.2 Å²	85.2	52%	0.524	43%	0.43	S	S	.	.	H	α-helix	trans	-60	-42.7	175.3	-70.9	172.8	0	0	0	112.1	N321 L325 M326 Q327	N321-L323 VanDerWaalsContact C-N 3.3Å; N321-L323 PolarHBondContact O-N 2.88Å; N321-L323 PolarHBondContact OD1-N 3.26Å; L323-L325 VanDerWaalsContact C-N 3.35Å; L323-L325 PolarHBondContact O-N 2.83Å; L323-M326 HydrophobicContact CD2-CE 3.9Å; L323-M326 PolarHBondContact O-N 3.23Å; L323-Q327 WeakPolarHBondContact O-CB 3.33Å; L323-Q327 VanDerWaalsContact O-CG 3.23Å; L323-Q327 WeakPolarHBondContact O-CG 3.45Å; L323-Q327 PolarHBondContact O-N 2.83Å
324	K	91.6	Very high	89.2	Confident	81 Å²	81	86.7 Å²	86.7	35%	0.352	45%	0.45	S	S	.	.	H	α-helix	trans	-65.1	-38.1	177.4	-176.4	172.4	176.3	-178	0	111.6	L320 N321 T322 T328	L320-K324 HydrophobicContact CD2-CD 3.97Å; L320-K324 HydrophobicContact CD2-CG 4.47Å; N321-K324 PolarHBondContact O-N 2.77Å; N321-K324 WeakPolarHBondContact OD1-CB 3.33Å; N321-K324 PolarHBondContact OD1-N 2.85Å; T322-K324 VanDerWaalsContact C-N 3.35Å; T322-K324 PolarHBondContact O-N 3.1Å; K324-T328 HydrophobicContact CG-CG2 4.41Å; K324-T328 WeakPolarHBondContact O-CB 3.25Å; K324-T328 VanDerWaalsContact O-CG2 3.31Å; K324-T328 WeakPolarHBondContact O-CG2 3.07Å; K324-T328 PolarHBondContact O-N 3.14Å; K324-T328 PolarHBondContact O-OG1 2.8Å
325	L	94.6	Very high	90.3	Very high	46 Å²	46	78.2 Å²	78.2	24%	0.241	42%	0.418	C	S	.	.	H	α-helix	trans	-63.9	-47.1	174.7	-65	178.2	0	0	0	111.1	F282 L320 N321 T322 L323 T328 N329 K330 I332	F282-L325 HydrophobicContact CE2-CD2 3.73Å; F282-L325 HydrophobicContact CZ-CD2 3.78Å; L320-L325 HydrophobicContact CD1-CD2 4.19Å; L320-L325 HydrophobicContact CD2-CD2 4.42Å; N321-L325 PolarHBondContact O-N 2.84Å; T322-L325 PolarHBondContact O-N 2.99Å; L323-L325 VanDerWaalsContact C-N 3.35Å; L323-L325 PolarHBondContact O-N 2.83Å; L325-T328 PolarHBondContact O-N 3.37Å; L325-T328 PolarHBondContact O-OG1 2.99Å; L325-N329 PolarHBondContact O-N 2.67Å; L325-K330 PolarHBondContact O-N 3.49Å; L325-I332 HydrophobicContact CD2-CG2 4.49Å
326	M	95.3	Very high	91.5	Very high	124 Å²	124	72.2 Å²	72.2	61%	0.611	40%	0.397	S	S	*	.	H	α-helix	trans	-59.8	-47.7	176.5	-177.2	-173.8	71.5	0	0	112	T322 L323 T328 N329	T322-M326 PolarHBondContact O-N 3.33Å; L323-M326 HydrophobicContact CD2-CE 3.9Å; L323-M326 PolarHBondContact O-N 3.23Å; M326-T328 VanDerWaalsContact C-N 3.34Å; M326-T328 PolarHBondContact O-N 3.44Å; M326-N329 PolarHBondContact O-N 2.86Å
327	Q	95.1	Very high	92.4	Very high	143 Å²	143	70.2 Å²	70.2	67%	0.668	39%	0.386	S	S	*	.	H	α-helix	trans	-67.4	-32.3	-179	-72.8	171.3	-16.8	0	0	113.1	L323	L323-Q327 WeakPolarHBondContact O-CB 3.33Å; L323-Q327 VanDerWaalsContact O-CG 3.23Å; L323-Q327 WeakPolarHBondContact O-CG 3.45Å; L323-Q327 PolarHBondContact O-N 2.83Å
328	T	95.4	Very high	93.1	Very high	49 Å²	49	65.7 Å²	65.7	30%	0.301	37%	0.37	S	S	.	.	H	α-helix	trans	-92.1	-11	-179	58.8	0	0	0	0	113.7	K324 L325 M326 K330	K324-T328 HydrophobicContact CG-CG2 4.41Å; K324-T328 WeakPolarHBondContact O-CB 3.25Å; K324-T328 VanDerWaalsContact O-CG2 3.31Å; K324-T328 WeakPolarHBondContact O-CG2 3.07Å; K324-T328 PolarHBondContact O-N 3.14Å; K324-T328 PolarHBondContact O-OG1 2.8Å; L325-T328 PolarHBondContact O-N 3.37Å; L325-T328 PolarHBondContact O-OG1 2.99Å; M326-T328 VanDerWaalsContact C-N 3.34Å; M326-T328 PolarHBondContact O-N 3.44Å; T328-K330 VanDerWaalsContact C-N 3.29Å; T328-K330 PolarHBondContact O-N 3.11Å
329	N	97.3	Very high	93.6	Very high	96 Å²	96	70.3 Å²	70.3	51%	0.513	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	45.3	-172.2	-67.3	-79.2	0	0	0	112.1	L288 L325 M326	L288-N329 VanDerWaalsContact CA-O 3.31Å; L288-N329 WeakPolarHBondContact CA-O 3.13Å; L288-N329 HydrophobicContact CD2-CB 4.39Å; L288-N329 PolarHBondContact N-O 2.9Å; L325-N329 PolarHBondContact O-N 2.67Å; M326-N329 PolarHBondContact O-N 2.86Å
330	K	97.2	Very high	94.1	Very high	38 Å²	38	66.5 Å²	66.5	17%	0.165	36%	0.361	C	S	.	.			trans	-122.4	154.3	-178.3	-70.1	172.9	178.1	-161.2	0	110.9	F282 L285 L325 T328	F282-K330 HydrophobicContact CD1-CD 4.5Å; F282-K330 HydrophobicContact CE1-CD 3.97Å; F282-K330 HydrophobicContact CE2-CB 3.71Å; F282-K330 HydrophobicContact CE2-CD 4.23Å; F282-K330 HydrophobicContact CZ-CB 3.72Å; F282-K330 HydrophobicContact CZ-CD 3.81Å; F282-K330 HydrophobicContact CZ-CG 4.41Å; F282-K330 PolarHBondContact O-NZ 3.3Å; L285-K330 HydrophobicContact CB-CD 3.86Å; L285-K330 HydrophobicContact CB-CG 4.08Å; L285-K330 HydrophobicContact CD1-CB 4.22Å; L285-K330 HydrophobicContact CD1-CD 4.3Å; L285-K330 HydrophobicContact CD1-CG 4.32Å; L285-K330 WeakPolarHBondContact O-CE 3.48Å; L285-K330 PolarHBondContact O-NZ 2.8Å; L325-K330 PolarHBondContact O-N 3.49Å; T328-K330 VanDerWaalsContact C-N 3.29Å; T328-K330 PolarHBondContact O-N 3.11Å
331	A	97.3	Very high	94.4	Very high	35 Å²	35	74.2 Å²	74.2	29%	0.289	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	150.4	173.5	0	0	0	0	0	111.6	G289 M290 L291	G289-A331 PolarHBondContact O-N 3.22Å; M290-A331 WeakPolarHBondContact CA-O 3.28Å; M290-A331 HydrophobicContact CB-CB 4.27Å; M290-A331 HydrophobicContact CE-CB 3.94Å; M290-A331 HydrophobicContact CG-CB 4.13Å; L291-A331 PolarHBondContact N-O 3.34Å
332	I	96.1	Very high	94.7	Very high	59 Å²	59	73.6 Å²	73.6	30%	0.303	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.7	166.5	-172.8	163.8	0	0	0	108.2	T278 L291 L318 L320 L325	T278-I332 HydrophobicContact CG2-CD1 4.17Å; L291-I332 HydrophobicContact CD2-CD1 3.85Å; L291-I332 HydrophobicContact CD2-CG1 3.84Å; L291-I332 CarbonylContact O-C 3.38Å; L291-I332 WeakPolarHBondContact O-CA 3.21Å; L318-I332 HydrophobicContact CD2-CD1 3.83Å; L320-I332 HydrophobicContact CD1-CB 4.19Å; L320-I332 HydrophobicContact CD1-CD1 3.87Å; L320-I332 HydrophobicContact CD1-CG2 3.64Å; L325-I332 HydrophobicContact CD2-CG2 4.49Å
333	S	96.3	Very high	94.7	Very high	39 Å²	39	71.7 Å²	71.7	27%	0.273	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	160.8	172.8	-158.7	0	0	0	0	111.7	M192 L291 I292 V293	M192-S333 WeakPolarHBondContact CE-OG 3.31Å; L291-S333 PolarHBondContact O-N 2.76Å; I292-S333 WeakPolarHBondContact CA-O 3.29Å; V293-S333 PolarHBondContact N-O 3.38Å
334	G	95.8	Very high	94.8	Very high	55 Å²	55	73.9 Å²	73.9	57%	0.567	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.7	170.9	0	0	0	0	0	109.7	V293	V293-G334 CarbonylContact O-C 3.5Å; V293-G334 WeakPolarHBondContact O-CA 3.44Å
335	F	97.1	Very high	95	Very high	16 Å²	16	71.1 Å²	71.1	7%	0.07	36%	0.364	C	S	.	.			trans	-130.8	131.4	175.9	-179.6	-92.5	0	0	0	110.8	T184 M187 M188 M192 I292 V293 F294 L337 I340	T184-F335 HydrophobicContact CG2-CD1 3.87Å; T184-F335 HydrophobicContact CG2-CE1 3.62Å; M187-F335 HydrophobicContact CB-CD2 4.41Å; M187-F335 HydrophobicContact CB-CE2 3.53Å; M187-F335 HydrophobicContact CB-CZ 3.76Å; M187-F335 HydrophobicContact CG-CE2 4.3Å; M187-F335 HydrophobicContact CG-CZ 4.35Å; M187-F335 HydrophobicContact SD-CE2 3.81Å; M187-F335 HydrophobicContact SD-CZ 3.8Å; M188-F335 HydrophobicContact CG-CB 3.93Å; M188-F335 HydrophobicContact CG-CD1 3.77Å; M188-F335 HydrophobicContact CG-CD2 4.4Å; M188-F335 HydrophobicContact CG-CE1 4.44Å; M188-F335 HydrophobicContact CG-CG 3.74Å; M188-F335 HydrophobicContact SD-CB 4.36Å; M188-F335 HydrophobicContact SD-CD1 4.21Å; M188-F335 HydrophobicContact SD-CG 4.49Å; M192-F335 HydrophobicContact SD-CB 3.81Å; M192-F335 HydrophobicContact SD-CD2 3.62Å; M192-F335 HydrophobicContact SD-CG 4.08Å; I292-F335 HydrophobicContact CG2-CB 3.7Å; V293-F335 PolarHBondContact O-N 3.41Å; F294-F335 WeakPolarHBondContact CA-O 3.49Å; F294-F335 HydrophobicContact CB-CB 4.22Å; F294-F335 HydrophobicContact CB-CD1 4.29Å; F294-F335 VanDerWaalsContact CB-O 3.29Å; F294-F335 WeakPolarHBondContact CB-O 3.39Å; F335-L337 HydrophobicContact CE1-CB 4.05Å; F335-L337 HydrophobicContact CZ-CB 4.11Å; F335-L337 HydrophobicContact CZ-CD1 4.25Å; F335-I340 HydrophobicContact CE2-CG1 4.48Å
336	H	95.4	Very high	94.9	Very high	64 Å²	64	69.2 Å²	69.2	30%	0.296	35%	0.353	S	S	.	.			trans	-150	112.5	168.3	-176	-56.5	0	0	0	109.2	Y109 G338 Y339	Y109-H336 AromaticContact CE2-CE1 3.62Å; Y109-H336 AromaticContact CE2-NE2 3.33Å; Y109-H336 VanDerWaalsContact CE2-NE2 3.33Å; Y109-H336 WeakPolarHBondContact CE2-NE2 3.46Å; Y109-H336 AromaticContact CZ-CE1 3.83Å; Y109-H336 AromaticContact CZ-NE2 3.95Å; Y109-H336 PolarHBondContact OH-CE1 3.2Å; H336-G338 PolarHBondContact ND1-N 2.82Å; H336-G338 PolarHBondContact O-N 3.14Å; H336-G338 VanDerWaalsContact O-N 3.1Å; H336-Y339 HydrophobicContact CB-CD2 3.75Å; H336-Y339 HydrophobicContact CB-CE2 4.31Å; H336-Y339 AromaticContact CG-CD2 3.65Å; H336-Y339 AromaticContact CG-CE2 3.92Å; H336-Y339 AromaticContact ND1-CD2 3.57Å; H336-Y339 AromaticContact ND1-CE2 3.98Å; H336-Y339 PolarHBondContact O-N 2.64Å
337	L	94.9	Very high	94.9	Very high	14 Å²	14	68.7 Å²	68.7	7%	0.073	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-52.5	-39.4	-173.5	-175.9	60.8	0	0	0	113.3	M146 I180 M183 M187 F335 Y339 I340 F346	M146-L337 HydrophobicContact CE-CD2 4.4Å; I180-L337 HydrophobicContact CD1-CD2 3.84Å; M183-L337 HydrophobicContact CB-CD1 4.24Å; M183-L337 HydrophobicContact CB-CD2 3.92Å; M187-L337 HydrophobicContact CE-CD1 4.28Å; M187-L337 HydrophobicContact SD-CD1 3.96Å; F335-L337 HydrophobicContact CE1-CB 4.05Å; F335-L337 HydrophobicContact CZ-CB 4.11Å; F335-L337 HydrophobicContact CZ-CD1 4.25Å; L337-Y339 PolarHBondContact O-N 2.75Å; L337-Y339 VanDerWaalsContact O-N 3.09Å; L337-I340 WeakPolarHBondContact O-CB 3.14Å; L337-I340 PolarHBondContact O-N 3.38Å; L337-F346 HydrophobicContact CD1-CD2 4.4Å; L337-F346 HydrophobicContact CD1-CE2 4.32Å
338	G	91.9	Very high	95	Very high	19 Å²	19	67.5 Å²	67.5	20%	0.196	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-59.5	-18	177.3	0	0	0	0	0	116	L111 R148 H336	L111-G338 WeakPolarHBondContact CD1-O 3.31Å; R148-G338 PolarHBondContact NH1-O 2.97Å; H336-G338 PolarHBondContact ND1-N 2.82Å; H336-G338 PolarHBondContact O-N 3.14Å; H336-G338 VanDerWaalsContact O-N 3.1Å
339	Y	92.9	Very high	95.2	Very high	118 Å²	118	65.2 Å²	65.2	46%	0.463	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-95.1	-5.4	176.7	-69.2	-88.9	0	0	0	113.3	L111 H336 L337 R341	L111-Y339 HydrophobicContact CD1-CD1 4.3Å; L111-Y339 HydrophobicContact CD1-CD2 3.69Å; L111-Y339 HydrophobicContact CD1-CE1 4.16Å; L111-Y339 HydrophobicContact CD1-CE2 3.52Å; L111-Y339 HydrophobicContact CD1-CG 4.09Å; L111-Y339 HydrophobicContact CD2-CD1 4.14Å; L111-Y339 HydrophobicContact CD2-CE1 3.71Å; L111-Y339 HydrophobicContact CG-CE1 4.02Å; L111-Y339 HydrophobicContact CG-CE2 3.96Å; H336-Y339 HydrophobicContact CB-CD2 3.75Å; H336-Y339 HydrophobicContact CB-CE2 4.31Å; H336-Y339 AromaticContact CG-CD2 3.65Å; H336-Y339 AromaticContact CG-CE2 3.92Å; H336-Y339 AromaticContact ND1-CD2 3.57Å; H336-Y339 AromaticContact ND1-CE2 3.98Å; H336-Y339 PolarHBondContact O-N 2.64Å; L337-Y339 PolarHBondContact O-N 2.75Å; L337-Y339 VanDerWaalsContact O-N 3.09Å; Y339-R341 PolarHBondContact O-N 2.64Å
340	I	93.1	Very high	95.2	Very high	44 Å²	44	60.6 Å²	60.6	23%	0.226	30%	0.3	C	S	.	.			trans	-72.9	125.4	174.1	-57.3	-60.6	0	0	0	109.2	F335 L337 D342 L345	F335-I340 HydrophobicContact CE2-CG1 4.48Å; L337-I340 WeakPolarHBondContact O-CB 3.14Å; L337-I340 PolarHBondContact O-N 3.38Å; I340-D342 HydrophobicContact CG2-CB 4.34Å; I340-L345 HydrophobicContact CG2-CD2 4.14Å
341	R	91.8	Very high	95.2	Very high	210 Å²	210	61.6 Å²	61.6	79%	0.792	31%	0.309	S	S	*	.			trans	-112	-5.7	177.8	-60.7	-175.4	-178.6	-172.1	-0.4	113.4	Y339 E343	Y339-R341 PolarHBondContact O-N 2.64Å; R341-E343 PolarHBondContact O-N 2.9Å
342	D	94.5	Very high	95.3	Very high	81 Å²	81	63.3 Å²	63.3	43%	0.433	31%	0.31	S	S	.	.			trans	-77	103.1	177	-176.8	-18.2	0	0	0	108.9	I340 E344 L345 F346	I340-D342 HydrophobicContact CG2-CB 4.34Å; D342-E344 VanDerWaalsContact C-N 3.35Å; D342-E344 PolarHBondContact OD1-N 3.47Å; D342-E344 VanDerWaalsContact OD1-N 3.08Å; D342-L345 HydrophobicContact CB-CB 3.87Å; D342-L345 HydrophobicContact CB-CD2 4.48Å; D342-L345 PolarHBondContact OD1-N 3.4Å; D342-L345 WeakPolarHBondContact OD2-CB 3.43Å; D342-F346 WeakPolarHBondContact O-CB 3.45Å; D342-F346 PolarHBondContact O-N 3.11Å; D342-F346 VanDerWaalsContact O-N 3.11Å
343	E	92.1	Very high	95.4	Very high	75 Å²	75	60.5 Å²	60.5	35%	0.35	30%	0.296	S	S	.	.	H	α-helix	trans	-68.7	-33.3	-179.2	-60.9	-61.8	154.8	0	0	111.8	R162 R341 F346 E347	R162-E343 IonicContact CZ-OE1 3.53Å; R162-E343 IonicContact CZ-OE2 3.07Å; R162-E343 IonicContact NE-OE1 2.76Å; R162-E343 IonicContact NE-OE2 3.63Å; R162-E343 PolarHBondContact NE-OE2 3.11Å; R162-E343 IonicContact NH2-OE1 2.69Å; R162-E343 PolarHBondContact NH2-OE1 3.36Å; R162-E343 IonicContact NH2-OE2 2.97Å; R162-E343 PolarHBondContact NH2-OE2 3.09Å; R341-E343 PolarHBondContact O-N 2.9Å; E343-F346 WeakPolarHBondContact O-CB 3.48Å; E343-F346 PolarHBondContact O-N 3.18Å; E343-E347 WeakPolarHBondContact O-CB 3.45Å; E343-E347 PolarHBondContact O-N 3.16Å
344	E	95.1	Very high	95.5	Very high	145 Å²	145	59.6 Å²	59.6	68%	0.678	29%	0.287	S	S	*	.	H	α-helix	trans	-69.5	-45.3	179	-173.4	-174.5	166.8	0	0	110.6	D342 F346 E347 R348	D342-E344 VanDerWaalsContact C-N 3.35Å; D342-E344 PolarHBondContact OD1-N 3.47Å; D342-E344 VanDerWaalsContact OD1-N 3.08Å; E344-F346 PolarHBondContact O-N 3.1Å; E344-E347 PolarHBondContact O-N 3.38Å; E344-R348 WeakPolarHBondContact O-CB 3.42Å; E344-R348 VanDerWaalsContact O-CG 3.27Å; E344-R348 WeakPolarHBondContact O-CG 3.42Å; E344-R348 PolarHBondContact O-N 3.24Å
345	L	95.3	Very high	95.7	Very high	24 Å²	24	60.4 Å²	60.4	13%	0.126	28%	0.277	C	S	.	.	H	α-helix	trans	-57.4	-41.4	171.6	169.3	61.4	0	0	0	111.5	M187 E191 I340 D342 T349	M187-L345 HydrophobicContact CE-CD1 3.98Å; M187-L345 HydrophobicContact CE-CD2 4.27Å; M187-L345 HydrophobicContact CE-CG 3.73Å; M187-L345 HydrophobicContact SD-CD2 4.49Å; E191-L345 HydrophobicContact CG-CD1 4.16Å; I340-L345 HydrophobicContact CG2-CD2 4.14Å; D342-L345 HydrophobicContact CB-CB 3.87Å; D342-L345 HydrophobicContact CB-CD2 4.48Å; D342-L345 PolarHBondContact OD1-N 3.4Å; D342-L345 WeakPolarHBondContact OD2-CB 3.43Å; L345-T349 VanDerWaalsContact O-CB 3.26Å; L345-T349 WeakPolarHBondContact O-CB 3.32Å; L345-T349 PolarHBondContact O-N 3.23Å; L345-T349 VanDerWaalsContact O-N 3.15Å; L345-T349 PolarHBondContact O-OG1 2.92Å
346	F	93.9	Very high	95.7	Very high	6 Å²	6	60.4 Å²	60.4	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-51.8	179.2	-170.2	-87.5	0	0	0	111.5	M146 R162 F164 M183 L337 D342 E343 E344 T349 L350	M146-F346 HydrophobicContact CB-CZ 4.38Å; M146-F346 HydrophobicContact CE-CE2 4.07Å; M146-F346 HydrophobicContact CE-CZ 3.63Å; M146-F346 HydrophobicContact SD-CE1 3.96Å; M146-F346 HydrophobicContact SD-CE2 4.31Å; M146-F346 HydrophobicContact SD-CZ 3.34Å; M146-F346 WeakPolarHBondContact SD-CZ 3.42Å; R162-F346 VanDerWaalsContact NH1-CE1 3.32Å; F164-F346 HydrophobicContact CE2-CD1 4.46Å; F164-F346 HydrophobicContact CE2-CE1 4.01Å; F164-F346 HydrophobicContact CZ-CD1 4.19Å; F164-F346 HydrophobicContact CZ-CE1 4.19Å; M183-F346 HydrophobicContact CE-CB 4.34Å; M183-F346 HydrophobicContact CE-CD1 3.93Å; M183-F346 HydrophobicContact CE-CD2 3.33Å; M183-F346 HydrophobicContact CE-CE1 4.02Å; M183-F346 HydrophobicContact CE-CE2 3.43Å; M183-F346 VanDerWaalsContact CE-CE2 3.43Å; M183-F346 HydrophobicContact CE-CG 3.61Å; M183-F346 HydrophobicContact CE-CZ 3.81Å; M183-F346 WeakPolarHBondContact CE-O 3.33Å; M183-F346 HydrophobicContact SD-CD2 4.34Å; M183-F346 HydrophobicContact SD-CE1 4.33Å; M183-F346 HydrophobicContact SD-CE2 3.83Å; M183-F346 HydrophobicContact SD-CZ 3.86Å; L337-F346 HydrophobicContact CD1-CD2 4.4Å; L337-F346 HydrophobicContact CD1-CE2 4.32Å; D342-F346 WeakPolarHBondContact O-CB 3.45Å; D342-F346 PolarHBondContact O-N 3.11Å; D342-F346 VanDerWaalsContact O-N 3.11Å; E343-F346 WeakPolarHBondContact O-CB 3.48Å; E343-F346 PolarHBondContact O-N 3.18Å; E344-F346 PolarHBondContact O-N 3.1Å; F346-T349 PolarHBondContact O-N 3.47Å; F346-L350 PolarHBondContact O-N 2.93Å; F346-L350 VanDerWaalsContact O-N 3.1Å
347	E	95.5	Very high	95.9	Very high	112 Å²	112	58.7 Å²	58.7	52%	0.523	27%	0.268	S	S	.	.	H	α-helix	trans	-60.8	-53.6	179.4	-179.6	174.3	-177.6	0	0	111.5	F164 E343 E344 T349 L350 V351	F164-E347 HydrophobicContact CE1-CB 4.44Å; F164-E347 HydrophobicContact CE1-CG 4.08Å; E343-E347 WeakPolarHBondContact O-CB 3.45Å; E343-E347 PolarHBondContact O-N 3.16Å; E344-E347 PolarHBondContact O-N 3.38Å; E347-T349 PolarHBondContact O-N 3.13Å; E347-L350 PolarHBondContact O-N 3.29Å; E347-L350 VanDerWaalsContact O-N 3.11Å; E347-V351 HydrophobicContact CG-CG2 4.33Å; E347-V351 WeakPolarHBondContact O-CG2 3.26Å; E347-V351 PolarHBondContact O-N 3.14Å
348	R	97.3	Very high	96	Very high	118 Å²	118	64.4 Å²	64.4	45%	0.445	30%	0.295	S	S	.	.	H	α-helix	trans	-58.9	-35	-178.8	76.6	-170.7	172.9	92	-2.5	112.2	E191 E344 K352	E191-R348 IonicContact OE1-CZ 3.58Å; E191-R348 IonicContact OE1-NH1 3.89Å; E191-R348 PolarHBondContact OE1-NH1 3.04Å; E191-R348 IonicContact OE1-NH2 2.63Å; E191-R348 IonicContact OE2-CZ 3.42Å; E191-R348 IonicContact OE2-NH1 2.61Å; E191-R348 IonicContact OE2-NH2 2.64Å; E191-R348 PolarHBondContact OE2-NH2 2.74Å; E344-R348 WeakPolarHBondContact O-CB 3.42Å; E344-R348 VanDerWaalsContact O-CG 3.27Å; E344-R348 WeakPolarHBondContact O-CG 3.42Å; E344-R348 PolarHBondContact O-N 3.24Å; R348-K352 VanDerWaalsContact O-CB 3.31Å; R348-K352 WeakPolarHBondContact O-CB 3.44Å; R348-K352 PolarHBondContact O-N 3.34Å
349	T	98.1	Very high	96.3	Very high	1 Å²	1	68.9 Å²	68.9	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-68.1	-47.9	177	-60.7	0	0	0	0	111.4	M183 Y186 M187 L345 F346 E347 K352 L353	M183-T349 HydrophobicContact CB-CG2 4.23Å; M183-T349 HydrophobicContact CE-CG2 4.24Å; M183-T349 HydrophobicContact CG-CG2 4.08Å; Y186-T349 HydrophobicContact CD1-CG2 3.66Å; Y186-T349 HydrophobicContact CE1-CG2 4.36Å; Y186-T349 HydrophobicContact CG-CG2 4.06Å; M187-T349 HydrophobicContact CE-CG2 3.94Å; M187-T349 VanDerWaalsContact CE-OG1 3.29Å; M187-T349 WeakPolarHBondContact CE-OG1 3.45Å; M187-T349 HydrophobicContact CG-CG2 4.22Å; L345-T349 VanDerWaalsContact O-CB 3.26Å; L345-T349 WeakPolarHBondContact O-CB 3.32Å; L345-T349 PolarHBondContact O-N 3.23Å; L345-T349 VanDerWaalsContact O-N 3.15Å; L345-T349 PolarHBondContact O-OG1 2.92Å; F346-T349 PolarHBondContact O-N 3.47Å; E347-T349 PolarHBondContact O-N 3.13Å; T349-K352 WeakPolarHBondContact O-CB 3.32Å; T349-K352 PolarHBondContact O-N 2.97Å; T349-L353 HydrophobicContact CG2-CD1 4.24Å; T349-L353 WeakPolarHBondContact O-CG 3.3Å; T349-L353 PolarHBondContact O-N 2.93Å
350	L	97.6	Very high	96.6	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-70	-38.8	-177.4	-173.4	55	0	0	0	112	M146 F164 L178 P179 M183 F346 E347 K352 L353 L354	M146-L350 HydrophobicContact SD-CD2 4.27Å; F164-L350 HydrophobicContact CB-CD2 4.05Å; F164-L350 HydrophobicContact CD1-CB 4.28Å; F164-L350 HydrophobicContact CD1-CD2 3.73Å; F164-L350 HydrophobicContact CD1-CG 4Å; F164-L350 HydrophobicContact CD2-CD2 3.18Å; F164-L350 HydrophobicContact CD2-CG 4.29Å; F164-L350 HydrophobicContact CE1-CB 4.06Å; F164-L350 HydrophobicContact CE1-CD2 3.93Å; F164-L350 HydrophobicContact CE1-CG 4.24Å; F164-L350 HydrophobicContact CE2-CD2 3.45Å; F164-L350 VanDerWaalsContact CE2-CD2 3.45Å; F164-L350 HydrophobicContact CG-CD2 3.36Å; F164-L350 HydrophobicContact CG-CG 4.03Å; F164-L350 HydrophobicContact CZ-CB 4.32Å; F164-L350 HydrophobicContact CZ-CD2 3.81Å; L178-L350 HydrophobicContact CD2-CD1 4.25Å; P179-L350 HydrophobicContact CB-CD1 4.46Å; M183-L350 HydrophobicContact CE-CB 4.22Å; M183-L350 HydrophobicContact CG-CD1 4.45Å; M183-L350 HydrophobicContact SD-CB 4.17Å; M183-L350 HydrophobicContact SD-CD1 4.35Å; M183-L350 HydrophobicContact SD-CD2 4.47Å; F346-L350 PolarHBondContact O-N 2.93Å; F346-L350 VanDerWaalsContact O-N 3.1Å; E347-L350 PolarHBondContact O-N 3.29Å; E347-L350 VanDerWaalsContact O-N 3.11Å; L350-K352 VanDerWaalsContact C-N 3.29Å; L350-K352 PolarHBondContact O-N 2.82Å; L350-L353 HydrophobicContact CD1-CD1 4.41Å; L350-L353 PolarHBondContact O-N 3.09Å; L350-L354 WeakPolarHBondContact O-CG 3.45Å; L350-L354 PolarHBondContact O-N 3.14Å
351	V	98.1	Very high	96.8	Very high	59 Å²	59	70.2 Å²	70.2	36%	0.358	34%	0.336	S	S	.	.	H	α-helix	trans	-56.5	-46.4	170.7	171.9	0	0	0	0	110.1	E347 L353 L354 E355	E347-V351 HydrophobicContact CG-CG2 4.33Å; E347-V351 WeakPolarHBondContact O-CG2 3.26Å; E347-V351 PolarHBondContact O-N 3.14Å; V351-L353 VanDerWaalsContact C-N 3.28Å; V351-L353 PolarHBondContact O-N 3.37Å; V351-L354 PolarHBondContact O-N 3.45Å; V351-L354 VanDerWaalsContact O-N 3.13Å; V351-E355 PolarHBondContact O-N 3.47Å
352	K	98.6	Very high	97.2	Very high	71 Å²	71	60.4 Å²	60.4	31%	0.309	30%	0.299	S	S	.	.	H	α-helix	trans	-60.5	-38.1	178.2	-172.9	54.6	175.9	-179	0	113.2	Y186 R348 T349 L350 E355 L356	Y186-K352 HydrophobicContact CE2-CG 3.81Å; R348-K352 VanDerWaalsContact O-CB 3.31Å; R348-K352 WeakPolarHBondContact O-CB 3.44Å; R348-K352 PolarHBondContact O-N 3.34Å; T349-K352 WeakPolarHBondContact O-CB 3.32Å; T349-K352 PolarHBondContact O-N 2.97Å; L350-K352 VanDerWaalsContact C-N 3.29Å; L350-K352 PolarHBondContact O-N 2.82Å; K352-E355 WeakPolarHBondContact CD-OE2 3.38Å; K352-E355 IonicContact NZ-OE2 3.58Å; K352-E355 PolarHBondContact NZ-OE2 3.37Å; K352-E355 WeakPolarHBondContact O-CB 3.47Å; K352-E355 PolarHBondContact O-N 2.81Å; K352-L356 WeakPolarHBondContact O-CG 3.46Å; K352-L356 PolarHBondContact O-N 3.08Å
353	L	98.8	Very high	97.3	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67.3	-40.1	176.4	-68.4	170.1	0	0	0	111.8	L178 Y182 M183 Y186 L217 T349 L350 V351 E355 L356 Y357 I362	L178-L353 HydrophobicContact CD2-CB 4.46Å; Y182-L353 HydrophobicContact CD1-CD2 4.38Å; M183-L353 HydrophobicContact CB-CD1 4.34Å; M183-L353 HydrophobicContact CG-CD1 3.61Å; Y186-L353 HydrophobicContact CD2-CD2 4.04Å; Y186-L353 HydrophobicContact CG-CD2 4.42Å; L217-L353 HydrophobicContact CD2-CD2 4.14Å; T349-L353 HydrophobicContact CG2-CD1 4.24Å; T349-L353 WeakPolarHBondContact O-CG 3.3Å; T349-L353 PolarHBondContact O-N 2.93Å; L350-L353 HydrophobicContact CD1-CD1 4.41Å; L350-L353 PolarHBondContact O-N 3.09Å; V351-L353 VanDerWaalsContact C-N 3.28Å; V351-L353 PolarHBondContact O-N 3.37Å; L353-E355 VanDerWaalsContact C-N 3.34Å; L353-E355 PolarHBondContact O-N 3.39Å; L353-L356 PolarHBondContact O-N 3.29Å; L353-Y357 PolarHBondContact O-N 2.8Å; L353-I362 HydrophobicContact CB-CD1 4.28Å; L353-I362 HydrophobicContact CD2-CD1 3.97Å; L353-I362 WeakPolarHBondContact O-CD1 3.33Å
354	L	98.6	Very high	97.6	Very high	19 Å²	19	59.5 Å²	59.5	10%	0.099	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-39.9	175.1	-67.9	175.7	0	0	0	111.8	I144 F164 P167 M170 L178 L350 V351 Y357 Q358	I144-L354 HydrophobicContact CD1-CD2 3.87Å; F164-L354 HydrophobicContact CB-CD1 4.29Å; P167-L354 HydrophobicContact CG-CD2 3.94Å; M170-L354 HydrophobicContact CE-CD2 3.93Å; L178-L354 HydrophobicContact CD2-CD2 3.74Å; L350-L354 WeakPolarHBondContact O-CG 3.45Å; L350-L354 PolarHBondContact O-N 3.14Å; V351-L354 PolarHBondContact O-N 3.45Å; V351-L354 VanDerWaalsContact O-N 3.13Å; L354-Y357 PolarHBondContact O-N 3.03Å; L354-Q358 WeakPolarHBondContact O-CG 3.48Å; L354-Q358 PolarHBondContact O-N 3.05Å
355	E	98.4	Very high	97.8	Very high	72 Å²	72	56.7 Å²	56.7	34%	0.336	28%	0.277	S	S	.	.	H	α-helix	trans	-58.9	-48.1	172	-68.6	174.6	-177.4	0	0	111.7	V351 K352 L353 Y357 Q358 Q359	V351-E355 PolarHBondContact O-N 3.47Å; K352-E355 WeakPolarHBondContact CD-OE2 3.38Å; K352-E355 IonicContact NZ-OE2 3.58Å; K352-E355 PolarHBondContact NZ-OE2 3.37Å; K352-E355 WeakPolarHBondContact O-CB 3.47Å; K352-E355 PolarHBondContact O-N 2.81Å; L353-E355 VanDerWaalsContact C-N 3.34Å; L353-E355 PolarHBondContact O-N 3.39Å; E355-Y357 VanDerWaalsContact C-N 3.27Å; E355-Y357 PolarHBondContact O-N 2.86Å; E355-Q358 PolarHBondContact O-N 3.11Å; E355-Q359 VanDerWaalsContact O-CG 3.23Å; E355-Q359 WeakPolarHBondContact O-CG 3.34Å; E355-Q359 PolarHBondContact O-N 2.69Å
356	L	98.7	Very high	98	Very high	16 Å²	16	56.9 Å²	56.9	8%	0.084	28%	0.278	C	S	.	.	H	α-helix	trans	-62.7	-35.4	178.9	-71.9	173.1	0	0	0	111.9	L217 T220 K352 L353 Q359 G360 K361 I362	L217-L356 HydrophobicContact CD2-CD1 3.79Å; T220-L356 HydrophobicContact CG2-CD2 4.46Å; K352-L356 WeakPolarHBondContact O-CG 3.46Å; K352-L356 PolarHBondContact O-N 3.08Å; L353-L356 PolarHBondContact O-N 3.29Å; L356-Q359 PolarHBondContact O-N 2.8Å; L356-G360 PolarHBondContact O-N 2.89Å; L356-K361 HydrophobicContact CB-CB 4.42Å; L356-K361 HydrophobicContact CD2-CB 4.19Å; L356-K361 HydrophobicContact CD2-CG 4.42Å; L356-K361 WeakPolarHBondContact O-CB 3.41Å; L356-K361 PolarHBondContact O-N 2.91Å; L356-I362 HydrophobicContact CB-CD1 3.92Å; L356-I362 HydrophobicContact CB-CG1 3.89Å; L356-I362 HydrophobicContact CB-CG2 4.39Å; L356-I362 PolarHBondContact O-N 2.85Å
357	Y	98.6	Very high	98.2	Very high	29 Å²	29	58.1 Å²	58.1	11%	0.114	29%	0.285	C	S	.	.	H	α-helix	trans	-65.6	-48.3	174.7	178.3	-86.8	0	0	0	111.1	M170 E174 L353 L354 E355 Q359 G360 I362	M170-Y357 WeakPolarHBondContact CA-OH 3.43Å; M170-Y357 HydrophobicContact CB-CE1 3.66Å; M170-Y357 HydrophobicContact CE-CD1 3.2Å; M170-Y357 HydrophobicContact CE-CD2 3.61Å; M170-Y357 HydrophobicContact CE-CE1 3.4Å; M170-Y357 VanDerWaalsContact CE-CE1 3.4Å; M170-Y357 HydrophobicContact CE-CE2 3.77Å; M170-Y357 HydrophobicContact CE-CG 3.31Å; M170-Y357 HydrophobicContact CG-CE1 4.03Å; M170-Y357 HydrophobicContact CG-CE2 4.35Å; E174-Y357 PolarHBondContact OE2-OH 3.43Å; L353-Y357 PolarHBondContact O-N 2.8Å; L354-Y357 PolarHBondContact O-N 3.03Å; E355-Y357 VanDerWaalsContact C-N 3.27Å; E355-Y357 PolarHBondContact O-N 2.86Å; Y357-Q359 PolarHBondContact O-N 3.29Å; Y357-G360 WeakPolarHBondContact O-CA 3.45Å; Y357-G360 PolarHBondContact O-N 2.92Å; Y357-I362 WeakPolarHBondContact CD2-O 3.4Å
358	Q	97.9	Very high	98.3	Very high	133 Å²	133	53.6 Å²	53.6	62%	0.621	27%	0.266	S	S	*	.	H	α-helix	trans	-61.3	-32.8	177.9	-73.1	175	-22.3	0	0	112.4	P167 L354 E355 G360	P167-Q358 HydrophobicContact CB-CG 4Å; P167-Q358 HydrophobicContact CG-CG 4.16Å; L354-Q358 WeakPolarHBondContact O-CG 3.48Å; L354-Q358 PolarHBondContact O-N 3.05Å; E355-Q358 PolarHBondContact O-N 3.11Å; Q358-G360 PolarHBondContact O-N 3.11Å
359	Q	98.1	Very high	98.4	Very high	113 Å²	113	53.8 Å²	53.8	53%	0.528	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-2	173	-67.5	168.6	16.7	0	0	113.7	E355 L356 Y357 K361	E355-Q359 VanDerWaalsContact O-CG 3.23Å; E355-Q359 WeakPolarHBondContact O-CG 3.34Å; E355-Q359 PolarHBondContact O-N 2.69Å; L356-Q359 PolarHBondContact O-N 2.8Å; Y357-Q359 PolarHBondContact O-N 3.29Å; Q359-K361 HydrophobicContact CB-CG 3.92Å; Q359-K361 PolarHBondContact O-N 2.97Å
360	G	97.9	Very high	98.4	Very high	66 Å²	66	55.8 Å²	55.8	68%	0.68	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	17.1	-176.6	0	0	0	0	0	114.1	L356 Y357 Q358	L356-G360 PolarHBondContact O-N 2.89Å; Y357-G360 WeakPolarHBondContact O-CA 3.45Å; Y357-G360 PolarHBondContact O-N 2.92Å; Q358-G360 PolarHBondContact O-N 3.11Å
361	K	98.4	Very high	98.4	Very high	124 Å²	124	57.7 Å²	57.7	54%	0.539	28%	0.283	S	S	.	.	S	Bend	trans	-83	-27	-178.8	-63.3	-61.1	-176	-177.3	0	113	T220 L356 Q359	T220-K361 HydrophobicContact CG2-CB 4.14Å; L356-K361 HydrophobicContact CB-CB 4.42Å; L356-K361 HydrophobicContact CD2-CB 4.19Å; L356-K361 HydrophobicContact CD2-CG 4.42Å; L356-K361 WeakPolarHBondContact O-CB 3.41Å; L356-K361 PolarHBondContact O-N 2.91Å; Q359-K361 HydrophobicContact CB-CG 3.92Å; Q359-K361 PolarHBondContact O-N 2.97Å
362	I	98.6	Very high	98.5	Very high	4 Å²	4	55 Å²	55	2%	0.021	27%	0.266	C	S	.	.			trans	-130.7	147.6	174.1	64	174.3	0	0	0	110.2	L178 Y182 Q216 L217 L353 L356 Y357	L178-I362 HydrophobicContact CD1-CD1 3.9Å; Y182-I362 HydrophobicContact CD1-CB 4.32Å; Y182-I362 HydrophobicContact CD1-CD1 3.73Å; Y182-I362 HydrophobicContact CD1-CG2 4.4Å; Y182-I362 HydrophobicContact CE1-CB 3.72Å; Y182-I362 HydrophobicContact CE1-CD1 3.95Å; Y182-I362 HydrophobicContact CE1-CG1 4.33Å; Y182-I362 HydrophobicContact CE1-CG2 4.01Å; Q216-I362 HydrophobicContact CB-CG2 4.08Å; L217-I362 HydrophobicContact CD2-CG2 4Å; L217-I362 HydrophobicContact CG-CG2 4.48Å; L353-I362 HydrophobicContact CB-CD1 4.28Å; L353-I362 HydrophobicContact CD2-CD1 3.97Å; L353-I362 WeakPolarHBondContact O-CD1 3.33Å; L356-I362 HydrophobicContact CB-CD1 3.92Å; L356-I362 HydrophobicContact CB-CG1 3.89Å; L356-I362 HydrophobicContact CB-CG2 4.39Å; L356-I362 PolarHBondContact O-N 2.85Å; Y357-I362 WeakPolarHBondContact CD2-O 3.4Å
363	K	98.3	Very high	98.4	Very high	132 Å²	132	55.8 Å²	55.8	57%	0.574	27%	0.271	S	S	*	.			trans	-148.6	111	175.8	-175.7	166.7	-175.8	161.9	0	109.6	E174 Y182 Q216 H365	E174-K363 WeakPolarHBondContact OE1-CE 3.41Å; Y182-K363 VanDerWaalsContact OH-C 3.31Å; Y182-K363 PolarHBondContact OH-O 3.04Å; Q216-K363 PolarHBondContact NE2-O 3.09Å; Q216-K363 PolarHBondContact OE1-O 2.92Å; K363-H365 PolarHBondContact O-N 3.41Å
364	P	98.5	Very high	98.4	Very high	5 Å²	5	57.6 Å²	57.6	3%	0.032	28%	0.28	C	S	.	.			trans	-54.5	124.6	177.2	-26.6	35.1	0	0	0	111.6	E174 A177 L178 Y182	E174-P364 HydrophobicContact CB-CB 4.43Å; E174-P364 HydrophobicContact CB-CG 4.39Å; A177-P364 HydrophobicContact CB-CB 3.67Å; L178-P364 HydrophobicContact CB-CG 4Å; L178-P364 HydrophobicContact CD1-CG 3.71Å; L178-P364 HydrophobicContact CG-CG 4.49Å; Y182-P364 HydrophobicContact CE2-CB 4.08Å; Y182-P364 HydrophobicContact CE2-CG 3.9Å; Y182-P364 WeakPolarHBondContact OH-CA 3.44Å
365	H	98.3	Very high	98.3	Very high	86 Å²	86	57.2 Å²	57.2	40%	0.398	28%	0.278	S	S	.	.			trans	-89	115.3	177.4	-171.4	89.7	0	0	0	109.7	I212 K363 I388 G389 K390	I212-H365 HydrophobicContact CD1-CB 3.94Å; I212-H365 HydrophobicContact CG2-CB 4.15Å; K363-H365 PolarHBondContact O-N 3.41Å; H365-I388 PolarHBondContact CD2-O 3.46Å; H365-G389 CarbonylContact O-C 3.56Å; H365-G389 WeakPolarHBondContact O-CA 3.44Å; H365-K390 PolarHBondContact O-N 2.96Å
366	I	98.7	Very high	98.3	Very high	29 Å²	29	55.9 Å²	55.9	15%	0.149	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	120.8	177.1	-51.2	-54.1	0	0	0	108.9	E173 A177 R369 K390 I392	E173-I366 HydrophobicContact CB-CD1 4.26Å; E173-I366 HydrophobicContact CB-CG1 4.25Å; E173-I366 WeakPolarHBondContact O-CD1 3.27Å; A177-I366 HydrophobicContact CB-CD1 3.41Å; A177-I366 VanDerWaalsContact CB-CD1 3.41Å; I366-R369 HydrophobicContact CG2-CG 4.35Å; I366-K390 HydrophobicContact CD1-CB 4.33Å; I366-I392 HydrophobicContact CD1-CD1 4.24Å; I366-I392 HydrophobicContact CD1-CG1 4.02Å; I366-I392 HydrophobicContact CG2-CG1 3.87Å
367	D	98.6	Very high	98.2	Very high	31 Å²	31	59.4 Å²	59.4	17%	0.166	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-54.1	178.1	176.9	56.8	0	0	0	111.3	R381 N387 I388 K390	D367-R381 IonicContact OD1-CZ 2.68Å; D367-R381 IonicContact OD1-NE 3.6Å; D367-R381 IonicContact OD1-NH2 2.7Å; D367-R381 PolarHBondContact OD1-NH2 3.25Å; D367-R381 WeakPolarHBondContact OD2-CD 3.48Å; D367-R381 IonicContact OD2-CZ 3.37Å; D367-R381 IonicContact OD2-NE 3.59Å; D367-R381 PolarHBondContact OD2-NE 2.95Å; D367-R381 IonicContact OD2-NH2 2.75Å; D367-R381 PolarHBondContact OD2-NH2 3.37Å; D367-N387 HydrophobicContact CB-CB 4.22Å; D367-N387 VanDerWaalsContact CG-CA 3.48Å; D367-N387 WeakPolarHBondContact OD1-CA 3.29Å; D367-N387 VanDerWaalsContact OD2-CA 3.23Å; D367-N387 WeakPolarHBondContact OD2-CA 3.42Å; D367-N387 WeakPolarHBondContact OD2-CB 3.13Å; D367-I388 WeakPolarHBondContact CA-O 3.41Å; D367-I388 WeakPolarHBondContact CB-O 3.18Å; D367-I388 PolarHBondContact OD1-N 3.08Å; D367-K390 VanDerWaalsContact CB-O 3.3Å; D367-K390 WeakPolarHBondContact CB-O 3.26Å; D367-K390 PolarHBondContact N-O 3.17Å
368	S	98.4	Very high	98.2	Very high	17 Å²	17	58 Å²	58	12%	0.119	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	156.2	-172.1	61.9	0	0	0	0	110.7	Y370 I392	S368-Y370 WeakPolarHBondContact OG-CE2 3.2Å; S368-I392 PolarHBondContact O-N 2.96Å
369	R	98.5	Very high	98.1	Very high	123 Å²	123	51.7 Å²	51.7	46%	0.464	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.6	175.9	-62.6	169.5	-178.8	75.7	0.5	108.2	E173 I366 I392 L394	E173-R369 IonicContact OE1-CZ 2.92Å; E173-R369 IonicContact OE1-NE 2.94Å; E173-R369 PolarHBondContact OE1-NE 2.96Å; E173-R369 IonicContact OE1-NH2 3.57Å; I366-R369 HydrophobicContact CG2-CG 4.35Å; R369-I392 WeakPolarHBondContact CA-O 3.37Å; R369-I392 HydrophobicContact CG-CB 4.36Å; R369-L394 HydrophobicContact CB-CD1 4.06Å; R369-L394 HydrophobicContact CB-CG 4.41Å
370	Y	98.6	Very high	98	Very high	42 Å²	42	50.8 Å²	50.8	17%	0.165	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	139.5	178.5	-70.3	-79.3	0	0	0	109.2	S368 E374 D377 A378 R381 V391 I392 L393 L394	S368-Y370 WeakPolarHBondContact OG-CE2 3.2Å; Y370-E374 HydrophobicContact CD1-CB 3.81Å; Y370-E374 HydrophobicContact CG-CB 4.4Å; Y370-D377 HydrophobicContact CD1-CB 4.38Å; Y370-D377 HydrophobicContact CE1-CB 3.95Å; Y370-A378 HydrophobicContact CD1-CB 4.49Å; Y370-A378 HydrophobicContact CD2-CB 3.42Å; Y370-A378 VanDerWaalsContact CD2-CB 3.42Å; Y370-A378 HydrophobicContact CE2-CB 4.01Å; Y370-A378 HydrophobicContact CG-CB 3.69Å; Y370-R381 WeakPolarHBondContact OH-CD 3.47Å; Y370-V391 HydrophobicContact CD2-CG1 3.76Å; Y370-V391 HydrophobicContact CE2-CG1 3.95Å; Y370-I392 PolarHBondContact N-O 2.87Å; Y370-L393 CarbonylContact O-C 3.55Å; Y370-L393 VanDerWaalsContact O-CA 3.25Å; Y370-L393 WeakPolarHBondContact O-CA 3.4Å; Y370-L394 PolarHBondContact O-N 3.48Å
371	H	98.6	Very high	97.9	Very high	41 Å²	41	51 Å²	51	19%	0.19	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	164	169.2	-65.5	-89.5	0	0	0	110.3	E373 E374 E396 K398	H371-E373 VanDerWaalsContact CB-OE2 3.31Å; H371-E373 WeakPolarHBondContact CB-OE2 3.26Å; H371-E373 PolarHBondContact O-N 3.07Å; H371-E374 IonicContact CD2-OE2 2.64Å; H371-E374 PolarHBondContact N-OE2 2.79Å; H371-E374 WeakPolarHBondContact O-CA 3.48Å; H371-E374 PolarHBondContact O-N 3.14Å; H371-E396 PolarHBondContact ND1-O 3.48Å; H371-K398 HydrophobicContact CB-CB 4.15Å
372	F	98.3	Very high	97.8	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-57.1	-31.9	-179.8	-79.1	-3.1	0	0	0	113.5	L60 L73 W152 E374 V375 L393 L394 P395	L60-F372 HydrophobicContact CD1-CB 4.07Å; L60-F372 HydrophobicContact CD1-CD1 3.59Å; L60-F372 HydrophobicContact CD1-CD2 4.49Å; L60-F372 HydrophobicContact CD1-CE1 4.08Å; L60-F372 HydrophobicContact CD1-CG 3.81Å; L60-F372 HydrophobicContact CD2-CB 4.16Å; L60-F372 HydrophobicContact CG-CB 4.1Å; L60-F372 HydrophobicContact CG-CD1 4.19Å; L60-F372 HydrophobicContact CG-CD2 4.22Å; L60-F372 HydrophobicContact CG-CG 3.93Å; L73-F372 HydrophobicContact CD1-CB 3.92Å; L73-F372 HydrophobicContact CD1-CD2 4Å; L73-F372 HydrophobicContact CD1-CG 4.44Å; L73-F372 HydrophobicContact CD2-CB 4.46Å; W152-F372 HydrophobicContact CB-CZ 4.49Å; F372-E374 PolarHBondContact O-N 3.06Å; F372-V375 WeakPolarHBondContact O-CB 3.36Å; F372-V375 PolarHBondContact O-N 2.76Å; F372-L393 HydrophobicContact CD1-CB 4.11Å; F372-L393 HydrophobicContact CE1-CB 3.98Å; F372-L394 WeakPolarHBondContact CD1-O 3.43Å; F372-L394 PolarHBondContact N-O 3.28Å; F372-P395 HydrophobicContact CD2-CB 4.36Å; F372-P395 HydrophobicContact CE1-CB 4.2Å; F372-P395 HydrophobicContact CE1-CG 3.98Å; F372-P395 HydrophobicContact CE2-CB 3.66Å; F372-P395 HydrophobicContact CE2-CG 4.17Å; F372-P395 HydrophobicContact CZ-CB 3.58Å; F372-P395 HydrophobicContact CZ-CG 3.55Å
373	E	97.7	Very high	97.4	Very high	89 Å²	89	46.9 Å²	46.9	42%	0.416	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-60.1	-26.3	174.2	-63	84.3	170.3	0	0	112.5	R58 L73 H371	R58-E373 IonicContact CZ-OE1 3.9Å; R58-E373 IonicContact NH1-OE1 3.11Å; R58-E373 PolarHBondContact NH1-OE1 3.2Å; R58-E373 IonicContact NH2-OE1 3.33Å; L73-E373 HydrophobicContact CD2-CG 4.03Å; H371-E373 VanDerWaalsContact CB-OE2 3.31Å; H371-E373 WeakPolarHBondContact CB-OE2 3.26Å; H371-E373 PolarHBondContact O-N 3.07Å
374	E	97.8	Very high	97.2	Very high	38 Å²	38	43.5 Å²	43.5	18%	0.178	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-101.7	16	-174.8	-58.6	169.1	132.4	0	0	112.1	Y370 H371 F372 A376 D377 A378 K398	Y370-E374 HydrophobicContact CD1-CB 3.81Å; Y370-E374 HydrophobicContact CG-CB 4.4Å; H371-E374 IonicContact CD2-OE2 2.64Å; H371-E374 PolarHBondContact N-OE2 2.79Å; H371-E374 WeakPolarHBondContact O-CA 3.48Å; H371-E374 PolarHBondContact O-N 3.14Å; F372-E374 PolarHBondContact O-N 3.06Å; E374-A376 PolarHBondContact O-N 3.1Å; E374-A376 VanDerWaalsContact O-N 3.1Å; E374-D377 PolarHBondContact O-N 3.17Å; E374-A378 PolarHBondContact O-N 2.93Å; E374-K398 IonicContact OE1-NZ 2.81Å; E374-K398 PolarHBondContact OE1-NZ 3.24Å
375	V	97.8	Very high	96.9	Very high	11 Å²	11	46 Å²	46	7%	0.067	22%	0.218	C	C	.	.	H	α-helix	trans	-55.2	-33.1	-177.1	66.6	0	0	0	0	113.3	L60 I71 W152 F372 D377 A378 M379 L393	L60-V375 HydrophobicContact CD1-CB 3.89Å; L60-V375 HydrophobicContact CD1-CG2 3.78Å; L60-V375 HydrophobicContact CD2-CB 4.24Å; L60-V375 HydrophobicContact CD2-CG1 3.98Å; I71-V375 HydrophobicContact CG2-CG1 4.17Å; I71-V375 HydrophobicContact CG2-CG2 4.34Å; W152-V375 HydrophobicContact CE3-CG2 4.44Å; W152-V375 HydrophobicContact CZ3-CG2 4.01Å; F372-V375 WeakPolarHBondContact O-CB 3.36Å; F372-V375 PolarHBondContact O-N 2.76Å; V375-D377 VanDerWaalsContact C-N 3.35Å; V375-A378 PolarHBondContact O-N 2.86Å; V375-M379 HydrophobicContact CG2-CG 4.49Å; V375-M379 WeakPolarHBondContact O-CB 3.47Å; V375-M379 WeakPolarHBondContact O-CG 3.42Å; V375-M379 PolarHBondContact O-N 3.44Å; V375-L393 HydrophobicContact CG2-CD1 4.32Å
376	A	97.1	Very high	96.8	Very high	44 Å²	44	46.9 Å²	46.9	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-64.1	-41.9	178.6	0	0	0	0	0	111.4	C68 E374 K380	C68-A376 HydrophobicContact CB-CB 3.94Å; E374-A376 PolarHBondContact O-N 3.1Å; E374-A376 VanDerWaalsContact O-N 3.1Å; A376-K380 WeakPolarHBondContact O-CB 3.33Å; A376-K380 PolarHBondContact O-N 2.77Å
377	D	97.8	Very high	96.8	Very high	89 Å²	89	46 Å²	46	48%	0.476	22%	0.218	S	C	.	.	H	α-helix	trans	-71.8	-40.5	178.1	-64	-39.6	0	0	0	111.3	Y370 E374 V375 M379 K380 R381	Y370-D377 HydrophobicContact CD1-CB 4.38Å; Y370-D377 HydrophobicContact CE1-CB 3.95Å; E374-D377 PolarHBondContact O-N 3.17Å; V375-D377 VanDerWaalsContact C-N 3.35Å; D377-M379 VanDerWaalsContact C-N 3.34Å; D377-M379 PolarHBondContact O-N 3.47Å; D377-K380 PolarHBondContact O-N 2.91Å; D377-R381 WeakPolarHBondContact O-CB 3.46Å; D377-R381 PolarHBondContact O-N 2.85Å
378	A	98	Very high	96.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56	-48.5	173.1	0	0	0	0	0	111.8	L97 Y370 E374 V375 R381 M382 V391 L393	L97-A378 HydrophobicContact CD1-CB 3.95Å; Y370-A378 HydrophobicContact CD1-CB 4.49Å; Y370-A378 HydrophobicContact CD2-CB 3.42Å; Y370-A378 VanDerWaalsContact CD2-CB 3.42Å; Y370-A378 HydrophobicContact CE2-CB 4.01Å; Y370-A378 HydrophobicContact CG-CB 3.69Å; E374-A378 PolarHBondContact O-N 2.93Å; V375-A378 PolarHBondContact O-N 2.86Å; A378-R381 PolarHBondContact O-N 3.26Å; A378-M382 PolarHBondContact O-N 2.99Å; A378-V391 HydrophobicContact CB-CG1 3.9Å; A378-L393 HydrophobicContact CB-CD2 3.68Å
379	M	96.4	Very high	96.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.1	-42	176.3	-78.3	-162.6	166.2	0	0	112.5	I71 L97 E101 L102 K105 L119 W152 V375 D377 R381 M382 H383	I71-M379 HydrophobicContact CD1-CE 3.2Å; I71-M379 HydrophobicContact CD1-SD 3.33Å; I71-M379 WeakPolarHBondContact CD1-SD 3.45Å; L97-M379 HydrophobicContact CD1-CG 3.97Å; E101-M379 HydrophobicContact CB-CE 4.37Å; L102-M379 HydrophobicContact CD2-CB 4.01Å; L102-M379 HydrophobicContact CD2-CG 3.98Å; L102-M379 HydrophobicContact CD2-SD 4.12Å; K105-M379 HydrophobicContact CD-CE 4.22Å; K105-M379 HydrophobicContact CD-SD 3.59Å; K105-M379 VanDerWaalsContact CD-SD 3.59Å; L119-M379 HydrophobicContact CD1-CE 4.23Å; W152-M379 HydrophobicContact CH2-CE 3.37Å; W152-M379 HydrophobicContact CZ3-CE 3.49Å; W152-M379 VanDerWaalsContact CZ3-CE 3.49Å; V375-M379 HydrophobicContact CG2-CG 4.49Å; V375-M379 WeakPolarHBondContact O-CB 3.47Å; V375-M379 WeakPolarHBondContact O-CG 3.42Å; V375-M379 PolarHBondContact O-N 3.44Å; D377-M379 VanDerWaalsContact C-N 3.34Å; D377-M379 PolarHBondContact O-N 3.47Å; M379-R381 VanDerWaalsContact C-N 3.34Å; M379-R381 PolarHBondContact O-N 3.04Å; M379-M382 PolarHBondContact O-N 2.95Å; M379-H383 VanDerWaalsContact O-CB 3.23Å; M379-H383 WeakPolarHBondContact O-CB 3.48Å; M379-H383 PolarHBondContact O-N 2.83Å
380	K	95.4	Very high	96.8	Very high	95 Å²	95	39.6 Å²	39.6	41%	0.413	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-44.3	178.4	-175	-176.2	-176.6	-55.7	0	111	A376 D377 M382 H383 D384	A376-K380 WeakPolarHBondContact O-CB 3.33Å; A376-K380 PolarHBondContact O-N 2.77Å; D377-K380 PolarHBondContact O-N 2.91Å; K380-M382 VanDerWaalsContact C-N 3.31Å; K380-M382 PolarHBondContact O-N 3.4Å; K380-H383 PolarHBondContact O-N 2.9Å; K380-D384 WeakPolarHBondContact CG-OD2 3.46Å; K380-D384 IonicContact NZ-OD2 3.7Å; K380-D384 PolarHBondContact NZ-OD2 2.84Å; K380-D384 WeakPolarHBondContact O-CB 3.42Å; K380-D384 PolarHBondContact O-N 3.28Å
381	R	96.8	Very high	96.8	Very high	69 Å²	69	37.6 Å²	37.6	26%	0.26	18%	0.183	S	C	.	.	H	α-helix	trans	-58.2	-41.3	179	-175.7	168.7	177.3	85	3.9	112.7	D367 Y370 D377 A378 M379 Q386 N387	D367-R381 IonicContact OD1-CZ 2.68Å; D367-R381 IonicContact OD1-NE 3.6Å; D367-R381 IonicContact OD1-NH2 2.7Å; D367-R381 PolarHBondContact OD1-NH2 3.25Å; D367-R381 WeakPolarHBondContact OD2-CD 3.48Å; D367-R381 IonicContact OD2-CZ 3.37Å; D367-R381 IonicContact OD2-NE 3.59Å; D367-R381 PolarHBondContact OD2-NE 2.95Å; D367-R381 IonicContact OD2-NH2 2.75Å; D367-R381 PolarHBondContact OD2-NH2 3.37Å; Y370-R381 WeakPolarHBondContact OH-CD 3.47Å; D377-R381 WeakPolarHBondContact O-CB 3.46Å; D377-R381 PolarHBondContact O-N 2.85Å; A378-R381 PolarHBondContact O-N 3.26Å; M379-R381 VanDerWaalsContact C-N 3.34Å; M379-R381 PolarHBondContact O-N 3.04Å; R381-Q386 HydrophobicContact CG-CB 4.24Å; R381-Q386 PolarHBondContact O-N 3.15Å; R381-N387 HydrophobicContact CG-CB 4.36Å; R381-N387 PolarHBondContact O-N 3.05Å
382	M	95.3	Very high	96.8	Very high	18 Å²	18	35.7 Å²	35.7	9%	0.089	17%	0.174	C	C	.	.	H	α-helix	trans	-73.5	-42.7	174.3	-175.9	173.7	-69.7	0	0	112.3	L97 L102 A378 M379 K380 D384 R385 V391	L97-M382 HydrophobicContact CD2-CB 3.99Å; L97-M382 HydrophobicContact CD2-CE 3.37Å; L97-M382 HydrophobicContact CD2-CG 4.25Å; L97-M382 HydrophobicContact CD2-SD 3.3Å; L97-M382 WeakPolarHBondContact CD2-SD 3.23Å; L97-M382 WeakPolarHBondContact O-CE 3.45Å; L102-M382 HydrophobicContact CD1-CB 4.29Å; L102-M382 HydrophobicContact CD1-CG 3.92Å; L102-M382 HydrophobicContact CD1-SD 4.16Å; A378-M382 PolarHBondContact O-N 2.99Å; M379-M382 PolarHBondContact O-N 2.95Å; K380-M382 VanDerWaalsContact C-N 3.31Å; K380-M382 PolarHBondContact O-N 3.4Å; M382-D384 VanDerWaalsContact C-N 3.32Å; M382-D384 PolarHBondContact O-N 3.38Å; M382-R385 WeakPolarHBondContact O-CA 3.21Å; M382-R385 PolarHBondContact O-N 3.19Å; M382-V391 HydrophobicContact CE-CB 4.46Å; M382-V391 HydrophobicContact CE-CG2 4.35Å
383	H	91.4	Very high	96.8	Very high	24 Å²	24	35.6 Å²	35.6	11%	0.111	17%	0.174	C	C	.	.	H	α-helix	trans	-59.1	-44.3	-179.3	-173.2	76.4	0	0	0	112	L102 V300 G302 M379 K380 R385	L102-H383 HydrophobicContact CD1-CB 4.29Å; V300-H383 VanDerWaalsContact CG1-CE1 3.42Å; V300-H383 WeakPolarHBondContact CG1-CE1 3.45Å; V300-H383 WeakPolarHBondContact CG1-ND1 3.38Å; G302-H383 VanDerWaalsContact CA-NE2 3.35Å; G302-H383 WeakPolarHBondContact CA-NE2 3.33Å; G302-H383 PolarHBondContact O-CE1 3.38Å; M379-H383 VanDerWaalsContact O-CB 3.23Å; M379-H383 WeakPolarHBondContact O-CB 3.48Å; M379-H383 PolarHBondContact O-N 2.83Å; K380-H383 PolarHBondContact O-N 2.9Å; H383-R385 PolarHBondContact O-N 3.09Å
384	D	92.8	Very high	96.9	Very high	61 Å²	61	32.7 Å²	32.7	33%	0.326	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	3.9	178.3	-64	-8.9	0	0	0	112.4	K380 M382 Q386	K380-D384 WeakPolarHBondContact CG-OD2 3.46Å; K380-D384 IonicContact NZ-OD2 3.7Å; K380-D384 PolarHBondContact NZ-OD2 2.84Å; K380-D384 WeakPolarHBondContact O-CB 3.42Å; K380-D384 PolarHBondContact O-N 3.28Å; M382-D384 VanDerWaalsContact C-N 3.32Å; M382-D384 PolarHBondContact O-N 3.38Å; D384-Q386 HydrophobicContact CB-CG 3.97Å; D384-Q386 PolarHBondContact O-N 3.22Å
385	R	93	Very high	96.8	Very high	57 Å²	57	31 Å²	31	22%	0.215	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	34	179.4	-49	-178.8	-177.5	-157.8	0.3	111.9	K234 A297 M382 H383	K234-R385 PolarHBondContact NZ-O 3.35Å; A297-R385 PolarHBondContact O-NH2 3.4Å; M382-R385 WeakPolarHBondContact O-CA 3.21Å; M382-R385 PolarHBondContact O-N 3.19Å; H383-R385 PolarHBondContact O-N 3.09Å
386	Q	96	Very high	96.6	Very high	105 Å²	105	36.3 Å²	36.3	49%	0.491	18%	0.178	S	C	.	.			trans	-83.8	-29.6	-179.3	-70.6	-176.7	-33.9	0	0	111.8	K234 R381 D384	K234-Q386 WeakPolarHBondContact CE-O 3.47Å; K234-Q386 PolarHBondContact NZ-O 3.4Å; R381-Q386 HydrophobicContact CG-CB 4.24Å; R381-Q386 PolarHBondContact O-N 3.15Å; D384-Q386 HydrophobicContact CB-CG 3.97Å; D384-Q386 PolarHBondContact O-N 3.22Å
387	N	98	Very high	96.3	Very high	12 Å²	12	37.2 Å²	37.2	6%	0.064	18%	0.18	C	C	.	.			trans	-57.5	140.6	180	67.5	-63.6	0	0	0	114	K234 D367 R381 G389 V391	K234-N387 PolarHBondContact NZ-O 3.39Å; D367-N387 HydrophobicContact CB-CB 4.22Å; D367-N387 VanDerWaalsContact CG-CA 3.48Å; D367-N387 WeakPolarHBondContact OD1-CA 3.29Å; D367-N387 VanDerWaalsContact OD2-CA 3.23Å; D367-N387 WeakPolarHBondContact OD2-CA 3.42Å; D367-N387 WeakPolarHBondContact OD2-CB 3.13Å; R381-N387 HydrophobicContact CG-CB 4.36Å; R381-N387 PolarHBondContact O-N 3.05Å; N387-G389 PolarHBondContact ND2-O 3.05Å; N387-V391 HydrophobicContact CB-CG2 3.82Å
388	I	98.3	Very high	96	Very high	32 Å²	32	38.2 Å²	38.2	16%	0.164	18%	0.18	C	C	.	.	S	Bend	trans	-113.7	105.5	162.8	-57.8	175.3	0	0	0	106	A207 I212 K234 T237 H365 D367	A207-I388 HydrophobicContact CB-CG2 4.39Å; A207-I388 CarbonylContact O-C 3.6Å; A207-I388 VanDerWaalsContact O-CA 3.31Å; A207-I388 WeakPolarHBondContact O-CA 3.36Å; I212-I388 HydrophobicContact CD1-CG2 4.07Å; K234-I388 HydrophobicContact CB-CD1 4.35Å; K234-I388 HydrophobicContact CD-CD1 4.39Å; K234-I388 HydrophobicContact CD-CG1 3.91Å; K234-I388 HydrophobicContact CG-CD1 3.93Å; K234-I388 HydrophobicContact CG-CG1 4.03Å; T237-I388 HydrophobicContact CG2-CG2 3.79Å; H365-I388 PolarHBondContact CD2-O 3.46Å; D367-I388 WeakPolarHBondContact CA-O 3.41Å; D367-I388 WeakPolarHBondContact CB-O 3.18Å; D367-I388 PolarHBondContact OD1-N 3.08Å
389	G	98.3	Very high	95.4	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.01	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	89.8	-151.3	-172.4	0	0	0	0	0	114.5	A207 H365 N387	A207-G389 PolarHBondContact O-N 3.29Å; H365-G389 CarbonylContact O-C 3.56Å; H365-G389 WeakPolarHBondContact O-CA 3.44Å; N387-G389 PolarHBondContact ND2-O 3.05Å
390	K	98.7	Very high	94.3	Very high	3 Å²	3	50.1 Å²	50.1	1%	0.013	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	130.9	-170.7	-166.2	83.8	179.5	-170.2	0	112.2	L97 N98 E122 A177 N181 H365 I366 D367 I392	L97-K390 WeakPolarHBondContact O-CE 3.46Å; N98-K390 PolarHBondContact OD1-NZ 3.15Å; E122-K390 WeakPolarHBondContact OE1-CE 3.43Å; E122-K390 IonicContact OE1-NZ 3.77Å; E122-K390 PolarHBondContact OE1-NZ 3.29Å; E122-K390 IonicContact OE2-NZ 3.59Å; A177-K390 HydrophobicContact CB-CB 3.67Å; A177-K390 HydrophobicContact CB-CD 4.17Å; A177-K390 HydrophobicContact CB-CG 3.62Å; N181-K390 WeakPolarHBondContact ND2-CD 3.38Å; H365-K390 PolarHBondContact O-N 2.96Å; I366-K390 HydrophobicContact CD1-CB 4.33Å; D367-K390 VanDerWaalsContact CB-O 3.3Å; D367-K390 WeakPolarHBondContact CB-O 3.26Å; D367-K390 PolarHBondContact N-O 3.17Å; K390-I392 HydrophobicContact CG-CD1 3.73Å; K390-I392 HydrophobicContact CG-CG1 4.39Å
391	V	98.8	Very high	92.4	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.6	165.4	-179.5	0	0	0	0	108.8	L97 Y370 A378 M382 N387	L97-V391 HydrophobicContact CB-CB 4.25Å; L97-V391 HydrophobicContact CB-CG1 4.4Å; L97-V391 WeakPolarHBondContact CB-O 3.37Å; L97-V391 HydrophobicContact CD1-CG1 4.36Å; L97-V391 PolarHBondContact N-O 2.88Å; L97-V391 VanDerWaalsContact N-O 3.07Å; Y370-V391 HydrophobicContact CD2-CG1 3.76Å; Y370-V391 HydrophobicContact CE2-CG1 3.95Å; A378-V391 HydrophobicContact CB-CG1 3.9Å; M382-V391 HydrophobicContact CE-CB 4.46Å; M382-V391 HydrophobicContact CE-CG2 4.35Å; N387-V391 HydrophobicContact CB-CG2 3.82Å
392	I	98.8	Very high	90	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139	-178	-62.6	-63.8	0	0	0	110.5	A94 C95 E173 A176 A177 I366 S368 R369 Y370 K390 L394	A94-I392 HydrophobicContact CB-CG2 3.88Å; C95-I392 WeakPolarHBondContact O-CA 3.47Å; E173-I392 HydrophobicContact CB-CG1 4.27Å; E173-I392 HydrophobicContact CB-CG2 4.43Å; E173-I392 HydrophobicContact CG-CG2 4.04Å; A176-I392 HydrophobicContact CB-CD1 4.22Å; A177-I392 HydrophobicContact CB-CD1 4.23Å; I366-I392 HydrophobicContact CD1-CD1 4.24Å; I366-I392 HydrophobicContact CD1-CG1 4.02Å; I366-I392 HydrophobicContact CG2-CG1 3.87Å; S368-I392 PolarHBondContact O-N 2.96Å; R369-I392 WeakPolarHBondContact CA-O 3.37Å; R369-I392 HydrophobicContact CG-CB 4.36Å; Y370-I392 PolarHBondContact N-O 2.87Å; K390-I392 HydrophobicContact CG-CD1 3.73Å; K390-I392 HydrophobicContact CG-CG1 4.39Å; I392-L394 HydrophobicContact CG2-CD2 3.88Å
393	L	98.8	Very high	87.5	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.7	168.5	-65.6	173.7	0	0	0	110.3	L60 A94 C95 L97 W152 Y370 F372 V375 A378	L60-L393 HydrophobicContact CD1-CD1 4.04Å; A94-L393 CarbonylContact C-O 3.58Å; A94-L393 WeakPolarHBondContact CA-O 3.33Å; C95-L393 HydrophobicContact CB-CB 4.24Å; C95-L393 PolarHBondContact N-O 3.49Å; C95-L393 PolarHBondContact O-N 3.4Å; L97-L393 HydrophobicContact CD1-CD1 4.49Å; W152-L393 HydrophobicContact CD2-CD1 3.51Å; W152-L393 VanDerWaalsContact CE2-CD1 3.46Å; W152-L393 HydrophobicContact CE3-CD1 3.82Å; W152-L393 HydrophobicContact CG-CD1 4Å; W152-L393 HydrophobicContact CH2-CD1 4.09Å; W152-L393 HydrophobicContact CZ2-CD1 3.78Å; W152-L393 HydrophobicContact CZ3-CD1 4.11Å; Y370-L393 CarbonylContact O-C 3.55Å; Y370-L393 VanDerWaalsContact O-CA 3.25Å; Y370-L393 WeakPolarHBondContact O-CA 3.4Å; F372-L393 HydrophobicContact CD1-CB 4.11Å; F372-L393 HydrophobicContact CE1-CB 3.98Å; V375-L393 HydrophobicContact CG2-CD1 4.32Å; A378-L393 HydrophobicContact CB-CD2 3.68Å
394	L	98.7	Very high	84.9	Confident	28 Å²	28	66 Å²	66	15%	0.147	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.3	179	-60.1	-178.2	0	0	0	109.4	A94 E173 R369 Y370 F372 I392 E396	A94-L394 HydrophobicContact CB-CD2 4.25Å; E173-L394 HydrophobicContact CG-CD2 4.38Å; R369-L394 HydrophobicContact CB-CD1 4.06Å; R369-L394 HydrophobicContact CB-CG 4.41Å; Y370-L394 PolarHBondContact O-N 3.48Å; F372-L394 WeakPolarHBondContact CD1-O 3.43Å; F372-L394 PolarHBondContact N-O 3.28Å; I392-L394 HydrophobicContact CG2-CD2 3.88Å; L394-E396 PolarHBondContact O-N 2.69Å
395	P	97.1	Very high	82.4	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.019	34%	0.34	C	S	.	.			trans	-72.1	-14	175.7	-18.2	31.6	0	0	0	114	R58 V92 K93 E154 F372	R58-P395 PolarHBondContact NH2-O 3.17Å; V92-P395 HydrophobicContact CB-CG 4.09Å; V92-P395 HydrophobicContact CG1-CG 3.92Å; K93-P395 WeakPolarHBondContact O-CD 3.31Å; E154-P395 HydrophobicContact CB-CB 4.35Å; E154-P395 HydrophobicContact CG-CB 3.65Å; F372-P395 HydrophobicContact CD2-CB 4.36Å; F372-P395 HydrophobicContact CE1-CB 4.2Å; F372-P395 HydrophobicContact CE1-CG 3.98Å; F372-P395 HydrophobicContact CE2-CB 3.66Å; F372-P395 HydrophobicContact CE2-CG 4.17Å; F372-P395 HydrophobicContact CZ-CB 3.58Å; F372-P395 HydrophobicContact CZ-CG 3.55Å
396	E	92.8	Very high	80.1	Confident	121 Å²	121	73.5 Å²	73.5	57%	0.565	36%	0.361	S	S	*	.	S	Bend	trans	-68.2	140.4	175.4	-171.3	175.6	172.9	0	0	110	H371 L394	H371-E396 PolarHBondContact ND1-O 3.48Å; L394-E396 PolarHBondContact O-N 2.69Å
397	P	91.9	Very high	77.5	Confident	64 Å²	64	75.9 Å²	75.9	42%	0.416	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-61.9	142.7	174.7	-17.7	26.9	0	0	0	111.2	R58 K399	R58-P397 VanDerWaalsContact NH2-CA 3.29Å; P397-K399 PolarHBondContact O-N 2.85Å
398	K	90.9	Very high	75.1	Confident	109 Å²	109	79.7 Å²	79.7	47%	0.474	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-61.3	125.2	168.3	-170	173.3	-177.6	171.3	0	108.3	H371 E374 S400	H371-K398 HydrophobicContact CB-CB 4.15Å; E374-K398 IonicContact OE1-NZ 2.81Å; E374-K398 PolarHBondContact OE1-NZ 3.24Å; K398-S400 PolarHBondContact O-N 2.97Å
399	K	86.1	Confident	72.9	Confident	171 Å²	171	84.4 Å²	84.4	74%	0.743	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-62.3	127.4	174.7	-66.4	-179.9	-178.4	175.2	0	108	P397	P397-K399 PolarHBondContact O-N 2.85Å
400	S	73.1	Confident	70.8	Confident	80 Å²	80	87.4 Å²	87.4	56%	0.559	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-63.7	135.8	172.9	55.9	0	0	0	0	109.1	K398 E402	K398-S400 PolarHBondContact O-N 2.97Å; S400-E402 PolarHBondContact O-N 2.91Å; S400-E402 VanDerWaalsContact O-N 3.1Å; S400-E402 PolarHBondContact OG-OE2 2.93Å
401	E	55.6	Low	68.6	Low	162 Å²	162	93 Å²	93	76%	0.757	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	7.8	176.7	-70.1	-179.4	163.5	0	0	112.7	K403 S404	E401-K403 PolarHBondContact O-N 3.45Å; E401-K403 VanDerWaalsContact O-N 3.09Å; E401-S404 PolarHBondContact O-N 2.81Å; E401-S404 PolarHBondContact O-OG 2.84Å
402	E	46.6	Very low	66.6	Low	146 Å²	146	95.6 Å²	95.6	68%	0.682	49%	0.487	S	S	*	.	H	α-helix	trans	-68.4	-8.2	-177.5	-69.3	170.4	156.5	0	0	114.3	S400	S400-E402 PolarHBondContact O-N 2.91Å; S400-E402 VanDerWaalsContact O-N 3.1Å; S400-E402 PolarHBondContact OG-OE2 2.93Å
403	K	42.6	Very low	64.7	Low	165 Å²	165	101.9 Å²	101.9	72%	0.717	52%	0.516	S	S	*	.	H	α-helix	trans	-94.2	-3.2	176.1	-88.2	-173.6	175.5	-177.8	0	115.4	E401	E401-K403 PolarHBondContact O-N 3.45Å; E401-K403 VanDerWaalsContact O-N 3.09Å
404	S	36.6	Very low	62.7	Low	66 Å²	66	104.3 Å²	104.3	46%	0.462	54%	0.536	S	S	.	.	H	α-helix	trans	-85.6	-29.4	170.6	43.4	0	0	0	0	112.7	E401 T408	E401-S404 PolarHBondContact O-N 2.81Å; E401-S404 PolarHBondContact O-OG 2.84Å; S404-T408 WeakPolarHBondContact O-CB 3.46Å; S404-T408 PolarHBondContact O-N 3.45Å; S404-T408 PolarHBondContact O-OG1 2.84Å
405	E	40.8	Very low	60.9	Low	138 Å²	138	105.7 Å²	105.7	65%	0.645	55%	0.552	S	S	*	*	H	α-helix	trans	-71.4	-41.9	178.2	-71.9	180	166	0	0	111.4	K407 T408 E409	E405-K407 VanDerWaalsContact C-N 3.27Å; E405-K407 PolarHBondContact O-N 2.69Å; E405-T408 CarbonylContact O-C 3.55Å; E405-T408 PolarHBondContact O-N 2.74Å; E405-E409 PolarHBondContact O-N 2.99Å
406	E	43.9	Very low	59.4	Low	138 Å²	138	110.3 Å²	110.3	65%	0.645	57%	0.573	S	S	*	*	H	α-helix	trans	-63	-30.8	176.9	-133.5	178.4	-165.7	0	0	113.1	S410	E406-S410 WeakPolarHBondContact O-CB 3.48Å; E406-S410 PolarHBondContact O-N 2.97Å; E406-S410 VanDerWaalsContact O-N 3.14Å; E406-S410 PolarHBondContact O-OG 3.44Å
407	K	42	Very low	58.2	Low	155 Å²	155	109.6 Å²	109.6	67%	0.674	57%	0.573	S	S	*	*	H	α-helix	trans	-80.2	-24.3	173.2	-85.6	-172.9	175	-175	0	113.5	E405 S410 N411	E405-K407 VanDerWaalsContact C-N 3.27Å; E405-K407 PolarHBondContact O-N 2.69Å; K407-S410 WeakPolarHBondContact CA-OG 3.43Å; K407-S410 PolarHBondContact O-OG 2.67Å; K407-N411 WeakPolarHBondContact O-CB 3.27Å; K407-N411 PolarHBondContact O-N 3.27Å
408	T	47.6	Very low	57.1	Low	92 Å²	92	110.5 Å²	110.5	56%	0.564	58%	0.577	S	S	*	*	H	α-helix	trans	-84.8	-37.4	178.4	-47.7	0	0	0	0	110.2	S404 E405 N411 A412	S404-T408 WeakPolarHBondContact O-CB 3.46Å; S404-T408 PolarHBondContact O-N 3.45Å; S404-T408 PolarHBondContact O-OG1 2.84Å; E405-T408 CarbonylContact O-C 3.55Å; E405-T408 PolarHBondContact O-N 2.74Å; T408-N411 PolarHBondContact O-N 2.72Å; T408-A412 WeakPolarHBondContact O-CB 3.12Å; T408-A412 PolarHBondContact O-N 2.78Å
409	E	52.2	Low	55.9	Low	130 Å²	130	112 Å²	112	61%	0.607	59%	0.586	S	S	*	*	H	α-helix	trans	-67	-44.6	171.5	-74	-176.6	159	0	0	111.7	E405 N411 A412 E413	E405-E409 PolarHBondContact O-N 2.99Å; E409-N411 VanDerWaalsContact C-N 3.33Å; E409-N411 PolarHBondContact O-N 2.85Å; E409-A412 PolarHBondContact O-N 2.91Å; E409-E413 WeakPolarHBondContact O-CB 3.13Å; E409-E413 WeakPolarHBondContact O-CG 3.04Å; E409-E413 PolarHBondContact O-N 3.25Å
410	S	52.6	Low	54.9	Low	64 Å²	64	109.7 Å²	109.7	45%	0.448	58%	0.576	S	S	.	*	H	α-helix	trans	-66.8	-31.1	175.9	54.8	0	0	0	0	113.7	E406 K407 A414	E406-S410 WeakPolarHBondContact O-CB 3.48Å; E406-S410 PolarHBondContact O-N 2.97Å; E406-S410 VanDerWaalsContact O-N 3.14Å; E406-S410 PolarHBondContact O-OG 3.44Å; K407-S410 WeakPolarHBondContact CA-OG 3.43Å; K407-S410 PolarHBondContact O-OG 2.67Å; S410-A414 VanDerWaalsContact O-CB 3.23Å; S410-A414 WeakPolarHBondContact O-CB 3.44Å; S410-A414 PolarHBondContact O-N 3.48Å; S410-A414 VanDerWaalsContact O-N 3.12Å
411	N	53.4	Low	54.6	Low	122 Å²	122	108.4 Å²	108.4	65%	0.652	57%	0.57	S	S	*	*	H	α-helix	trans	-76	-31.8	171.2	-96.9	-9.3	0	0	0	112.8	K407 T408 E409 A415	K407-N411 WeakPolarHBondContact O-CB 3.27Å; K407-N411 PolarHBondContact O-N 3.27Å; T408-N411 PolarHBondContact O-N 2.72Å; E409-N411 VanDerWaalsContact C-N 3.33Å; E409-N411 PolarHBondContact O-N 2.85Å; N411-A415 VanDerWaalsContact O-CB 3.32Å; N411-A415 WeakPolarHBondContact O-CB 3.23Å; N411-A415 PolarHBondContact O-N 3.47Å
412	A	57.2	Low	55	Low	54 Å²	54	107.2 Å²	107.2	45%	0.446	57%	0.565	S	S	.	*	H	α-helix	trans	-72.1	-43	176.1	0	0	0	0	0	111.4	T408 E409 A414 A415 E416	T408-A412 WeakPolarHBondContact O-CB 3.12Å; T408-A412 PolarHBondContact O-N 2.78Å; E409-A412 PolarHBondContact O-N 2.91Å; A412-A414 VanDerWaalsContact C-N 3.32Å; A412-A414 PolarHBondContact O-N 3.21Å; A412-A415 PolarHBondContact O-N 3.29Å; A412-E416 WeakPolarHBondContact O-CB 3.5Å; A412-E416 PolarHBondContact O-N 3.4Å
413	E	57.4	Low	55.9	Low	132 Å²	132	102.6 Å²	102.6	62%	0.617	55%	0.551	S	S	*	*	H	α-helix	trans	-65	-35.2	173	-76.1	-172.5	151.2	0	0	111.9	E409 N417	E409-E413 WeakPolarHBondContact O-CB 3.13Å; E409-E413 WeakPolarHBondContact O-CG 3.04Å; E409-E413 PolarHBondContact O-N 3.25Å; E413-N417 WeakPolarHBondContact O-CB 3.14Å; E413-N417 PolarHBondContact O-N 2.85Å; E413-N417 VanDerWaalsContact O-N 3.13Å; E413-N417 PolarHBondContact O-ND2 2.84Å
414	A	57.9	Low	56.9	Low	50 Å²	50	97 Å²	97	41%	0.413	54%	0.536	S	S	.	.	H	α-helix	trans	-68.4	-40.1	173.3	0	0	0	0	0	112	S410 A412 V418	S410-A414 VanDerWaalsContact O-CB 3.23Å; S410-A414 WeakPolarHBondContact O-CB 3.44Å; S410-A414 PolarHBondContact O-N 3.48Å; S410-A414 VanDerWaalsContact O-N 3.12Å; A412-A414 VanDerWaalsContact C-N 3.32Å; A412-A414 PolarHBondContact O-N 3.21Å; A414-V418 VanDerWaalsContact O-CG2 3.31Å; A414-V418 WeakPolarHBondContact O-CG2 3.29Å; A414-V418 PolarHBondContact O-N 2.81Å
415	A	60.4	Low	58.3	Low	58 Å²	58	98 Å²	98	48%	0.479	54%	0.539	S	S	.	.	H	α-helix	trans	-68.3	-42.5	177	0	0	0	0	0	112.3	N411 A412 N417 V418 E419	N411-A415 VanDerWaalsContact O-CB 3.32Å; N411-A415 WeakPolarHBondContact O-CB 3.23Å; N411-A415 PolarHBondContact O-N 3.47Å; A412-A415 PolarHBondContact O-N 3.29Å; A415-N417 VanDerWaalsContact C-N 3.32Å; A415-N417 PolarHBondContact O-N 2.86Å; A415-V418 PolarHBondContact O-N 2.97Å; A415-E419 PolarHBondContact O-N 2.84Å
416	E	64.9	Low	59.3	Low	100 Å²	100	94.3 Å²	94.3	47%	0.467	53%	0.529	S	S	.	.	H	α-helix	trans	-67.2	-32.7	178.8	-158.2	-170.9	152.4	0	0	112	A412 K420	A412-E416 WeakPolarHBondContact O-CB 3.5Å; A412-E416 PolarHBondContact O-N 3.4Å; E416-K420 WeakPolarHBondContact O-CB 3.5Å; E416-K420 WeakPolarHBondContact O-CG 3.34Å; E416-K420 PolarHBondContact O-N 2.98Å; E416-K420 WeakPolarHBondContact OE1-CE 3.29Å; E416-K420 IonicContact OE1-NZ 3.85Å; E416-K420 PolarHBondContact OE1-NZ 3.1Å
417	N	68.5	Low	60	Low	106 Å²	106	94 Å²	94	57%	0.567	53%	0.527	S	S	*	.	H	α-helix	trans	-71.7	-32.2	173.6	-82.2	-37.2	0	0	0	113.2	E413 A415 A421	E413-N417 WeakPolarHBondContact O-CB 3.14Å; E413-N417 PolarHBondContact O-N 2.85Å; E413-N417 VanDerWaalsContact O-N 3.13Å; E413-N417 PolarHBondContact O-ND2 2.84Å; A415-N417 VanDerWaalsContact C-N 3.32Å; A415-N417 PolarHBondContact O-N 2.86Å; N417-A421 WeakPolarHBondContact O-CB 3.37Å; N417-A421 PolarHBondContact O-N 2.81Å; N417-A421 VanDerWaalsContact O-N 3.11Å
418	V	68.1	Low	60.8	Low	83 Å²	83	94.3 Å²	94.3	50%	0.503	53%	0.529	S	S	.	.	H	α-helix	trans	-70.4	-43.2	173.6	173	0	0	0	0	110.3	A414 A415 K420 A421 E422	A414-V418 VanDerWaalsContact O-CG2 3.31Å; A414-V418 WeakPolarHBondContact O-CG2 3.29Å; A414-V418 PolarHBondContact O-N 2.81Å; A415-V418 PolarHBondContact O-N 2.97Å; V418-K420 PolarHBondContact O-N 3.12Å; V418-A421 PolarHBondContact O-N 3.36Å; V418-A421 VanDerWaalsContact O-N 3.16Å; V418-E422 WeakPolarHBondContact O-CG 3.46Å; V418-E422 PolarHBondContact O-N 2.77Å
419	E	66.3	Low	61.3	Low	141 Å²	141	97.3 Å²	97.3	66%	0.659	53%	0.534	S	S	*	.	H	α-helix	trans	-66.5	-38.6	-179.8	-153.7	172.2	-165.7	0	0	112	A415 E422 A423	A415-E419 PolarHBondContact O-N 2.84Å; E419-E422 PolarHBondContact O-N 3.1Å; E419-A423 WeakPolarHBondContact O-CB 3.41Å; E419-A423 PolarHBondContact O-N 2.9Å
420	K	66	Low	61.5	Low	121 Å²	121	97.7 Å²	97.7	53%	0.526	54%	0.535	S	S	.	.	H	α-helix	trans	-66.6	-35	171.3	-77.6	176	-173.6	157.9	0	113.1	E416 V418 A424	E416-K420 WeakPolarHBondContact O-CB 3.5Å; E416-K420 WeakPolarHBondContact O-CG 3.34Å; E416-K420 PolarHBondContact O-N 2.98Å; E416-K420 WeakPolarHBondContact OE1-CE 3.29Å; E416-K420 IonicContact OE1-NZ 3.85Å; E416-K420 PolarHBondContact OE1-NZ 3.1Å; V418-K420 PolarHBondContact O-N 3.12Å; K420-A424 WeakPolarHBondContact O-CB 3.24Å; K420-A424 PolarHBondContact O-N 2.92Å; K420-A424 VanDerWaalsContact O-N 3.11Å
421	A	65.5	Low	61.7	Low	54 Å²	54	99.7 Å²	99.7	45%	0.446	54%	0.541	S	S	.	.	H	α-helix	trans	-70.2	-36.9	176.2	0	0	0	0	0	111.9	N417 V418 V425	N417-A421 WeakPolarHBondContact O-CB 3.37Å; N417-A421 PolarHBondContact O-N 2.81Å; N417-A421 VanDerWaalsContact O-N 3.11Å; V418-A421 PolarHBondContact O-N 3.36Å; V418-A421 VanDerWaalsContact O-N 3.16Å; A421-V425 VanDerWaalsContact O-CG2 3.25Å; A421-V425 WeakPolarHBondContact O-CG2 3.21Å; A421-V425 PolarHBondContact O-N 2.77Å
422	E	64.1	Low	61.8	Low	137 Å²	137	96.6 Å²	96.6	64%	0.64	53%	0.533	S	S	*	.	H	α-helix	trans	-70	-39.8	175.8	-71.8	-173.8	163.3	0	0	112.2	V418 E419 V425 S426	V418-E422 WeakPolarHBondContact O-CG 3.46Å; V418-E422 PolarHBondContact O-N 2.77Å; E419-E422 PolarHBondContact O-N 3.1Å; E422-V425 PolarHBondContact O-N 3.15Å; E422-S426 PolarHBondContact O-N 2.99Å
423	A	65	Low	61.7	Low	48 Å²	48	96.9 Å²	96.9	40%	0.397	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-39.3	175	0	0	0	0	0	113	E419 V425 S426 E427	E419-A423 WeakPolarHBondContact O-CB 3.41Å; E419-A423 PolarHBondContact O-N 2.9Å; A423-V425 PolarHBondContact O-N 3.4Å; A423-S426 WeakPolarHBondContact CA-OG 3.24Å; A423-S426 PolarHBondContact O-N 3.11Å; A423-S426 PolarHBondContact O-OG 2.97Å; A423-E427 PolarHBondContact O-N 2.8Å
424	A	64.6	Low	61.6	Low	49 Å²	49	97.4 Å²	97.4	41%	0.405	54%	0.538	S	S	.	.	H	α-helix	trans	-69	-22.4	176.2	0	0	0	0	0	113.2	K420	K420-A424 WeakPolarHBondContact O-CB 3.24Å; K420-A424 PolarHBondContact O-N 2.92Å; K420-A424 VanDerWaalsContact O-N 3.11Å
425	V	66.2	Low	61.4	Low	87 Å²	87	103 Å²	103	53%	0.527	56%	0.555	S	S	.	*	H	α-helix	trans	-84	-30.3	174.7	173.4	0	0	0	0	111.3	A421 E422 A423 K429	A421-V425 VanDerWaalsContact O-CG2 3.25Å; A421-V425 WeakPolarHBondContact O-CG2 3.21Å; A421-V425 PolarHBondContact O-N 2.77Å; E422-V425 PolarHBondContact O-N 3.15Å; A423-V425 PolarHBondContact O-N 3.4Å; V425-K429 PolarHBondContact O-N 2.91Å
426	S	60.8	Low	61.2	Low	60 Å²	60	105.6 Å²	105.6	42%	0.42	57%	0.565	S	S	.	*	H	α-helix	trans	-72.4	-42.5	173.3	56.8	0	0	0	0	112.5	E422 A423 K428 K429 E430	E422-S426 PolarHBondContact O-N 2.99Å; A423-S426 WeakPolarHBondContact CA-OG 3.24Å; A423-S426 PolarHBondContact O-N 3.11Å; A423-S426 PolarHBondContact O-OG 2.97Å; S426-K428 PolarHBondContact O-N 3.42Å; S426-K429 WeakPolarHBondContact O-CB 3.47Å; S426-K429 PolarHBondContact O-N 3.47Å; S426-E430 PolarHBondContact O-N 2.83Å
427	E	59.8	Low	60.6	Low	131 Å²	131	108.9 Å²	108.9	61%	0.612	58%	0.58	S	S	*	*	H	α-helix	trans	-62.5	-41.6	176.8	-76.4	-177.3	159.2	0	0	111.5	A423 K429 E430 D431	A423-E427 PolarHBondContact O-N 2.8Å; E427-K429 PolarHBondContact O-N 3.01Å; E427-E430 PolarHBondContact O-N 2.82Å; E427-D431 PolarHBondContact O-N 3.37Å
428	K	59.2	Low	60	Low	162 Å²	162	108.2 Å²	108.2	70%	0.704	59%	0.59	S	S	*	*	H	α-helix	trans	-66.2	-20.9	174.4	-79.6	-176.6	177.8	178.3	0	114.4	S426 A432	S426-K428 PolarHBondContact O-N 3.42Å; K428-A432 WeakPolarHBondContact O-CB 3.27Å; K428-A432 PolarHBondContact O-N 3.46Å
429	K	56.8	Low	59.2	Low	154 Å²	154	107.4 Å²	107.4	67%	0.67	60%	0.598	S	S	*	*	H	α-helix	trans	-84.6	-30.6	174.6	-92	-176.1	175.4	178.5	0	112.2	V425 S426 E427 A433	V425-K429 PolarHBondContact O-N 2.91Å; S426-K429 WeakPolarHBondContact O-CB 3.47Å; S426-K429 PolarHBondContact O-N 3.47Å; E427-K429 PolarHBondContact O-N 3.01Å; K429-A433 WeakPolarHBondContact O-CB 3.47Å; K429-A433 PolarHBondContact O-N 3.41Å
430	E	56.8	Low	58.6	Low	138 Å²	138	109.5 Å²	109.5	65%	0.645	61%	0.605	S	S	*	*	H	α-helix	trans	-72.9	-43.1	173.5	-79.6	-178.3	150.8	0	0	111.3	S426 E427 A432 A433 E434	S426-E430 PolarHBondContact O-N 2.83Å; E427-E430 PolarHBondContact O-N 2.82Å; E430-A432 VanDerWaalsContact C-N 3.29Å; E430-A432 PolarHBondContact O-N 3.03Å; E430-A433 WeakPolarHBondContact O-CB 3.34Å; E430-A433 PolarHBondContact O-N 3.01Å; E430-E434 PolarHBondContact O-N 2.93Å
431	D	56.3	Low	57.6	Low	106 Å²	106	115.2 Å²	115.2	57%	0.567	64%	0.641	S	S	*	*	H	α-helix	trans	-61.4	-36.7	175	-77.2	-23.2	0	0	0	112.3	E427 A433 E435	E427-D431 PolarHBondContact O-N 3.37Å; D431-A433 VanDerWaalsContact C-N 3.3Å; D431-A433 PolarHBondContact O-N 2.83Å; D431-E435 PolarHBondContact O-N 2.86Å
432	A	55.7	Low	57.2	Low	58 Å²	58	118.3 Å²	118.3	48%	0.479	65%	0.651	S	S	.	*	H	α-helix	trans	-75	-16.9	176	0	0	0	0	0	113.5	K428 E430 V436	K428-A432 WeakPolarHBondContact O-CB 3.27Å; K428-A432 PolarHBondContact O-N 3.46Å; E430-A432 VanDerWaalsContact C-N 3.29Å; E430-A432 PolarHBondContact O-N 3.03Å; A432-V436 WeakPolarHBondContact O-CG2 3.36Å
433	A	55.4	Low	56.9	Low	60 Å²	60	117.3 Å²	117.3	50%	0.496	65%	0.651	S	S	.	*	H	α-helix	trans	-86.5	-35.4	175.5	0	0	0	0	0	111.6	K429 E430 D431 V436 E437	K429-A433 WeakPolarHBondContact O-CB 3.47Å; K429-A433 PolarHBondContact O-N 3.41Å; E430-A433 WeakPolarHBondContact O-CB 3.34Å; E430-A433 PolarHBondContact O-N 3.01Å; D431-A433 VanDerWaalsContact C-N 3.3Å; D431-A433 PolarHBondContact O-N 2.83Å; A433-V436 PolarHBondContact O-N 3.01Å; A433-E437 PolarHBondContact O-N 2.96Å
434	E	54.8	Low	56.4	Low	143 Å²	143	121.2 Å²	121.2	67%	0.668	67%	0.666	S	S	*	*	H	α-helix	trans	-68.6	-33.7	174.5	-89.3	-169.5	150.8	0	0	113	E430 V436 E437 A438	E430-E434 PolarHBondContact O-N 2.93Å; E434-V436 VanDerWaalsContact C-N 3.25Å; E434-V436 PolarHBondContact O-N 2.94Å; E434-E437 PolarHBondContact O-N 3.21Å; E434-A438 PolarHBondContact O-N 3.36Å
435	E	53.9	Low	55.9	Low	167 Å²	167	125.4 Å²	125.4	78%	0.78	68%	0.681	S	S	*	*	H	α-helix	trans	-69.4	-19	174.3	-86	-168	156.7	0	0	113.8	D431	D431-E435 PolarHBondContact O-N 2.86Å
436	V	55.8	Low	55.3	Low	113 Å²	113	127.8 Å²	127.8	69%	0.685	69%	0.691	S	S	*	*	H	α-helix	trans	-88.3	-22.8	177.4	178.8	0	0	0	0	111.9	A432 A433 E434	A432-V436 WeakPolarHBondContact O-CG2 3.36Å; A433-V436 PolarHBondContact O-N 3.01Å; E434-V436 VanDerWaalsContact C-N 3.25Å; E434-V436 PolarHBondContact O-N 2.94Å
437	E	53.8	Low	54.9	Low	168 Å²	168	132.3 Å²	132.3	79%	0.785	71%	0.709	S	S	*	*	H	α-helix	trans	-85.3	-21.6	176.8	-118	-179.6	174.6	0	0	113.5	A433 E434 G439	A433-E437 PolarHBondContact O-N 2.96Å; E434-E437 PolarHBondContact O-N 3.21Å; E437-G439 VanDerWaalsContact C-N 3.31Å; E437-G439 PolarHBondContact O-N 3.36Å
438	A	54.6	Low	54.6	Low	93 Å²	93	132.4 Å²	132.4	77%	0.769	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	2.4	176.6	0	0	0	0	0	115.1	E434	E434-A438 PolarHBondContact O-N 3.36Å
439	G	51.9	Low	54.2	Low	65 Å²	65	130.2 Å²	130.2	67%	0.67	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	10.9	-176.7	0	0	0	0	0	115.9	E437	E437-G439 VanDerWaalsContact C-N 3.31Å; E437-G439 PolarHBondContact O-N 3.36Å
440	K	54.6	Low	54	Low	185 Å²	185	128.2 Å²	128.2	80%	0.804	72%	0.72	S	S	*	*			trans	-122.7	77.6	174.4	-79.4	-177.5	178.2	172.6	0	110.8
441	D	44.3	Very low	53.7	Low	242 Å²	242	127.3 Å²	127.3	100%	1.294	73%	0.727	S	S	*	*			trans	-154.4	0	143.2	-94.3	-29	0	0	0	109.6

Retrieved 441 of 441 residues in 246.1 ms (Link to these results)

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