A0A087Y6Q3_POEFO Loading...

EPS8 signaling adaptor L3b

AlphaFold DB , UniProt , Accession A0A087Y6Q3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 657 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	33.9	Very low	251 Å²	251	160.5 Å²	160.5	100%	1.236	88%	0.876	S	S	*	*				0	108.3	0	-70.8	-170.2	174.8	0	0	107.4
2	L	34	Very low	34.2	Very low	186 Å²	186	157.1 Å²	157.1	97%	0.974	87%	0.867	S	S	*	*			trans	-90.9	128.7	179.9	-75.6	154.5	0	0	0	108.3
3	G	33.5	Very low	34.1	Very low	83 Å²	83	163.5 Å²	163.5	86%	0.856	87%	0.871	S	S	*	*			trans	-109.9	118	175.5	0	0	0	0	0	110.5
4	N	36	Very low	33.9	Very low	174 Å²	174	157.4 Å²	157.4	93%	0.93	87%	0.866	S	S	*	*			trans	-126.9	144.6	179.6	-141.8	8.9	0	0	0	108.1
5	G	32.8	Very low	33.8	Very low	66 Å²	66	161.1 Å²	161.1	68%	0.68	87%	0.87	S	S	*	*			trans	113.1	92.6	149.1	0	0	0	0	0	119.8
6	R	33.3	Very low	33.6	Very low	245 Å²	245	158.4 Å²	158.4	93%	0.925	87%	0.868	S	S	*	*				36.7	168.9	121.4	-67	-170.5	-177.1	-162.4	1.4	121.3
7	P	42.8	Very low	33.7	Very low	110 Å²	110	160.1 Å²	160.1	71%	0.714	87%	0.868	S	S	*	*			cis	-134.7	176.4	-31.1	33.2	-13.4	0	0	0	113.3
8	F	31	Very low	33.6	Very low	216 Å²	216	161.4 Å²	161.4	95%	0.947	87%	0.867	S	S	*	*			trans	-123.3	126.9	160.8	-88.6	-80.8	0	0	0	111.2
9	S	30.1	Very low	33.4	Very low	112 Å²	112	161.7 Å²	161.7	78%	0.783	87%	0.869	S	S	*	*			trans	-90.5	147.7	174.4	50.2	0	0	0	0	110.8
10	Y	30.6	Very low	33.5	Very low	218 Å²	218	163.9 Å²	163.9	86%	0.855	87%	0.87	S	S	*	*			trans	-113.1	129.3	170.9	-149.7	-95.7	0	0	0	109.1
11	S	30.6	Very low	33.6	Very low	105 Å²	105	162 Å²	162	73%	0.734	87%	0.867	S	S	*	*			trans	-128.3	129.3	168.4	-67.1	0	0	0	0	107.9
12	P	37.8	Very low	33.4	Very low	119 Å²	119	159.3 Å²	159.3	77%	0.773	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-88.8	123	-178.6	31.3	-28.2	0	0	0	111.3
13	R	32.4	Very low	33.4	Very low	241 Å²	241	161.9 Å²	161.9	91%	0.909	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-91.1	133.7	166.6	-100	-173.1	179.3	-157.2	0.4	109.8
14	G	32.1	Very low	33.1	Very low	78 Å²	78	169.9 Å²	169.9	80%	0.804	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-71.4	159.4	179	0	0	0	0	0	114.1
15	F	32.7	Very low	32.9	Very low	213 Å²	213	165.6 Å²	165.6	93%	0.934	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-101.6	131.2	175.5	-82.3	-86.1	0	0	0	110.9
16	S	30.1	Very low	32.7	Very low	118 Å²	118	173.1 Å²	173.1	83%	0.825	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-89.4	152.4	177.2	47.1	0	0	0	0	112.5
17	Q	34.5	Very low	32.6	Very low	187 Å²	187	169.2 Å²	169.2	87%	0.874	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-63.1	118.2	176.6	-176.6	177.2	24.6	0	0	112.5
18	E	31.9	Very low	32.1	Very low	183 Å²	183	171.5 Å²	171.5	86%	0.855	85%	0.849	S	S	*	*			trans	176.8	102.2	148.7	-101.6	169	-151	0	0	109.6
19	D	31.1	Very low	32	Very low	168 Å²	168	168.4 Å²	168.4	90%	0.898	84%	0.842	S	S	*	*			trans	-174.4	100.7	144	-95.3	-26.6	0	0	0	109
20	F	34.6	Very low	32	Very low	205 Å²	205	171.6 Å²	171.6	90%	0.899	85%	0.845	S	S	*	*			trans	-125.2	144.8	165.8	-93.5	-77.4	0	0	0	108.4
21	P	36	Very low	33.1	Very low	124 Å²	124	165.7 Å²	165.7	81%	0.805	83%	0.833	S	S	*	*			trans	-114.1	154.8	140.9	7.4	12.7	0	0	0	112.4
22	Q	33.6	Very low	33.1	Very low	194 Å²	194	169 Å²	169	91%	0.907	84%	0.835	S	S	*	*			trans	-77.7	157.4	-157.8	-73.8	147.8	-56.6	0	0	117.4
23	R	33.2	Very low	32.8	Very low	240 Å²	240	171.2 Å²	171.2	91%	0.906	83%	0.834	S	S	*	*			trans	-54.1	149.6	169.2	-69.2	-178.5	178.5	-167	-0.7	114.6
24	R	27.1	Very low	32.9	Very low	252 Å²	252	165.2 Å²	165.2	95%	0.951	83%	0.829	S	S	*	*			trans	-126.4	135.4	136	-86.9	-172	-175.8	172.6	2.7	110
25	A	32.3	Very low	32.8	Very low	84 Å²	84	169.5 Å²	169.5	69%	0.694	83%	0.833	S	S	*	*			trans	-98.9	145.1	176.5	0	0	0	0	0	110.2
26	F	28.8	Very low	33	Very low	223 Å²	223	167.5 Å²	167.5	98%	0.978	83%	0.831	S	S	*	*			trans	-153.6	146.1	146.9	-97.5	-75.5	0	0	0	109.7
27	H	30.5	Very low	33.3	Very low	163 Å²	163	171.3 Å²	171.3	76%	0.755	84%	0.836	S	S	*	*			trans	-95.5	158.8	-165	-116.1	-82.7	0	0	0	113.2
28	Q	34	Very low	33.2	Very low	159 Å²	159	174.1 Å²	174.1	74%	0.743	84%	0.838	S	S	*	*			trans	66.4	136.4	153.2	-78.6	166.5	-4.6	0	0	117.1
29	D	27.5	Very low	33.3	Very low	150 Å²	150	174.8 Å²	174.8	80%	0.802	84%	0.841	S	S	*	*			cis	-150	156.8	26.8	-86.2	-45.5	0	0	0	112.9
30	E	31.1	Very low	33.3	Very low	179 Å²	179	171.7 Å²	171.7	84%	0.836	83%	0.833	S	S	*	*			trans	-78.2	-176.8	173.5	-101.8	-144.7	147.4	0	0	114
31	P	53	Low	33.5	Very low	94 Å²	94	170.7 Å²	170.7	61%	0.61	83%	0.833	S	S	*	*			cis	-135.8	169.4	-14.9	25.3	-2.4	0	0	0	114.5
32	K	31.6	Very low	33.8	Very low	176 Å²	176	169.4 Å²	169.4	77%	0.765	83%	0.827	S	S	*	*				164.4	118.4	128.3	-92.9	-179	179.3	-172.9	0	113.8
33	E	31.3	Very low	34.6	Very low	165 Å²	165	170.9 Å²	170.9	77%	0.771	83%	0.825	S	S	*	*				48	106.2	129	-64.8	173.3	153.9	0	0	119
34	S	33.2	Very low	35.7	Very low	114 Å²	114	163 Å²	163	80%	0.797	80%	0.804	S	S	*	*				155.2	146.5	120.3	52.8	0	0	0	0	109.3
35	L	30.3	Very low	38.1	Very low	169 Å²	169	154.1 Å²	154.1	89%	0.885	78%	0.781	S	S	*	*			trans	104.8	50.3	-174.7	-54.8	173.8	0	0	0	115.5
36	L	38	Very low	40	Very low	170 Å²	170	153.1 Å²	153.1	89%	0.89	78%	0.779	S	S	*	*			trans	-129.8	91	156.1	-73.5	176.5	0	0	0	110
37	Q	36.2	Very low	41.4	Very low	199 Å²	199	152.1 Å²	152.1	93%	0.93	77%	0.768	S	S	*	*			trans	-170.8	74.3	140.1	-113.3	160.8	-9.2	0	0	110.2
38	R	32.1	Very low	42.6	Very low	245 Å²	245	146.8 Å²	146.8	93%	0.925	75%	0.749	S	S	*	*	S	Bend	trans	-105.1	122.5	147.8	-93.6	-174.6	171.2	-167.8	-2.7	106.4	S40	R38-S40 PolarHBondContact O-N 3.18Å; R38-S40 VanDerWaalsContact O-N 3.11Å
39	Q	34.9	Very low	44.3	Very low	197 Å²	197	141.6 Å²	141.6	92%	0.921	73%	0.726	S	S	*	*			trans	-46.7	114.7	174.1	-73.2	165.4	-19.8	0	0	110	M41	Q39-M41 PolarHBondContact O-N 3.27Å
40	S	30.4	Very low	46.8	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	72%	0.715	S	S	*	*			trans	-81.6	93.8	169.7	157.4	0	0	0	0	107.7	R38 S42	R38-S40 PolarHBondContact O-N 3.18Å; R38-S40 VanDerWaalsContact O-N 3.11Å; S40-S42 PolarHBondContact O-N 2.91Å
41	M	39.1	Very low	48.8	Very low	183 Å²	183	137.9 Å²	137.9	90%	0.901	70%	0.7	S	S	*	*			trans	-55.8	96	147.6	-74.2	-91.8	-85.4	0	0	106.2	Q39 R43	Q39-M41 PolarHBondContact O-N 3.27Å; M41-R43 PolarHBondContact O-N 2.88Å
42	S	42.3	Very low	49.4	Very low	97 Å²	97	139.6 Å²	139.6	68%	0.678	70%	0.7	S	S	*	*			trans	-65.5	106.9	177.5	53.8	0	0	0	0	107.1	S40 P44	S40-S42 PolarHBondContact O-N 2.91Å; S42-P44 VanDerWaalsContact O-N 3.16Å
43	R	49.3	Very low	51.7	Low	226 Å²	226	139.8 Å²	139.8	85%	0.853	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-47.4	123.9	175.2	-172.6	175.4	180	173.8	0.3	108	M41 S45	M41-R43 PolarHBondContact O-N 2.88Å; R43-S45 PolarHBondContact O-N 3.04Å
44	P	56.7	Low	54.1	Low	73 Å²	73	136.6 Å²	136.6	47%	0.474	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-56.5	136.2	-175	16.8	-26.7	0	0	0	109.4	S42 I49	S42-P44 VanDerWaalsContact O-N 3.16Å; P44-I49 HydrophobicContact CB-CD1 4.24Å; P44-I49 HydrophobicContact CB-CG1 3.78Å; P44-I49 HydrophobicContact CG-CD1 3.99Å; P44-I49 HydrophobicContact CG-CG1 3.88Å; P44-I49 WeakPolarHBondContact O-CD1 3.38Å
45	S	77.8	Confident	55.8	Low	67 Å²	67	137.3 Å²	137.3	47%	0.469	67%	0.67	S	S	.	*	P	Polyproline II helix	trans	-57	148.2	-179.6	73.2	0	0	0	0	110.2	R43 R47 S48 I49	R43-S45 PolarHBondContact O-N 3.04Å; S45-R47 PolarHBondContact O-N 3.17Å; S45-S48 PolarHBondContact N-OG 3.37Å; S45-S48 PolarHBondContact O-N 3.09Å; S45-S48 PolarHBondContact O-OG 3.01Å; S45-S48 WeakPolarHBondContact OG-CB 3.42Å; S45-S48 PolarHBondContact OG-N 3.47Å; S45-S48 PolarHBondContact OG-OG 2.74Å; S45-I49 WeakPolarHBondContact O-CG1 3.33Å; S45-I49 PolarHBondContact O-N 2.8Å
46	G	71	Confident	57.3	Low	62 Å²	62	136.6 Å²	136.6	64%	0.639	66%	0.657	S	S	*	*	H	α-helix	trans	-54.8	-30.5	176.5	0	0	0	0	0	112.9	Y50	G46-Y50 VanDerWaalsContact O-CB 3.29Å; G46-Y50 WeakPolarHBondContact O-CB 3.35Å; G46-Y50 PolarHBondContact O-N 3.01Å
47	R	59.5	Low	58.7	Low	203 Å²	203	130.2 Å²	130.2	77%	0.766	63%	0.628	S	S	*	*	H	α-helix	trans	-70.9	-43.3	175.4	-172.9	175.9	179.3	158.7	-0.9	112.8	S45 Y50 M51	S45-R47 PolarHBondContact O-N 3.17Å; R47-Y50 PolarHBondContact O-N 3.12Å; R47-M51 HydrophobicContact CG-CG 4.49Å; R47-M51 WeakPolarHBondContact O-CB 3.39Å; R47-M51 VanDerWaalsContact O-CG 3.28Å; R47-M51 WeakPolarHBondContact O-CG 3.45Å; R47-M51 PolarHBondContact O-N 3.23Å
48	S	54.9	Low	60.1	Low	50 Å²	50	124.8 Å²	124.8	35%	0.35	60%	0.603	S	S	.	*	H	α-helix	trans	-67.9	-40	177.3	61.3	0	0	0	0	111.3	S45 Y50 M51 Q52	S45-S48 PolarHBondContact N-OG 3.37Å; S45-S48 PolarHBondContact O-N 3.09Å; S45-S48 PolarHBondContact O-OG 3.01Å; S45-S48 WeakPolarHBondContact OG-CB 3.42Å; S45-S48 PolarHBondContact OG-N 3.47Å; S45-S48 PolarHBondContact OG-OG 2.74Å; S48-Y50 VanDerWaalsContact C-N 3.34Å; S48-Y50 PolarHBondContact O-N 3.43Å; S48-M51 PolarHBondContact O-N 3.03Å; S48-Q52 VanDerWaalsContact O-CB 3.25Å; S48-Q52 WeakPolarHBondContact O-CB 3.16Å; S48-Q52 PolarHBondContact O-N 3.23Å
49	I	69.9	Low	61.2	Low	50 Å²	50	116.5 Å²	116.5	26%	0.256	58%	0.58	S	S	.	*	H	α-helix	trans	-60.7	-44.9	172.9	-61.2	172.2	0	0	0	110.4	P44 S45 R53	P44-I49 HydrophobicContact CB-CD1 4.24Å; P44-I49 HydrophobicContact CB-CG1 3.78Å; P44-I49 HydrophobicContact CG-CD1 3.99Å; P44-I49 HydrophobicContact CG-CG1 3.88Å; P44-I49 WeakPolarHBondContact O-CD1 3.38Å; S45-I49 WeakPolarHBondContact O-CG1 3.33Å; S45-I49 PolarHBondContact O-N 2.8Å; I49-R53 HydrophobicContact CG2-CG 4.46Å; I49-R53 WeakPolarHBondContact O-CB 3.4Å; I49-R53 WeakPolarHBondContact O-CG 3.35Å; I49-R53 PolarHBondContact O-N 3.41Å
50	Y	80.2	Confident	62.2	Low	147 Å²	147	111.7 Å²	111.7	58%	0.576	56%	0.56	S	S	*	*	H	α-helix	trans	-65.3	-45.3	179.2	176	-96.6	0	0	0	112.5	G46 R47 S48 R53 K54	G46-Y50 VanDerWaalsContact O-CB 3.29Å; G46-Y50 WeakPolarHBondContact O-CB 3.35Å; G46-Y50 PolarHBondContact O-N 3.01Å; R47-Y50 PolarHBondContact O-N 3.12Å; S48-Y50 VanDerWaalsContact C-N 3.34Å; S48-Y50 PolarHBondContact O-N 3.43Å; Y50-R53 PolarHBondContact O-N 3.47Å; Y50-K54 HydrophobicContact CE1-CD 4.36Å; Y50-K54 WeakPolarHBondContact O-CB 3.43Å; Y50-K54 PolarHBondContact O-N 3.03Å
51	M	72.3	Confident	63.3	Low	105 Å²	105	114.2 Å²	114.2	52%	0.517	56%	0.56	S	S	.	*	H	α-helix	trans	-64.2	-43.8	178.7	-70.3	-68.5	-73.9	0	0	111.4	R47 S48 R53 K54 E55	R47-M51 HydrophobicContact CG-CG 4.49Å; R47-M51 WeakPolarHBondContact O-CB 3.39Å; R47-M51 VanDerWaalsContact O-CG 3.28Å; R47-M51 WeakPolarHBondContact O-CG 3.45Å; R47-M51 PolarHBondContact O-N 3.23Å; S48-M51 PolarHBondContact O-N 3.03Å; M51-R53 VanDerWaalsContact C-N 3.33Å; M51-R53 PolarHBondContact O-N 2.99Å; M51-K54 PolarHBondContact O-N 3.13Å; M51-E55 WeakPolarHBondContact O-CB 3.32Å; M51-E55 PolarHBondContact O-N 3.47Å
52	Q	66.6	Low	64	Low	130 Å²	130	112.8 Å²	112.8	61%	0.607	55%	0.549	S	S	*	.	H	α-helix	trans	-62.4	-39.4	175.4	-170.6	179.7	3.8	0	0	111.8	S48 Y56	S48-Q52 VanDerWaalsContact O-CB 3.25Å; S48-Q52 WeakPolarHBondContact O-CB 3.16Å; S48-Q52 PolarHBondContact O-N 3.23Å; Q52-Y56 WeakPolarHBondContact O-CB 3.47Å; Q52-Y56 PolarHBondContact O-N 2.97Å
53	R	80.6	Confident	64.6	Low	179 Å²	179	112.8 Å²	112.8	68%	0.675	54%	0.541	S	S	*	.	H	α-helix	trans	-67.9	-37.5	174.4	-75.6	175.5	178.9	-170.4	-1.4	112.7	I49 Y50 M51 A57	I49-R53 HydrophobicContact CG2-CG 4.46Å; I49-R53 WeakPolarHBondContact O-CB 3.4Å; I49-R53 WeakPolarHBondContact O-CG 3.35Å; I49-R53 PolarHBondContact O-N 3.41Å; Y50-R53 PolarHBondContact O-N 3.47Å; M51-R53 VanDerWaalsContact C-N 3.33Å; M51-R53 PolarHBondContact O-N 2.99Å; R53-A57 VanDerWaalsContact O-CB 3.31Å; R53-A57 WeakPolarHBondContact O-CB 3.37Å; R53-A57 PolarHBondContact O-N 3.45Å
54	K	80.5	Confident	64.7	Low	98 Å²	98	107.1 Å²	107.1	43%	0.426	53%	0.533	S	S	.	.	H	α-helix	trans	-66.8	-45.8	176.9	-178.2	-178.5	171.4	-172.5	0	110.5	Y50 M51 A57 E58	Y50-K54 HydrophobicContact CE1-CD 4.36Å; Y50-K54 WeakPolarHBondContact O-CB 3.43Å; Y50-K54 PolarHBondContact O-N 3.03Å; M51-K54 PolarHBondContact O-N 3.13Å; K54-A57 PolarHBondContact O-N 3.19Å; K54-E58 WeakPolarHBondContact CE-OE1 3.33Å; K54-E58 IonicContact NZ-OE1 3.97Å; K54-E58 WeakPolarHBondContact O-CG 3.35Å; K54-E58 PolarHBondContact O-N 3.36Å
55	E	69.1	Low	64.6	Low	130 Å²	130	109.3 Å²	109.3	61%	0.607	54%	0.541	S	S	*	.	H	α-helix	trans	-62.4	-47.4	175.3	-177.4	172.7	-156.5	0	0	111.4	M51 A57 E58 T59	M51-E55 WeakPolarHBondContact O-CB 3.32Å; M51-E55 PolarHBondContact O-N 3.47Å; E55-A57 VanDerWaalsContact C-N 3.3Å; E55-A57 PolarHBondContact O-N 2.8Å; E55-E58 CarbonylContact O-C 3.53Å; E55-E58 WeakPolarHBondContact O-CA 3.45Å; E55-E58 WeakPolarHBondContact O-CB 3.26Å; E55-E58 PolarHBondContact O-N 2.92Å; E55-T59 PolarHBondContact O-N 3.04Å; E55-T59 PolarHBondContact O-OG1 2.84Å
56	Y	62.5	Low	64	Low	154 Å²	154	109.8 Å²	109.8	60%	0.604	54%	0.544	S	S	*	.	H	α-helix	trans	-55.5	-45.4	174.1	179.8	-106.9	0	0	0	112	Q52 E58 T59 L60	Q52-Y56 WeakPolarHBondContact O-CB 3.47Å; Q52-Y56 PolarHBondContact O-N 2.97Å; Y56-E58 PolarHBondContact O-N 3.45Å; Y56-T59 VanDerWaalsContact C-OG1 3.32Å; Y56-T59 VanDerWaalsContact CA-OG1 3.24Å; Y56-T59 WeakPolarHBondContact CA-OG1 3.45Å; Y56-T59 PolarHBondContact O-N 2.69Å; Y56-T59 PolarHBondContact O-OG1 2.81Å; Y56-L60 HydrophobicContact CD1-CD1 3.85Å; Y56-L60 HydrophobicContact CE1-CD1 3.42Å; Y56-L60 VanDerWaalsContact CE1-CD1 3.42Å; Y56-L60 HydrophobicContact CE1-CG 4.24Å; Y56-L60 WeakPolarHBondContact O-CG 3.46Å; Y56-L60 PolarHBondContact O-N 3.48Å
57	A	66.4	Low	64.5	Low	35 Å²	35	108 Å²	108	29%	0.289	52%	0.519	S	S	.	.	H	α-helix	trans	-62.7	-41	174.6	0	0	0	0	0	111.7	R53 K54 E55 L60 H61	R53-A57 VanDerWaalsContact O-CB 3.31Å; R53-A57 WeakPolarHBondContact O-CB 3.37Å; R53-A57 PolarHBondContact O-N 3.45Å; K54-A57 PolarHBondContact O-N 3.19Å; E55-A57 VanDerWaalsContact C-N 3.3Å; E55-A57 PolarHBondContact O-N 2.8Å; A57-L60 PolarHBondContact O-N 3.25Å; A57-H61 PolarHBondContact O-N 2.88Å; A57-H61 VanDerWaalsContact O-N 3.09Å; A57-H61 PolarHBondContact O-ND1 3.27Å
58	E	65.3	Low	65.9	Low	85 Å²	85	103.5 Å²	103.5	40%	0.397	51%	0.507	S	S	.	.	H	α-helix	trans	-67.3	-36.7	176.9	-73.8	174.8	-170.2	0	0	112.6	K54 E55 Y56 H61 K62	K54-E58 WeakPolarHBondContact CE-OE1 3.33Å; K54-E58 IonicContact NZ-OE1 3.97Å; K54-E58 WeakPolarHBondContact O-CG 3.35Å; K54-E58 PolarHBondContact O-N 3.36Å; E55-E58 CarbonylContact O-C 3.53Å; E55-E58 WeakPolarHBondContact O-CA 3.45Å; E55-E58 WeakPolarHBondContact O-CB 3.26Å; E55-E58 PolarHBondContact O-N 2.92Å; Y56-E58 PolarHBondContact O-N 3.45Å; E58-H61 PolarHBondContact O-N 3.47Å; E58-K62 WeakPolarHBondContact O-CB 3.07Å; E58-K62 VanDerWaalsContact O-CG 3.28Å; E58-K62 WeakPolarHBondContact O-CG 3.27Å; E58-K62 PolarHBondContact O-N 2.98Å
59	T	55.3	Low	67.7	Low	71 Å²	71	102 Å²	102	44%	0.436	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-40.5	171.6	28.2	0	0	0	0	112.6	E55 Y56 H61 K62 N63	E55-T59 PolarHBondContact O-N 3.04Å; E55-T59 PolarHBondContact O-OG1 2.84Å; Y56-T59 VanDerWaalsContact C-OG1 3.32Å; Y56-T59 VanDerWaalsContact CA-OG1 3.24Å; Y56-T59 WeakPolarHBondContact CA-OG1 3.45Å; Y56-T59 PolarHBondContact O-N 2.69Å; Y56-T59 PolarHBondContact O-OG1 2.81Å; T59-H61 PolarHBondContact O-N 3.24Å; T59-K62 PolarHBondContact O-N 2.85Å; T59-N63 PolarHBondContact O-N 2.77Å
60	L	56.4	Low	68.9	Low	96 Å²	96	104.3 Å²	104.3	50%	0.503	50%	0.501	S	S	.	.	H	α-helix	trans	-61.3	-33.5	173.3	-74.4	171.8	0	0	0	112.3	Y56 A57	Y56-L60 HydrophobicContact CD1-CD1 3.85Å; Y56-L60 HydrophobicContact CE1-CD1 3.42Å; Y56-L60 VanDerWaalsContact CE1-CD1 3.42Å; Y56-L60 HydrophobicContact CE1-CG 4.24Å; Y56-L60 WeakPolarHBondContact O-CG 3.46Å; Y56-L60 PolarHBondContact O-N 3.48Å; A57-L60 PolarHBondContact O-N 3.25Å
61	H	54.7	Low	69.6	Low	158 Å²	158	97.5 Å²	97.5	73%	0.731	48%	0.475	S	S	*	.	H	α-helix	trans	-83.7	-26.6	177.8	-70.4	104.1	0	0	0	113.9	A57 E58 T59	A57-H61 PolarHBondContact O-N 2.88Å; A57-H61 VanDerWaalsContact O-N 3.09Å; A57-H61 PolarHBondContact O-ND1 3.27Å; E58-H61 PolarHBondContact O-N 3.47Å; T59-H61 PolarHBondContact O-N 3.24Å
62	K	53.8	Low	70.7	Confident	153 Å²	153	95 Å²	95	67%	0.665	46%	0.461	S	S	*	.	H	α-helix	trans	-76.9	-37.8	-179.5	-79.6	173.3	-178.7	175	0	112.6	E58 T59 P64	E58-K62 WeakPolarHBondContact O-CB 3.07Å; E58-K62 VanDerWaalsContact O-CG 3.28Å; E58-K62 WeakPolarHBondContact O-CG 3.27Å; E58-K62 PolarHBondContact O-N 2.98Å; T59-K62 PolarHBondContact O-N 2.85Å; K62-P64 VanDerWaalsContact C-CD 3.48Å; K62-P64 WeakPolarHBondContact O-CD 3.48Å
63	N	53.4	Low	72	Confident	97 Å²	97	90.2 Å²	90.2	52%	0.519	44%	0.439	S	S	.	.			trans	-125.5	67.8	180	-62.8	-32.2	0	0	0	111	T59 D65 S66	T59-N63 PolarHBondContact O-N 2.77Å; N63-D65 PolarHBondContact O-N 3.32Å; N63-S66 PolarHBondContact O-N 3.42Å; N63-S66 PolarHBondContact O-OG 2.93Å
64	P	51.6	Low	72.7	Confident	106 Å²	106	82 Å²	82	69%	0.688	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.3	176.7	27.4	-35.1	0	0	0	113	K62	K62-P64 VanDerWaalsContact C-CD 3.48Å; K62-P64 WeakPolarHBondContact O-CD 3.48Å
65	D	54.4	Low	73.3	Confident	119 Å²	119	78.9 Å²	78.9	64%	0.636	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	1.3	177.4	-81.1	11.2	0	0	0	113.4	N63 F67 R189	N63-D65 PolarHBondContact O-N 3.32Å; D65-F67 PolarHBondContact O-N 3.04Å; D65-R189 IonicContact OD2-NH1 2.98Å; D65-R189 PolarHBondContact OD2-NH1 2.87Å; D65-R189 VanDerWaalsContact OD2-NH1 3.13Å
66	S	66.3	Low	74.5	Confident	77 Å²	77	76.1 Å²	76.1	54%	0.538	39%	0.385	S	S	.	.			trans	-75.2	97.7	175.6	62.7	0	0	0	0	110.2	N63 Q68	N63-S66 PolarHBondContact O-N 3.42Å; N63-S66 PolarHBondContact O-OG 2.93Å; S66-Q68 PolarHBondContact O-N 3.05Å
67	F	81.3	Confident	75.9	Confident	24 Å²	24	69.1 Å²	69.1	11%	0.105	36%	0.358	C	S	.	.			trans	-76.6	102.4	173.9	179.8	-90.1	0	0	0	109.5	D65 V69 L110 E111 I112 I179 D182 L183	D65-F67 PolarHBondContact O-N 3.04Å; F67-V69 HydrophobicContact CZ-CG2 4.45Å; F67-L110 HydrophobicContact CD1-CD2 4.25Å; F67-L110 HydrophobicContact CE1-CD2 3.28Å; F67-L110 HydrophobicContact CZ-CD2 3.93Å; F67-E111 VanDerWaalsContact O-CA 3.29Å; F67-E111 WeakPolarHBondContact O-CA 3.36Å; F67-E111 WeakPolarHBondContact O-CG 3.33Å; F67-I112 HydrophobicContact CB-CB 4.27Å; F67-I112 HydrophobicContact CB-CD1 3.86Å; F67-I112 HydrophobicContact CB-CG1 4.29Å; F67-I112 HydrophobicContact CD1-CB 4.05Å; F67-I112 HydrophobicContact CD1-CD1 3.27Å; F67-I112 HydrophobicContact CD1-CG1 3.35Å; F67-I112 HydrophobicContact CD2-CD1 4.26Å; F67-I112 HydrophobicContact CE1-CD1 3.6Å; F67-I112 HydrophobicContact CE1-CG1 3.74Å; F67-I112 HydrophobicContact CG-CD1 3.57Å; F67-I112 HydrophobicContact CG-CG1 4.07Å; F67-I112 HydrophobicContact CZ-CD1 4.26Å; F67-I112 PolarHBondContact O-N 3.37Å; F67-I179 HydrophobicContact CE2-CG2 4.07Å; F67-I179 HydrophobicContact CZ-CG2 3.63Å; F67-D182 HydrophobicContact CD2-CB 3.61Å; F67-D182 HydrophobicContact CE2-CB 3.57Å; F67-L183 HydrophobicContact CZ-CB 4.27Å
68	Q	89.3	Confident	77	Confident	110 Å²	110	72.5 Å²	72.5	51%	0.514	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	119	173.1	-173.1	179	59.8	0	0	108.7	S66 I109 L110 E111	S66-Q68 PolarHBondContact O-N 3.05Å; Q68-I109 HydrophobicContact CG-CG2 3.45Å; Q68-I109 VanDerWaalsContact CG-CG2 3.45Å; Q68-L110 WeakPolarHBondContact CA-O 3.39Å; Q68-E111 HydrophobicContact CB-CG 4.12Å; Q68-E111 HydrophobicContact CG-CB 4.28Å; Q68-E111 HydrophobicContact CG-CG 4.2Å; Q68-E111 PolarHBondContact NE2-OE2 3.49Å
69	V	92.9	Very high	78.1	Confident	18 Å²	18	70 Å²	70	11%	0.109	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.9	-174.4	-65.3	0	0	0	0	111.1	F67 V71 I109 L110 T174 I179	F67-V69 HydrophobicContact CZ-CG2 4.45Å; V69-V71 HydrophobicContact CG2-CG1 4.06Å; V69-I109 CarbonylContact O-C 3.57Å; V69-I109 WeakPolarHBondContact O-CA 3.5Å; V69-L110 HydrophobicContact CG2-CB 4.06Å; V69-L110 HydrophobicContact CG2-CD2 4.24Å; V69-L110 WeakPolarHBondContact CG2-O 3.38Å; V69-L110 PolarHBondContact N-O 3.2Å; V69-L110 PolarHBondContact O-N 2.92Å; V69-T174 HydrophobicContact CG1-CG2 4.17Å; V69-I179 HydrophobicContact CB-CD1 4.25Å; V69-I179 HydrophobicContact CB-CG1 4.43Å; V69-I179 HydrophobicContact CG1-CG1 4.25Å; V69-I179 HydrophobicContact CG2-CD1 3.94Å; V69-I179 HydrophobicContact CG2-CG1 4.14Å; V69-I179 HydrophobicContact CG2-CG2 4.17Å
70	R	93.7	Very high	79.1	Confident	98 Å²	98	70.1 Å²	70.1	37%	0.37	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.1	171.9	-169.9	-172.6	-178.5	117.7	-5.6	108.8	E107 I122 E173	R70-E107 IonicContact CZ-OE1 3.36Å; R70-E107 VanDerWaalsContact CZ-OE1 3.23Å; R70-E107 IonicContact CZ-OE2 2.92Å; R70-E107 IonicContact NE-OE1 3.13Å; R70-E107 PolarHBondContact NE-OE1 3.19Å; R70-E107 IonicContact NH2-OE1 2.77Å; R70-E107 PolarHBondContact NH2-OE1 2.79Å; R70-E107 IonicContact NH2-OE2 3.73Å; R70-E107 PolarHBondContact NH2-OE2 2.88Å; R70-I122 HydrophobicContact CG-CD1 4.19Å; R70-E173 WeakPolarHBondContact CB-OE2 3.47Å; R70-E173 WeakPolarHBondContact CD-OE2 3.08Å
71	V	95.1	Very high	79.4	Confident	5 Å²	5	71 Å²	71	3%	0.03	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	159	178.6	-59.9	0	0	0	0	110.2	V69 M108 L110 F169 I179	V69-V71 HydrophobicContact CG2-CG1 4.06Å; V71-M108 HydrophobicContact CG2-CG 3.79Å; V71-M108 PolarHBondContact N-O 2.93Å; V71-M108 PolarHBondContact O-N 3.39Å; V71-L110 HydrophobicContact CG1-CB 4.34Å; V71-L110 HydrophobicContact CG2-CB 3.81Å; V71-L110 HydrophobicContact CG2-CD1 4.3Å; V71-F169 HydrophobicContact CB-CB 4.24Å; V71-F169 HydrophobicContact CB-CD1 4.42Å; V71-F169 HydrophobicContact CG2-CB 4.47Å; V71-F169 HydrophobicContact CG2-CD1 3.77Å; V71-F169 HydrophobicContact CG2-CE1 4.41Å; V71-F169 HydrophobicContact CG2-CG 4.39Å; V71-I179 HydrophobicContact CG1-CD1 4.02Å
72	E	94.9	Very high	80.2	Confident	51 Å²	51	71.2 Å²	71.2	24%	0.238	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114.2	173.4	-177.6	176.6	-135.8	0	0	109.1	L74 P105 Q106 F169 Q170	E72-L74 HydrophobicContact CG-CD2 4.23Å; E72-P105 HydrophobicContact CG-CB 3.6Å; E72-P105 WeakPolarHBondContact OE1-CB 3.25Å; E72-Q106 CarbonylContact C-O 3.51Å; E72-Q106 WeakPolarHBondContact CA-O 3.35Å; E72-F169 CarbonylContact O-C 3.57Å; E72-F169 VanDerWaalsContact O-CA 3.23Å; E72-F169 WeakPolarHBondContact O-CA 3.48Å; E72-Q170 HydrophobicContact CB-CB 4.22Å; E72-Q170 PolarHBondContact N-O 2.91Å; E72-Q170 PolarHBondContact O-N 2.77Å; E72-Q170 PolarHBondContact OE2-OE1 3.48Å; E72-Q170 VanDerWaalsContact OE2-OE1 3.08Å
73	H	95.4	Very high	81.1	Confident	31 Å²	31	71 Å²	71	14%	0.144	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	129.8	177.6	174.4	-85.2	0	0	0	110.5	I76 P105 Q106 M108 F169	H73-I76 WeakPolarHBondContact NE2-CG1 3.4Å; H73-P105 WeakPolarHBondContact O-CA 3.36Å; H73-Q106 PolarHBondContact N-O 2.78Å; H73-Q106 PolarHBondContact O-N 3.04Å; H73-M108 HydrophobicContact CB-CE 3.26Å; H73-M108 HydrophobicContact CB-CG 4.41Å; H73-M108 HydrophobicContact CB-SD 3.59Å; H73-M108 VanDerWaalsContact CB-SD 3.59Å; H73-F169 HydrophobicContact CB-CD1 3.89Å; H73-F169 HydrophobicContact CB-CE1 3.95Å; H73-F169 AromaticContact CD2-CE1 3.53Å; H73-F169 AromaticContact CD2-CZ 3.99Å
74	L	94.6	Very high	82.6	Confident	7 Å²	7	67.1 Å²	67.1	4%	0.037	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-48.8	-174.8	-58.3	178.5	0	0	0	112.8	E72 L94 P105 Y148 L151 M168 Q170	E72-L74 HydrophobicContact CG-CD2 4.23Å; L74-L94 HydrophobicContact CB-CD1 3.86Å; L74-L94 HydrophobicContact CD1-CD1 4.27Å; L74-L94 HydrophobicContact CD1-CD2 4.1Å; L74-P105 HydrophobicContact CD2-CB 3.92Å; L74-P105 HydrophobicContact CD2-CG 4.11Å; L74-Y148 HydrophobicContact CD1-CD1 4.03Å; L74-Y148 HydrophobicContact CD1-CD2 4.19Å; L74-Y148 HydrophobicContact CD1-CE1 3.77Å; L74-Y148 HydrophobicContact CD1-CE2 3.94Å; L74-Y148 HydrophobicContact CD1-CG 4.22Å; L74-Y148 HydrophobicContact CD2-CE1 4.02Å; L74-L151 HydrophobicContact CD1-CD1 3.6Å; L74-M168 PolarHBondContact N-O 2.89Å; L74-Q170 HydrophobicContact CD1-CB 4.08Å; L74-Q170 HydrophobicContact CD2-CB 4.41Å; L74-Q170 HydrophobicContact CG-CB 4.35Å
75	L	93.4	Very high	84.1	Confident	31 Å²	31	68.5 Å²	68.5	16%	0.162	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	144.8	-170.2	-172.8	61.4	0	0	0	112	C77 L94 L97 M168	L75-C77 WeakPolarHBondContact CD2-SG 3.34Å; L75-L94 HydrophobicContact CB-CD1 3.91Å; L75-L94 HydrophobicContact CD2-CB 4.33Å; L75-L94 HydrophobicContact CD2-CD1 4.17Å; L75-L97 HydrophobicContact CD1-CD1 4.27Å; L75-L97 HydrophobicContact CD2-CD1 4.03Å; L75-M168 PolarHBondContact O-N 3.5Å
76	I	93.5	Very high	85.8	Confident	73 Å²	73	65.8 Å²	65.8	37%	0.374	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	125	164.6	-49.9	176.2	0	0	0	107.6	H73 Q165 V166 F167	H73-I76 WeakPolarHBondContact NE2-CG1 3.4Å; I76-Q165 HydrophobicContact CG2-CB 4.39Å; I76-V166 WeakPolarHBondContact CA-O 3.43Å; I76-F167 HydrophobicContact CD1-CD1 3.81Å; I76-F167 HydrophobicContact CD1-CE1 3.48Å; I76-F167 VanDerWaalsContact CD1-CE1 3.48Å; I76-F167 HydrophobicContact CD1-CZ 4.27Å; I76-F167 HydrophobicContact CG1-CD1 3.75Å; I76-F167 HydrophobicContact CG1-CE1 3.94Å; I76-F167 HydrophobicContact CG1-CG 4.42Å; I76-F167 HydrophobicContact CG2-CD1 4.43Å; I76-F167 HydrophobicContact CG2-CE1 4.33Å; I76-F167 HydrophobicContact CG2-CE2 4.44Å; I76-F167 HydrophobicContact CG2-CZ 4.32Å
77	C	91.6	Very high	86.9	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.041	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	148.5	174.2	-72.4	0	0	0	0	110.3	L75 L84 C90 Q165 V166	L75-C77 WeakPolarHBondContact CD2-SG 3.34Å; C77-L84 HydrophobicContact CB-CD1 4.01Å; C77-C90 HydrophobicContact CB-CB 4.1Å; C77-C90 VanDerWaalsContact CB-SG 3.57Å; C77-Q165 CarbonylContact O-C 3.52Å; C77-Q165 VanDerWaalsContact O-CA 3.3Å; C77-Q165 WeakPolarHBondContact O-CA 3.08Å; C77-V166 HydrophobicContact CB-CB 4.37Å; C77-V166 PolarHBondContact N-O 2.77Å; C77-V166 PolarHBondContact O-N 3.06Å
78	E	90.1	Very high	87.3	Confident	106 Å²	106	65.5 Å²	65.5	50%	0.495	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.9	166.6	-55.1	-160.1	146.2	0	0	108.2	D80 R161 Q165	E78-D80 PolarHBondContact O-N 3.29Å; E78-R161 IonicContact OE1-NH1 2.59Å; E78-R161 PolarHBondContact OE1-NH1 2.89Å; E78-Q165 HydrophobicContact CG-CG 4.27Å; E78-Q165 PolarHBondContact OE1-NE2 2.74Å
79	L	88.1	Confident	87.4	Confident	34 Å²	34	63.2 Å²	63.2	18%	0.178	32%	0.319	C	S	.	.			trans	-75.1	109.7	171.3	-68.9	175	0	0	0	107.9	L84 T155 A164 V166	L79-L84 CarbonylContact C-O 3.58Å; L79-L84 VanDerWaalsContact CA-O 3.25Å; L79-L84 WeakPolarHBondContact CA-O 3.38Å; L79-L84 WeakPolarHBondContact CD2-O 3.3Å; L79-T155 HydrophobicContact CD1-CG2 4.18Å; L79-A164 HydrophobicContact CB-CB 4.43Å; L79-A164 WeakPolarHBondContact CB-O 3.41Å; L79-A164 HydrophobicContact CD1-CB 4.09Å; L79-A164 PolarHBondContact N-O 2.77Å; L79-V166 HydrophobicContact CD1-CG2 3.59Å; L79-V166 HydrophobicContact CD2-CG2 4.09Å; L79-V166 HydrophobicContact CG-CG2 3.6Å
80	D	76.6	Confident	87.3	Confident	72 Å²	72	62.3 Å²	62.3	39%	0.385	31%	0.313	S	S	.	.			trans	-112.1	165.8	176.1	70.4	21.6	0	0	0	110.8	E78 Q82 E83 L84	E78-D80 PolarHBondContact O-N 3.29Å; D80-Q82 PolarHBondContact O-N 3.45Å; D80-Q82 PolarHBondContact OD1-N 3.46Å; D80-E83 PolarHBondContact OD1-N 2.74Å; D80-L84 PolarHBondContact N-O 3.31Å; D80-L84 CarbonylContact O-C 3.49Å; D80-L84 PolarHBondContact OD1-N 2.86Å
81	S	64	Low	87.2	Confident	114 Å²	114	58 Å²	58	80%	0.797	30%	0.298	S	S	*	.	S	Bend	trans	-78.6	2.8	-180	48.9	0	0	0	0	113.4	K85	S81-K85 WeakPolarHBondContact O-CE 3.25Å
82	Q	69.8	Low	87	Confident	164 Å²	164	61.9 Å²	61.9	77%	0.766	32%	0.322	S	S	*	.	S	Bend	trans	-117	-58.5	-166.9	-162.8	168.3	-3.2	0	0	113.3	D80	D80-Q82 PolarHBondContact O-N 3.45Å; D80-Q82 PolarHBondContact OD1-N 3.46Å
83	E	72.9	Confident	86.8	Confident	148 Å²	148	63 Å²	63	69%	0.692	33%	0.326	S	S	*	.	S	Bend	trans	-109.6	-37	-174.7	-66.9	-170.7	173	0	0	113.6	D80	D80-E83 PolarHBondContact OD1-N 2.74Å
84	L	84.6	Confident	86.7	Confident	15 Å²	15	61.5 Å²	61.5	8%	0.079	32%	0.319	C	S	.	.			trans	-124.4	91.1	-175.1	-67.7	178	0	0	0	110.9	C77 L79 D80 D89 K93	C77-L84 HydrophobicContact CB-CD1 4.01Å; L79-L84 CarbonylContact C-O 3.58Å; L79-L84 VanDerWaalsContact CA-O 3.25Å; L79-L84 WeakPolarHBondContact CA-O 3.38Å; L79-L84 WeakPolarHBondContact CD2-O 3.3Å; D80-L84 PolarHBondContact N-O 3.31Å; D80-L84 CarbonylContact O-C 3.49Å; D80-L84 PolarHBondContact OD1-N 2.86Å; L84-D89 HydrophobicContact CD2-CB 3.88Å; L84-K93 HydrophobicContact CD1-CD 3.76Å; L84-K93 HydrophobicContact CD2-CB 4.3Å; L84-K93 HydrophobicContact CD2-CD 3.93Å; L84-K93 HydrophobicContact CG-CD 4.32Å
85	K	84.1	Confident	86.5	Confident	136 Å²	136	64.7 Å²	64.7	59%	0.591	33%	0.333	S	S	*	.			trans	-94.9	-27.7	-173.7	-65.9	176.7	-178.7	174.3	0	112.8	S81 D89	S81-K85 WeakPolarHBondContact O-CE 3.25Å; K85-D89 PolarHBondContact N-OD2 3.2Å
86	T	89.1	Confident	86.3	Confident	61 Å²	61	68.2 Å²	68.2	37%	0.374	35%	0.348	S	S	.	.	S	Bend	trans	-129.2	158.8	-175	69.3	0	0	0	0	111.8	D88 D89 C90	T86-D88 PolarHBondContact O-N 2.87Å; T86-D89 PolarHBondContact N-OD2 2.86Å; T86-D89 WeakPolarHBondContact O-CB 3.16Å; T86-D89 PolarHBondContact O-N 2.9Å; T86-D89 VanDerWaalsContact O-N 3.16Å; T86-D89 PolarHBondContact OG1-N 3.22Å; T86-D89 PolarHBondContact OG1-OD1 3.39Å; T86-D89 PolarHBondContact OG1-OD2 3.47Å; T86-C90 PolarHBondContact O-N 3.47Å
87	E	89.4	Confident	86.2	Confident	16 Å²	16	66 Å²	66	8%	0.075	34%	0.337	C	S	.	.	H	α-helix	trans	-59.5	-32.3	172.4	-67.2	164.8	-172.4	0	0	111.9	C90 V91 K138 R140 V153 T155	E87-C90 WeakPolarHBondContact O-CB 3.26Å; E87-C90 PolarHBondContact O-N 3.04Å; E87-V91 WeakPolarHBondContact O-CG2 3.32Å; E87-V91 PolarHBondContact O-N 3.46Å; E87-K138 VanDerWaalsContact OE1-CD 3.24Å; E87-K138 WeakPolarHBondContact OE1-CD 3.05Å; E87-K138 IonicContact OE1-NZ 3.91Å; E87-K138 PolarHBondContact OE1-NZ 3.19Å; E87-K138 VanDerWaalsContact OE1-NZ 3.11Å; E87-K138 IonicContact OE2-NZ 2.78Å; E87-K138 PolarHBondContact OE2-NZ 2.66Å; E87-R140 WeakPolarHBondContact OE2-CD 3.48Å; E87-R140 IonicContact OE2-NH1 3.37Å; E87-V153 HydrophobicContact CG-CG1 4.45Å; E87-T155 PolarHBondContact OE1-OG1 2.89Å
88	D	90.3	Very high	86	Confident	80 Å²	80	68.3 Å²	68.3	43%	0.428	35%	0.349	S	S	.	.	H	α-helix	trans	-69	-33.4	177.3	-64.5	-59.8	0	0	0	112	T86 C90 V91 T92 R140	T86-D88 PolarHBondContact O-N 2.87Å; D88-C90 VanDerWaalsContact C-N 3.33Å; D88-V91 PolarHBondContact O-N 2.95Å; D88-T92 WeakPolarHBondContact O-CB 3.46Å; D88-T92 PolarHBondContact O-N 3.34Å; D88-T92 PolarHBondContact O-OG1 2.93Å; D88-R140 VanDerWaalsContact CG-NH1 3.3Å; D88-R140 IonicContact OD1-CZ 3.19Å; D88-R140 VanDerWaalsContact OD1-CZ 3.23Å; D88-R140 IonicContact OD1-NH1 3.8Å; D88-R140 PolarHBondContact OD1-NH1 3.24Å; D88-R140 IonicContact OD1-NH2 3.3Å; D88-R140 PolarHBondContact OD1-NH2 2.95Å; D88-R140 IonicContact OD2-NH1 3.23Å; D88-R140 PolarHBondContact OD2-NH1 3.22Å
89	D	91.5	Very high	85.9	Confident	61 Å²	61	66.8 Å²	66.8	33%	0.326	36%	0.361	S	S	.	.	H	α-helix	trans	-64.1	-42.3	171.3	-56.8	-38.4	0	0	0	110.3	L84 K85 T86 V91 T92 K93	L84-D89 HydrophobicContact CD2-CB 3.88Å; K85-D89 PolarHBondContact N-OD2 3.2Å; T86-D89 PolarHBondContact N-OD2 2.86Å; T86-D89 WeakPolarHBondContact O-CB 3.16Å; T86-D89 PolarHBondContact O-N 2.9Å; T86-D89 VanDerWaalsContact O-N 3.16Å; T86-D89 PolarHBondContact OG1-N 3.22Å; T86-D89 PolarHBondContact OG1-OD1 3.39Å; T86-D89 PolarHBondContact OG1-OD2 3.47Å; D89-V91 PolarHBondContact O-N 3.34Å; D89-T92 WeakPolarHBondContact O-CB 3.41Å; D89-T92 PolarHBondContact O-N 2.9Å; D89-K93 WeakPolarHBondContact O-CB 3.3Å; D89-K93 PolarHBondContact O-N 3.06Å
90	C	91.4	Very high	86	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-63.8	-40.7	176	-61.4	0	0	0	0	111.6	C77 T86 E87 D88 T92 K93 L94 V166 M168	C77-C90 HydrophobicContact CB-CB 4.1Å; C77-C90 VanDerWaalsContact CB-SG 3.57Å; T86-C90 PolarHBondContact O-N 3.47Å; E87-C90 WeakPolarHBondContact O-CB 3.26Å; E87-C90 PolarHBondContact O-N 3.04Å; D88-C90 VanDerWaalsContact C-N 3.33Å; C90-T92 VanDerWaalsContact C-N 3.31Å; C90-K93 PolarHBondContact O-N 3.33Å; C90-L94 PolarHBondContact O-N 2.81Å; C90-V166 HydrophobicContact CB-CG1 4.4Å; C90-M168 HydrophobicContact CB-CE 3.2Å
91	V	91.3	Very high	86.4	Confident	8 Å²	8	70.5 Å²	70.5	5%	0.048	39%	0.39	C	S	.	.	H	α-helix	trans	-66.4	-36.7	175.6	171.8	0	0	0	0	110.3	E87 D88 D89 L94 K95 L151 V153 M168	E87-V91 WeakPolarHBondContact O-CG2 3.32Å; E87-V91 PolarHBondContact O-N 3.46Å; D88-V91 PolarHBondContact O-N 2.95Å; D89-V91 PolarHBondContact O-N 3.34Å; V91-L94 WeakPolarHBondContact O-CB 3.47Å; V91-L94 PolarHBondContact O-N 2.86Å; V91-K95 VanDerWaalsContact O-CG 3.28Å; V91-K95 WeakPolarHBondContact O-CG 3.28Å; V91-K95 PolarHBondContact O-N 2.82Å; V91-K95 VanDerWaalsContact O-N 3.09Å; V91-L151 HydrophobicContact CG2-CD2 4.13Å; V91-V153 HydrophobicContact CG2-CG2 4.35Å; V91-M168 HydrophobicContact CG2-CE 3.97Å
92	T	91	Very high	87.7	Confident	86 Å²	86	73 Å²	73	53%	0.528	38%	0.382	S	S	.	.	H	α-helix	trans	-65.1	-42.3	174.8	-57.2	0	0	0	0	111.3	D88 D89 C90 L94 K95 E96	D88-T92 WeakPolarHBondContact O-CB 3.46Å; D88-T92 PolarHBondContact O-N 3.34Å; D88-T92 PolarHBondContact O-OG1 2.93Å; D89-T92 WeakPolarHBondContact O-CB 3.41Å; D89-T92 PolarHBondContact O-N 2.9Å; C90-T92 VanDerWaalsContact C-N 3.31Å; T92-L94 PolarHBondContact O-N 2.79Å; T92-K95 WeakPolarHBondContact O-CB 3.29Å; T92-K95 PolarHBondContact O-N 3.44Å; T92-E96 PolarHBondContact O-N 2.85Å
93	K	90.9	Very high	88.6	Confident	73 Å²	73	66 Å²	66	32%	0.317	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-39.3	174	-175.8	171	-178.5	169.9	0	112.4	L84 D89 C90 K95 E96 L97	L84-K93 HydrophobicContact CD1-CD 3.76Å; L84-K93 HydrophobicContact CD2-CB 4.3Å; L84-K93 HydrophobicContact CD2-CD 3.93Å; L84-K93 HydrophobicContact CG-CD 4.32Å; D89-K93 WeakPolarHBondContact O-CB 3.3Å; D89-K93 PolarHBondContact O-N 3.06Å; C90-K93 PolarHBondContact O-N 3.33Å; K93-K95 VanDerWaalsContact C-N 3.34Å; K93-K95 PolarHBondContact O-N 2.95Å; K93-E96 PolarHBondContact O-N 3.16Å; K93-L97 HydrophobicContact CG-CD1 4.25Å; K93-L97 WeakPolarHBondContact O-CG 3.49Å; K93-L97 PolarHBondContact O-N 2.78Å
94	L	92.1	Very high	89.3	Confident	1 Å²	1	68 Å²	68	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-56.1	-49.6	172.4	179.3	73.8	0	0	0	110.4	L74 L75 C90 V91 T92 E96 L97 D98 L103 Y148 L151 M168	L74-L94 HydrophobicContact CB-CD1 3.86Å; L74-L94 HydrophobicContact CD1-CD1 4.27Å; L74-L94 HydrophobicContact CD1-CD2 4.1Å; L75-L94 HydrophobicContact CB-CD1 3.91Å; L75-L94 HydrophobicContact CD2-CB 4.33Å; L75-L94 HydrophobicContact CD2-CD1 4.17Å; C90-L94 PolarHBondContact O-N 2.81Å; V91-L94 WeakPolarHBondContact O-CB 3.47Å; V91-L94 PolarHBondContact O-N 2.86Å; T92-L94 PolarHBondContact O-N 2.79Å; L94-E96 VanDerWaalsContact C-N 3.33Å; L94-E96 PolarHBondContact O-N 2.79Å; L94-L97 PolarHBondContact O-N 2.95Å; L94-D98 WeakPolarHBondContact O-CB 3.35Å; L94-D98 PolarHBondContact O-N 3.07Å; L94-L103 HydrophobicContact CD1-CD1 3.56Å; L94-L103 HydrophobicContact CD1-CD2 3.87Å; L94-L103 HydrophobicContact CD1-CG 4.39Å; L94-L103 HydrophobicContact CG-CD1 4.23Å; L94-Y148 HydrophobicContact CD1-CE2 4.5Å; L94-Y148 HydrophobicContact CD2-CD2 4.01Å; L94-Y148 HydrophobicContact CD2-CE2 3.88Å; L94-Y148 HydrophobicContact CG-CE2 4.06Å; L94-L151 HydrophobicContact CD2-CD1 3.97Å; L94-L151 HydrophobicContact CD2-CD2 3.92Å; L94-M168 HydrophobicContact CB-SD 4.02Å; L94-M168 HydrophobicContact CD1-SD 4.48Å; L94-M168 HydrophobicContact CD2-SD 3.91Å; L94-M168 HydrophobicContact CG-SD 4.37Å
95	K	90	Very high	89.6	Confident	74 Å²	74	70.1 Å²	70.1	32%	0.322	37%	0.366	S	S	.	.	H	α-helix	trans	-60.7	-40.4	178.3	-64.9	171.3	171.5	-170	0	112.9	V91 T92 K93 D98 G99 S145 C146	V91-K95 VanDerWaalsContact O-CG 3.28Å; V91-K95 WeakPolarHBondContact O-CG 3.28Å; V91-K95 PolarHBondContact O-N 2.82Å; V91-K95 VanDerWaalsContact O-N 3.09Å; T92-K95 WeakPolarHBondContact O-CB 3.29Å; T92-K95 PolarHBondContact O-N 3.44Å; K93-K95 VanDerWaalsContact C-N 3.34Å; K93-K95 PolarHBondContact O-N 2.95Å; K95-D98 PolarHBondContact O-N 3.45Å; K95-G99 PolarHBondContact O-N 3.24Å; K95-S145 WeakPolarHBondContact CE-OG 3.05Å; K95-S145 PolarHBondContact NZ-OG 3.36Å; K95-C146 HydrophobicContact CD-CB 4.24Å; K95-C146 WeakPolarHBondContact CD-SG 3.43Å; K95-C146 WeakPolarHBondContact CE-SG 3.33Å; K95-C146 HydrophobicContact CG-CB 3.86Å; K95-C146 WeakPolarHBondContact CG-SG 3.48Å
96	E	90.3	Very high	90	Very high	104 Å²	104	68.3 Å²	68.3	49%	0.486	36%	0.359	S	S	.	.	H	α-helix	trans	-65	-42.5	177.4	-169.8	-167.3	155.2	0	0	111.8	T92 K93 L94 K100	T92-E96 PolarHBondContact O-N 2.85Å; K93-E96 PolarHBondContact O-N 3.16Å; L94-E96 VanDerWaalsContact C-N 3.33Å; L94-E96 PolarHBondContact O-N 2.79Å; E96-K100 HydrophobicContact CG-CD 4.34Å; E96-K100 WeakPolarHBondContact O-CB 3.27Å; E96-K100 VanDerWaalsContact O-CG 3.28Å; E96-K100 WeakPolarHBondContact O-CG 3.38Å; E96-K100 PolarHBondContact O-N 2.86Å; E96-K100 VanDerWaalsContact O-N 3.15Å; E96-K100 WeakPolarHBondContact OE1-CE 3.15Å; E96-K100 IonicContact OE1-NZ 3.53Å; E96-K100 PolarHBondContact OE1-NZ 2.94Å
97	L	90.6	Very high	90.3	Very high	27 Å²	27	69.7 Å²	69.7	14%	0.141	36%	0.362	C	S	.	.	H	α-helix	trans	-69.3	-37.2	177.7	-70.4	174.7	0	0	0	112.1	L75 K93 L94 K100 G101 R102 L103	L75-L97 HydrophobicContact CD1-CD1 4.27Å; L75-L97 HydrophobicContact CD2-CD1 4.03Å; K93-L97 HydrophobicContact CG-CD1 4.25Å; K93-L97 WeakPolarHBondContact O-CG 3.49Å; K93-L97 PolarHBondContact O-N 2.78Å; L94-L97 PolarHBondContact O-N 2.95Å; L97-K100 CarbonylContact O-C 3.6Å; L97-K100 PolarHBondContact O-N 3.45Å; L97-G101 PolarHBondContact O-N 3.19Å; L97-G101 VanDerWaalsContact O-N 3.09Å; L97-R102 HydrophobicContact CD2-CB 4.03Å; L97-R102 PolarHBondContact O-N 3.27Å; L97-L103 HydrophobicContact CB-CD1 4.49Å; L97-L103 HydrophobicContact CB-CD2 3.62Å; L97-L103 HydrophobicContact CB-CG 3.78Å; L97-L103 HydrophobicContact CD1-CD2 4.03Å; L97-L103 HydrophobicContact CG-CD2 4.49Å
98	D	88.9	Confident	90.6	Very high	55 Å²	55	69.5 Å²	69.5	29%	0.294	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-50.1	174	-169.2	43.7	0	0	0	110.9	L94 K95 K100 G101 L103 Y148	L94-D98 WeakPolarHBondContact O-CB 3.35Å; L94-D98 PolarHBondContact O-N 3.07Å; K95-D98 PolarHBondContact O-N 3.45Å; D98-K100 PolarHBondContact O-N 2.82Å; D98-K100 VanDerWaalsContact O-N 3.1Å; D98-G101 PolarHBondContact O-N 3.01Å; D98-L103 HydrophobicContact CB-CD1 3.55Å; D98-L103 HydrophobicContact CB-CG 4.46Å; D98-Y148 PolarHBondContact OD1-OH 2.59Å
99	G	87.3	Confident	90.8	Very high	73 Å²	73	66.4 Å²	66.4	75%	0.753	34%	0.344	S	S	*	.	H	α-helix	trans	-61.6	-21.8	176.1	0	0	0	0	0	114.2	K95	K95-G99 PolarHBondContact O-N 3.24Å
100	K	90.6	Very high	91	Very high	123 Å²	123	63.5 Å²	63.5	54%	0.535	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-3.2	174	-70.5	173.5	179.5	179.2	0	113.5	E96 L97 D98 R102	E96-K100 HydrophobicContact CG-CD 4.34Å; E96-K100 WeakPolarHBondContact O-CB 3.27Å; E96-K100 VanDerWaalsContact O-CG 3.28Å; E96-K100 WeakPolarHBondContact O-CG 3.38Å; E96-K100 PolarHBondContact O-N 2.86Å; E96-K100 VanDerWaalsContact O-N 3.15Å; E96-K100 WeakPolarHBondContact OE1-CE 3.15Å; E96-K100 IonicContact OE1-NZ 3.53Å; E96-K100 PolarHBondContact OE1-NZ 2.94Å; L97-K100 CarbonylContact O-C 3.6Å; L97-K100 PolarHBondContact O-N 3.45Å; D98-K100 PolarHBondContact O-N 2.82Å; D98-K100 VanDerWaalsContact O-N 3.1Å; K100-R102 HydrophobicContact CB-CG 4.08Å; K100-R102 PolarHBondContact O-N 3.02Å
101	G	85.3	Confident	91.1	Very high	61 Å²	61	65.6 Å²	65.6	63%	0.629	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	28.9	-175.4	0	0	0	0	0	113.6	L97 D98	L97-G101 PolarHBondContact O-N 3.19Å; L97-G101 VanDerWaalsContact O-N 3.09Å; D98-G101 PolarHBondContact O-N 3.01Å
102	R	89.6	Confident	91.1	Very high	166 Å²	166	67 Å²	67	63%	0.626	35%	0.345	S	S	*	.			trans	-103.8	8.7	-176.6	-69	-173	67.3	-161.8	-0.8	113.6	L97 K100	L97-R102 HydrophobicContact CD2-CB 4.03Å; L97-R102 PolarHBondContact O-N 3.27Å; K100-R102 HydrophobicContact CB-CG 4.08Å; K100-R102 PolarHBondContact O-N 3.02Å
103	L	89.5	Confident	90.9	Very high	18 Å²	18	67 Å²	67	9%	0.094	34%	0.338	C	S	.	.			trans	-89	146.2	171.8	-67.4	178.7	0	0	0	110.6	L94 L97 D98 Y148	L94-L103 HydrophobicContact CD1-CD1 3.56Å; L94-L103 HydrophobicContact CD1-CD2 3.87Å; L94-L103 HydrophobicContact CD1-CG 4.39Å; L94-L103 HydrophobicContact CG-CD1 4.23Å; L97-L103 HydrophobicContact CB-CD1 4.49Å; L97-L103 HydrophobicContact CB-CD2 3.62Å; L97-L103 HydrophobicContact CB-CG 3.78Å; L97-L103 HydrophobicContact CD1-CD2 4.03Å; L97-L103 HydrophobicContact CG-CD2 4.49Å; D98-L103 HydrophobicContact CB-CD1 3.55Å; D98-L103 HydrophobicContact CB-CG 4.46Å; L103-Y148 WeakPolarHBondContact CD1-OH 3.18Å
104	W	87.2	Confident	90.7	Very high	189 Å²	189	67 Å²	67	72%	0.716	36%	0.358	S	S	*	.			trans	-124.8	86.2	176.1	-57.2	93.9	0	0	0	108
105	P	91.4	Very high	90.5	Very high	60 Å²	60	69.5 Å²	69.5	39%	0.39	38%	0.379	S	S	.	.			trans	-63.9	137.5	177.1	-20.7	34.3	0	0	0	110.6	E72 H73 L74	E72-P105 HydrophobicContact CG-CB 3.6Å; E72-P105 WeakPolarHBondContact OE1-CB 3.25Å; H73-P105 WeakPolarHBondContact O-CA 3.36Å; L74-P105 HydrophobicContact CD2-CB 3.92Å; L74-P105 HydrophobicContact CD2-CG 4.11Å
106	Q	93.3	Very high	90.6	Very high	98 Å²	98	70.5 Å²	70.5	46%	0.458	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	116.1	178.4	177.5	62.5	41	0	0	109.9	E72 H73 M108	E72-Q106 CarbonylContact C-O 3.51Å; E72-Q106 WeakPolarHBondContact CA-O 3.35Å; H73-Q106 PolarHBondContact N-O 2.78Å; H73-Q106 PolarHBondContact O-N 3.04Å; Q106-M108 HydrophobicContact CB-CE 4.31Å; Q106-M108 HydrophobicContact CG-CE 3.97Å
107	E	93.8	Very high	90.8	Very high	90 Å²	90	65.5 Å²	65.5	42%	0.421	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	136.1	173.5	-58.7	-165.9	93.2	0	0	110.9	R70 I122	R70-E107 IonicContact CZ-OE1 3.36Å; R70-E107 VanDerWaalsContact CZ-OE1 3.23Å; R70-E107 IonicContact CZ-OE2 2.92Å; R70-E107 IonicContact NE-OE1 3.13Å; R70-E107 PolarHBondContact NE-OE1 3.19Å; R70-E107 IonicContact NH2-OE1 2.77Å; R70-E107 PolarHBondContact NH2-OE1 2.79Å; R70-E107 IonicContact NH2-OE2 3.73Å; R70-E107 PolarHBondContact NH2-OE2 2.88Å; E107-I122 HydrophobicContact CB-CD1 3.31Å
108	M	95.6	Very high	91.1	Very high	12 Å²	12	64.5 Å²	64.5	6%	0.059	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	172	-178.4	58.1	-177.7	60.5	0	0	111.7	V71 H73 Q106 L119 C120 L128 F169	V71-M108 HydrophobicContact CG2-CG 3.79Å; V71-M108 PolarHBondContact N-O 2.93Å; V71-M108 PolarHBondContact O-N 3.39Å; H73-M108 HydrophobicContact CB-CE 3.26Å; H73-M108 HydrophobicContact CB-CG 4.41Å; H73-M108 HydrophobicContact CB-SD 3.59Å; H73-M108 VanDerWaalsContact CB-SD 3.59Å; Q106-M108 HydrophobicContact CB-CE 4.31Å; Q106-M108 HydrophobicContact CG-CE 3.97Å; M108-L119 HydrophobicContact SD-CB 4.13Å; M108-L119 HydrophobicContact SD-CD1 3.89Å; M108-L119 HydrophobicContact SD-CD2 4.11Å; M108-L119 HydrophobicContact SD-CG 4.27Å; M108-C120 WeakPolarHBondContact CB-O 3.22Å; M108-L128 HydrophobicContact CB-CD1 4.49Å; M108-L128 HydrophobicContact CE-CD1 4.48Å; M108-F169 HydrophobicContact SD-CD1 4.48Å; M108-F169 HydrophobicContact SD-CE1 3.98Å
109	I	95.1	Very high	91.4	Very high	15 Å²	15	62 Å²	62	8%	0.077	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.8	172.8	-64.5	169.3	0	0	0	108.3	Q68 V69 L119 C120 I122 K125	Q68-I109 HydrophobicContact CG-CG2 3.45Å; Q68-I109 VanDerWaalsContact CG-CG2 3.45Å; V69-I109 CarbonylContact O-C 3.57Å; V69-I109 WeakPolarHBondContact O-CA 3.5Å; I109-L119 CarbonylContact O-C 3.58Å; I109-L119 WeakPolarHBondContact O-CA 3.29Å; I109-C120 HydrophobicContact CB-CB 4.21Å; I109-C120 PolarHBondContact N-O 3.29Å; I109-C120 PolarHBondContact O-N 3.46Å; I109-I122 HydrophobicContact CD1-CG1 4.4Å; I109-I122 HydrophobicContact CG1-CG1 3.96Å; I109-K125 HydrophobicContact CD1-CD 3.89Å
110	L	95.6	Very high	91.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.3	173.5	-171.7	162.1	0	0	0	108.1	F67 Q68 V69 V71 V117 L119	F67-L110 HydrophobicContact CD1-CD2 4.25Å; F67-L110 HydrophobicContact CE1-CD2 3.28Å; F67-L110 HydrophobicContact CZ-CD2 3.93Å; Q68-L110 WeakPolarHBondContact CA-O 3.39Å; V69-L110 HydrophobicContact CG2-CB 4.06Å; V69-L110 HydrophobicContact CG2-CD2 4.24Å; V69-L110 WeakPolarHBondContact CG2-O 3.38Å; V69-L110 PolarHBondContact N-O 3.2Å; V69-L110 PolarHBondContact O-N 2.92Å; V71-L110 HydrophobicContact CG1-CB 4.34Å; V71-L110 HydrophobicContact CG2-CB 3.81Å; V71-L110 HydrophobicContact CG2-CD1 4.3Å; L110-V117 HydrophobicContact CD1-CG1 4.3Å; L110-V117 HydrophobicContact CD2-CG1 3.7Å; L110-V117 HydrophobicContact CG-CG1 3.77Å; L110-L119 HydrophobicContact CB-CD2 4.01Å; L110-L119 HydrophobicContact CD1-CD2 3.96Å; L110-L119 HydrophobicContact CG-CD2 3.78Å
111	E	93.3	Very high	91.9	Very high	44 Å²	44	54.3 Å²	54.3	21%	0.206	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.4	-173.6	-170.7	-178.5	158.8	0	0	111.1	F67 Q68 K113 V117 V118	F67-E111 VanDerWaalsContact O-CA 3.29Å; F67-E111 WeakPolarHBondContact O-CA 3.36Å; F67-E111 WeakPolarHBondContact O-CG 3.33Å; Q68-E111 HydrophobicContact CB-CG 4.12Å; Q68-E111 HydrophobicContact CG-CB 4.28Å; Q68-E111 HydrophobicContact CG-CG 4.2Å; Q68-E111 PolarHBondContact NE2-OE2 3.49Å; E111-K113 HydrophobicContact CG-CG 4.2Å; E111-K113 WeakPolarHBondContact OE1-CE 3.43Å; E111-K113 WeakPolarHBondContact OE2-CE 3.5Å; E111-K113 IonicContact OE2-NZ 2.69Å; E111-V117 CarbonylContact O-C 3.31Å; E111-V117 WeakPolarHBondContact O-CA 3.35Å; E111-V118 PolarHBondContact N-O 2.92Å; E111-V118 PolarHBondContact O-N 3.1Å
112	I	91.1	Very high	91.8	Very high	38 Å²	38	53 Å²	53	20%	0.195	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	114.5	170.5	-69.3	165.4	0	0	0	109.5	F67 Y116 V117 L133 L183 A186	F67-I112 HydrophobicContact CB-CB 4.27Å; F67-I112 HydrophobicContact CB-CD1 3.86Å; F67-I112 HydrophobicContact CB-CG1 4.29Å; F67-I112 HydrophobicContact CD1-CB 4.05Å; F67-I112 HydrophobicContact CD1-CD1 3.27Å; F67-I112 HydrophobicContact CD1-CG1 3.35Å; F67-I112 HydrophobicContact CD2-CD1 4.26Å; F67-I112 HydrophobicContact CE1-CD1 3.6Å; F67-I112 HydrophobicContact CE1-CG1 3.74Å; F67-I112 HydrophobicContact CG-CD1 3.57Å; F67-I112 HydrophobicContact CG-CG1 4.07Å; F67-I112 HydrophobicContact CZ-CD1 4.26Å; F67-I112 PolarHBondContact O-N 3.37Å; I112-Y116 WeakPolarHBondContact CA-O 3.26Å; I112-V117 HydrophobicContact CG1-CG2 4.38Å; I112-L133 HydrophobicContact CG2-CD1 4.29Å; I112-L183 HydrophobicContact CD1-CD1 4.03Å; I112-L183 HydrophobicContact CG1-CD1 4.49Å; I112-A186 HydrophobicContact CD1-CB 3.44Å; I112-A186 VanDerWaalsContact CD1-CB 3.44Å
113	K	87.8	Confident	91.4	Very high	86 Å²	86	53.5 Å²	53.5	37%	0.374	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	103.6	175.5	-64.8	-174.6	-178.8	173.3	0	109.6	E111 A115 Y116 V118	E111-K113 HydrophobicContact CG-CG 4.2Å; E111-K113 WeakPolarHBondContact OE1-CE 3.43Å; E111-K113 WeakPolarHBondContact OE2-CE 3.5Å; E111-K113 IonicContact OE2-NZ 2.69Å; K113-A115 PolarHBondContact O-N 2.75Å; K113-A115 VanDerWaalsContact O-N 3.16Å; K113-Y116 PolarHBondContact N-O 2.9Å; K113-Y116 PolarHBondContact O-N 3.43Å; K113-Y116 VanDerWaalsContact O-N 3.12Å; K113-V118 HydrophobicContact CB-CG2 3.85Å; K113-V118 HydrophobicContact CD-CB 4.32Å; K113-V118 HydrophobicContact CD-CG2 4.1Å; K113-V118 HydrophobicContact CG-CB 4.5Å; K113-V118 HydrophobicContact CG-CG2 4.13Å
114	G	85.9	Confident	91.2	Very high	72 Å²	72	57.6 Å²	57.6	74%	0.742	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	-116.4	-177.7	0	0	0	0	0	111.9
115	A	88.2	Confident	91.2	Very high	54 Å²	54	54.4 Å²	54.4	45%	0.446	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	13.1	-178.9	0	0	0	0	0	114.2	K113 L133	K113-A115 PolarHBondContact O-N 2.75Å; K113-A115 VanDerWaalsContact O-N 3.16Å; A115-L133 WeakPolarHBondContact O-CB 3.28Å; A115-L133 PolarHBondContact O-N 2.95Å
116	Y	93.3	Very high	91	Very high	95 Å²	95	53.1 Å²	53.1	37%	0.373	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	143.9	-173	-60.5	-96	0	0	0	111.7	I112 K113 I131 P132	I112-Y116 WeakPolarHBondContact CA-O 3.26Å; K113-Y116 PolarHBondContact N-O 2.9Å; K113-Y116 PolarHBondContact O-N 3.43Å; K113-Y116 VanDerWaalsContact O-N 3.12Å; Y116-I131 WeakPolarHBondContact CA-O 3.38Å; Y116-P132 HydrophobicContact CD1-CB 4.07Å; Y116-P132 HydrophobicContact CD1-CG 4.06Å; Y116-P132 HydrophobicContact CE1-CB 3.95Å; Y116-P132 HydrophobicContact CE1-CG 3.8Å
117	V	94.8	Very high	91	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.5	156.6	178.4	0	0	0	0	106.9	L110 E111 I112 I131 L133 I136 L183	L110-V117 HydrophobicContact CD1-CG1 4.3Å; L110-V117 HydrophobicContact CD2-CG1 3.7Å; L110-V117 HydrophobicContact CG-CG1 3.77Å; E111-V117 CarbonylContact O-C 3.31Å; E111-V117 WeakPolarHBondContact O-CA 3.35Å; I112-V117 HydrophobicContact CG1-CG2 4.38Å; V117-I131 HydrophobicContact CB-CB 4.32Å; V117-I131 PolarHBondContact N-O 3.33Å; V117-I131 PolarHBondContact O-N 3.34Å; V117-L133 HydrophobicContact CG2-CD2 3.58Å; V117-L133 HydrophobicContact CG2-CG 4.44Å; V117-I136 HydrophobicContact CG2-CD1 3.68Å; V117-L183 HydrophobicContact CG2-CD1 3.52Å
118	V	95.4	Very high	91	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.03	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	127.7	-178	-174.3	0	0	0	0	108.5	E111 K113 E127	E111-V118 PolarHBondContact N-O 2.92Å; E111-V118 PolarHBondContact O-N 3.1Å; K113-V118 HydrophobicContact CB-CG2 3.85Å; K113-V118 HydrophobicContact CD-CB 4.32Å; K113-V118 HydrophobicContact CD-CG2 4.1Å; K113-V118 HydrophobicContact CG-CB 4.5Å; K113-V118 HydrophobicContact CG-CG2 4.13Å; V118-E127 HydrophobicContact CG1-CB 4.18Å; V118-E127 HydrophobicContact CG1-CG 3.52Å
119	L	96.7	Very high	90.9	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.5	171.6	-56	-177.1	0	0	0	107.7	M108 I109 L110 L128 D129 F169	M108-L119 HydrophobicContact SD-CB 4.13Å; M108-L119 HydrophobicContact SD-CD1 3.89Å; M108-L119 HydrophobicContact SD-CD2 4.11Å; M108-L119 HydrophobicContact SD-CG 4.27Å; I109-L119 CarbonylContact O-C 3.58Å; I109-L119 WeakPolarHBondContact O-CA 3.29Å; L110-L119 HydrophobicContact CB-CD2 4.01Å; L110-L119 HydrophobicContact CD1-CD2 3.96Å; L110-L119 HydrophobicContact CG-CD2 3.78Å; L119-L128 HydrophobicContact CB-CB 4.49Å; L119-L128 WeakPolarHBondContact O-CA 3.4Å; L119-L128 WeakPolarHBondContact O-CB 3.4Å; L119-L128 PolarHBondContact O-N 3.37Å; L119-D129 HydrophobicContact CB-CB 4.24Å; L119-D129 HydrophobicContact CD1-CB 4.07Å; L119-D129 HydrophobicContact CG-CB 4.37Å; L119-D129 PolarHBondContact N-O 2.86Å; L119-D129 PolarHBondContact O-N 3.42Å; L119-F169 HydrophobicContact CD1-CE1 4.1Å; L119-F169 HydrophobicContact CD1-CZ 4.09Å; L119-F169 HydrophobicContact CD2-CE1 4.09Å; L119-F169 HydrophobicContact CD2-CZ 4.21Å
120	C	95.4	Very high	90.8	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.02	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	148.7	-178.7	-59.7	0	0	0	0	110.8	M108 I109 G126	M108-C120 WeakPolarHBondContact CB-O 3.22Å; I109-C120 HydrophobicContact CB-CB 4.21Å; I109-C120 PolarHBondContact N-O 3.29Å; I109-C120 PolarHBondContact O-N 3.46Å; C120-G126 CarbonylContact C-O 3.21Å; C120-G126 VanDerWaalsContact CA-O 3.23Å; C120-G126 WeakPolarHBondContact CA-O 2.75Å
121	D	92.1	Very high	90.8	Very high	31 Å²	31	58.8 Å²	58.8	17%	0.166	33%	0.326	C	S	.	.			trans	-67	142.9	170.8	178.3	-106.9	0	0	0	111.1	E123 T124 K125 G126 L128	D121-E123 PolarHBondContact OD1-N 2.8Å; D121-T124 VanDerWaalsContact CB-OG1 3.32Å; D121-T124 WeakPolarHBondContact CB-OG1 3.3Å; D121-T124 WeakPolarHBondContact OD1-CB 3.36Å; D121-T124 PolarHBondContact OD1-N 3.19Å; D121-T124 PolarHBondContact OD1-OG1 3.39Å; D121-K125 VanDerWaalsContact O-CA 3.22Å; D121-K125 WeakPolarHBondContact O-CA 3.32Å; D121-K125 PolarHBondContact O-N 3.45Å; D121-K125 VanDerWaalsContact O-N 3.15Å; D121-G126 PolarHBondContact N-O 2.82Å; D121-L128 HydrophobicContact CB-CD1 4.13Å; D121-L128 HydrophobicContact CB-CD2 4.11Å; D121-L128 HydrophobicContact CB-CG 4.13Å
122	I	83.9	Confident	90.8	Very high	33 Å²	33	58 Å²	58	17%	0.169	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-37.9	-176.2	-79.4	167.9	0	0	0	112.1	R70 E107 I109 K125	R70-I122 HydrophobicContact CG-CD1 4.19Å; E107-I122 HydrophobicContact CB-CD1 3.31Å; I109-I122 HydrophobicContact CD1-CG1 4.4Å; I109-I122 HydrophobicContact CG1-CG1 3.96Å; I122-K125 WeakPolarHBondContact O-CE 3.37Å; I122-K125 PolarHBondContact O-NZ 2.94Å
123	E	81.3	Confident	90.8	Very high	176 Å²	176	56.6 Å²	56.6	82%	0.822	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-53.4	-171.2	-62.4	-175.4	172.2	0	0	110.7	D121	D121-E123 PolarHBondContact OD1-N 2.8Å
124	T	84.6	Confident	91	Very high	104 Å²	104	62.8 Å²	62.8	64%	0.638	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-17.5	-175.1	62.7	0	0	0	0	113.4	D121 G126	D121-T124 VanDerWaalsContact CB-OG1 3.32Å; D121-T124 WeakPolarHBondContact CB-OG1 3.3Å; D121-T124 WeakPolarHBondContact OD1-CB 3.36Å; D121-T124 PolarHBondContact OD1-N 3.19Å; D121-T124 PolarHBondContact OD1-OG1 3.39Å; T124-G126 PolarHBondContact O-N 2.9Å; T124-G126 VanDerWaalsContact O-N 3.1Å; T124-G126 PolarHBondContact OG1-N 2.88Å
125	K	86.1	Confident	91.3	Very high	123 Å²	123	59.9 Å²	59.9	54%	0.535	31%	0.307	S	S	.	.			trans	58	12.9	-168	-49.5	-55	-175	-164.3	0	113.9	I109 D121 I122	I109-K125 HydrophobicContact CD1-CD 3.89Å; D121-K125 VanDerWaalsContact O-CA 3.22Å; D121-K125 WeakPolarHBondContact O-CA 3.32Å; D121-K125 PolarHBondContact O-N 3.45Å; D121-K125 VanDerWaalsContact O-N 3.15Å; I122-K125 WeakPolarHBondContact O-CE 3.37Å; I122-K125 PolarHBondContact O-NZ 2.94Å
126	G	87.2	Confident	91.6	Very high	32 Å²	32	57.8 Å²	57.8	33%	0.33	29%	0.288	S	S	.	.			trans	-68	143	176.2	0	0	0	0	0	111.4	C120 D121 T124 L128	C120-G126 CarbonylContact C-O 3.21Å; C120-G126 VanDerWaalsContact CA-O 3.23Å; C120-G126 WeakPolarHBondContact CA-O 2.75Å; D121-G126 PolarHBondContact N-O 2.82Å; T124-G126 PolarHBondContact O-N 2.9Å; T124-G126 VanDerWaalsContact O-N 3.1Å; T124-G126 PolarHBondContact OG1-N 2.88Å; G126-L128 PolarHBondContact O-N 3.31Å
127	E	94	Very high	91.5	Very high	117 Å²	117	58.2 Å²	58.2	55%	0.547	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	124.4	175.2	176.3	167.6	164.2	0	0	110.7	V118 S130	V118-E127 HydrophobicContact CG1-CB 4.18Å; V118-E127 HydrophobicContact CG1-CG 3.52Å; E127-S130 VanDerWaalsContact OE1-CB 3.32Å; E127-S130 WeakPolarHBondContact OE1-CB 3.38Å
128	L	93.5	Very high	91.5	Very high	95 Å²	95	63 Å²	63	50%	0.497	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-44.2	179.7	-63.8	177.2	0	0	0	111.8	M108 L119 D121 G126	M108-L128 HydrophobicContact CB-CD1 4.49Å; M108-L128 HydrophobicContact CE-CD1 4.48Å; L119-L128 HydrophobicContact CB-CB 4.49Å; L119-L128 WeakPolarHBondContact O-CA 3.4Å; L119-L128 WeakPolarHBondContact O-CB 3.4Å; L119-L128 PolarHBondContact O-N 3.37Å; D121-L128 HydrophobicContact CB-CD1 4.13Å; D121-L128 HydrophobicContact CB-CD2 4.11Å; D121-L128 HydrophobicContact CB-CG 4.13Å; G126-L128 PolarHBondContact O-N 3.31Å
129	D	94.1	Very high	91.5	Very high	67 Å²	67	63.3 Å²	63.3	36%	0.358	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	155.6	-179.7	-159.6	1.5	0	0	0	111.1	L119	L119-D129 HydrophobicContact CB-CB 4.24Å; L119-D129 HydrophobicContact CD1-CB 4.07Å; L119-D129 HydrophobicContact CG-CB 4.37Å; L119-D129 PolarHBondContact N-O 2.86Å; L119-D129 PolarHBondContact O-N 3.42Å
130	S	93.7	Very high	91.4	Very high	50 Å²	50	66.3 Å²	66.3	35%	0.35	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	120.4	-178.3	74.7	0	0	0	0	111.1	E127	E127-S130 VanDerWaalsContact OE1-CB 3.32Å; E127-S130 WeakPolarHBondContact OE1-CB 3.38Å
131	I	94.4	Very high	91.3	Very high	6 Å²	6	67.3 Å²	67.3	3%	0.031	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	113.8	-177.4	-58.2	170.2	0	0	0	108.1	Y116 V117 L133 I136 V156 F167	Y116-I131 WeakPolarHBondContact CA-O 3.38Å; V117-I131 HydrophobicContact CB-CB 4.32Å; V117-I131 PolarHBondContact N-O 3.33Å; V117-I131 PolarHBondContact O-N 3.34Å; I131-L133 PolarHBondContact O-N 3.45Å; I131-I136 HydrophobicContact CG2-CD1 4.12Å; I131-I136 HydrophobicContact CG2-CG1 3.78Å; I131-V156 HydrophobicContact CG2-CG1 3.89Å; I131-V156 HydrophobicContact CG2-CG2 3.81Å; I131-F167 HydrophobicContact CD1-CD1 4.17Å; I131-F167 HydrophobicContact CD1-CD2 4.34Å; I131-F167 HydrophobicContact CD1-CE1 3.91Å; I131-F167 HydrophobicContact CD1-CE2 4.12Å; I131-F167 HydrophobicContact CD1-CG 4.38Å; I131-F167 HydrophobicContact CD1-CZ 3.9Å; I131-F167 HydrophobicContact CG1-CZ 4.42Å
132	P	93.3	Very high	91.3	Very high	28 Å²	28	66.7 Å²	66.7	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	130.2	176.4	-16.8	24.8	0	0	0	110.9	Y116 R134 S135	Y116-P132 HydrophobicContact CD1-CB 4.07Å; Y116-P132 HydrophobicContact CD1-CG 4.06Å; Y116-P132 HydrophobicContact CE1-CB 3.95Å; Y116-P132 HydrophobicContact CE1-CG 3.8Å; P132-R134 HydrophobicContact CB-CG 3.98Å; P132-R134 PolarHBondContact O-N 3.09Å; P132-R134 VanDerWaalsContact O-N 3.14Å; P132-S135 WeakPolarHBondContact CD-OG 3.44Å; P132-S135 WeakPolarHBondContact O-CB 3.49Å; P132-S135 PolarHBondContact O-N 3.02Å; P132-S135 PolarHBondContact O-OG 3.42Å
133	L	92.2	Very high	91.4	Very high	8 Å²	8	68.9 Å²	68.9	4%	0.042	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-54.7	-38.6	179.4	-74.6	169.8	0	0	0	111.8	I112 A115 V117 I131 S135 I136 L183 I187	I112-L133 HydrophobicContact CG2-CD1 4.29Å; A115-L133 WeakPolarHBondContact O-CB 3.28Å; A115-L133 PolarHBondContact O-N 2.95Å; V117-L133 HydrophobicContact CG2-CD2 3.58Å; V117-L133 HydrophobicContact CG2-CG 4.44Å; I131-L133 PolarHBondContact O-N 3.45Å; L133-S135 PolarHBondContact O-N 2.71Å; L133-I136 HydrophobicContact CD2-CD1 4.28Å; L133-I136 WeakPolarHBondContact O-CB 3.28Å; L133-I136 PolarHBondContact O-N 3.19Å; L133-I136 VanDerWaalsContact O-N 3.15Å; L133-L183 HydrophobicContact CD2-CD1 3.81Å; L133-I187 HydrophobicContact CD2-CG1 3.86Å
134	R	90.6	Very high	91	Very high	215 Å²	215	68.9 Å²	68.9	81%	0.811	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-63.3	-20	176.2	67.9	178.3	177.5	-153.8	-4.9	115.2	P132	P132-R134 HydrophobicContact CB-CG 3.98Å; P132-R134 PolarHBondContact O-N 3.09Å; P132-R134 VanDerWaalsContact O-N 3.14Å
135	S	92.8	Very high	90	Very high	12 Å²	12	64.4 Å²	64.4	8%	0.084	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-89.6	-13.8	179.2	69.3	0	0	0	0	112.2	P132 L133 V137 V156 Q157	P132-S135 WeakPolarHBondContact CD-OG 3.44Å; P132-S135 WeakPolarHBondContact O-CB 3.49Å; P132-S135 PolarHBondContact O-N 3.02Å; P132-S135 PolarHBondContact O-OG 3.42Å; L133-S135 PolarHBondContact O-N 2.71Å; S135-V137 PolarHBondContact O-N 3.03Å; S135-V156 CarbonylContact O-C 3.48Å; S135-V156 WeakPolarHBondContact O-CA 3.34Å; S135-V156 WeakPolarHBondContact OG-CG1 3.36Å; S135-Q157 PolarHBondContact O-N 3.1Å
136	I	94.3	Very high	89	Confident	10 Å²	10	62.3 Å²	62.3	5%	0.051	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	107.8	175.8	-53.3	177.6	0	0	0	107.6	V117 I131 L133 T139 V156 L183 I187	V117-I136 HydrophobicContact CG2-CD1 3.68Å; I131-I136 HydrophobicContact CG2-CD1 4.12Å; I131-I136 HydrophobicContact CG2-CG1 3.78Å; L133-I136 HydrophobicContact CD2-CD1 4.28Å; L133-I136 WeakPolarHBondContact O-CB 3.28Å; L133-I136 PolarHBondContact O-N 3.19Å; L133-I136 VanDerWaalsContact O-N 3.15Å; I136-T139 HydrophobicContact CG2-CG2 3.9Å; I136-V156 HydrophobicContact CG1-CG2 4.37Å; I136-L183 HydrophobicContact CD1-CD1 4.36Å; I136-L183 HydrophobicContact CD1-CD2 4.4Å; I136-I187 HydrophobicContact CB-CD1 3.9Å; I136-I187 HydrophobicContact CD1-CD1 4.29Å; I136-I187 HydrophobicContact CG2-CD1 3.71Å
137	V	92.3	Very high	88	Confident	104 Å²	104	63.8 Å²	63.8	63%	0.63	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	-34.6	-178.4	-179.1	0	0	0	0	110.7	S135 T155 Q157	S135-V137 PolarHBondContact O-N 3.03Å; V137-T155 PolarHBondContact N-O 3.28Å; V137-Q157 HydrophobicContact CG2-CB 3.37Å
138	K	93.1	Very high	87.3	Confident	100 Å²	100	58.9 Å²	58.9	44%	0.435	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	140.5	-175.7	-174.5	168.6	167.3	-140.3	0	111.7	E87 T155	E87-K138 VanDerWaalsContact OE1-CD 3.24Å; E87-K138 WeakPolarHBondContact OE1-CD 3.05Å; E87-K138 IonicContact OE1-NZ 3.91Å; E87-K138 PolarHBondContact OE1-NZ 3.19Å; E87-K138 VanDerWaalsContact OE1-NZ 3.11Å; E87-K138 IonicContact OE2-NZ 2.78Å; E87-K138 PolarHBondContact OE2-NZ 2.66Å; K138-T155 PolarHBondContact N-O 3.37Å; K138-T155 PolarHBondContact O-N 3.19Å
139	T	95.6	Very high	86.7	Confident	11 Å²	11	59.3 Å²	59.3	7%	0.067	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.4	170.5	70.9	0	0	0	0	108.4	I136 V153 L154 K180 L183 D184 I187	I136-T139 HydrophobicContact CG2-CG2 3.9Å; T139-V153 CarbonylContact C-O 3.41Å; T139-L154 HydrophobicContact CG2-CD2 3.84Å; T139-K180 VanDerWaalsContact O-CE 3.31Å; T139-K180 WeakPolarHBondContact O-CE 3.35Å; T139-K180 VanDerWaalsContact OG1-CG 3.3Å; T139-K180 WeakPolarHBondContact OG1-CG 3.35Å; T139-L183 HydrophobicContact CG2-CD2 3.76Å; T139-L183 HydrophobicContact CG2-CG 4.16Å; T139-D184 WeakPolarHBondContact CG2-OD1 3.32Å; T139-D184 VanDerWaalsContact OG1-CG 3.27Å; T139-D184 PolarHBondContact OG1-OD1 3.45Å; T139-D184 PolarHBondContact OG1-OD2 3.13Å; T139-I187 HydrophobicContact CG2-CD1 3.83Å
140	R	94.8	Very high	86.6	Confident	67 Å²	67	56.8 Å²	56.8	25%	0.253	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	136.1	177.7	179.1	180	178.4	-169.6	-4.5	109.8	E87 D88 V142 V153	E87-R140 WeakPolarHBondContact OE2-CD 3.48Å; E87-R140 IonicContact OE2-NH1 3.37Å; D88-R140 VanDerWaalsContact CG-NH1 3.3Å; D88-R140 IonicContact OD1-CZ 3.19Å; D88-R140 VanDerWaalsContact OD1-CZ 3.23Å; D88-R140 IonicContact OD1-NH1 3.8Å; D88-R140 PolarHBondContact OD1-NH1 3.24Å; D88-R140 IonicContact OD1-NH2 3.3Å; D88-R140 PolarHBondContact OD1-NH2 2.95Å; D88-R140 IonicContact OD2-NH1 3.23Å; D88-R140 PolarHBondContact OD2-NH1 3.22Å; R140-V142 HydrophobicContact CG-CG2 4.05Å; R140-V153 HydrophobicContact CB-CB 4.27Å; R140-V153 PolarHBondContact N-O 3.07Å; R140-V153 PolarHBondContact O-N 3.12Å
141	A	94.2	Very high	86.6	Confident	24 Å²	24	54.4 Å²	54.4	20%	0.198	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.8	167.4	0	0	0	0	0	107.8	L151 A176 E177 K180	A141-L151 CarbonylContact C-O 3.58Å; A141-L151 WeakPolarHBondContact CA-O 3.45Å; A141-A176 HydrophobicContact CB-CB 3.97Å; A141-E177 HydrophobicContact CB-CB 4.46Å; A141-E177 HydrophobicContact CB-CG 3.79Å; A141-K180 HydrophobicContact CB-CB 4.44Å; A141-K180 HydrophobicContact CB-CD 4.06Å
142	V	91.2	Very high	86.7	Confident	18 Å²	18	54.1 Å²	54.1	11%	0.109	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	112.6	174.1	-172.2	0	0	0	0	106.7	R140 L151 V153	R140-V142 HydrophobicContact CG-CG2 4.05Å; V142-L151 HydrophobicContact CB-CB 4.26Å; V142-L151 HydrophobicContact CB-CD2 4.39Å; V142-L151 PolarHBondContact N-O 2.9Å; V142-L151 WeakPolarHBondContact O-CB 3.32Å; V142-L151 PolarHBondContact O-N 3.09Å; V142-V153 HydrophobicContact CG2-CG2 4.11Å
143	L	86.6	Confident	86.8	Confident	79 Å²	79	52.8 Å²	52.8	41%	0.414	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	150	177.2	-59.3	-176.1	0	0	0	110.2	S145 E177	L143-S145 PolarHBondContact O-N 3.43Å; L143-E177 HydrophobicContact CD1-CG 4.17Å; L143-E177 VanDerWaalsContact CD1-OE1 3.29Å; L143-E177 WeakPolarHBondContact CD1-OE1 3.31Å; L143-E177 HydrophobicContact CD2-CG 4.22Å; L143-E177 HydrophobicContact CG-CG 4.36Å
144	E	71.9	Confident	87	Confident	177 Å²	177	52.4 Å²	52.4	83%	0.827	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.9	47.7	171.3	-56.7	-175.6	166.5	0	0	114.2	N149	E144-N149 PolarHBondContact N-O 3.47Å
145	S	64.8	Low	87.2	Confident	9 Å²	9	42.7 Å²	42.7	6%	0.063	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	100.1	-178.1	-167.5	0	0	0	0	110.8	K95 L143 Y148	K95-S145 WeakPolarHBondContact CE-OG 3.05Å; K95-S145 PolarHBondContact NZ-OG 3.36Å; L143-S145 PolarHBondContact O-N 3.43Å; S145-Y148 PolarHBondContact N-O 3.49Å; S145-Y148 PolarHBondContact O-N 3.31Å
146	C	64.6	Low	87.3	Confident	80 Å²	80	42.5 Å²	42.5	54%	0.541	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	-127.9	-176.8	-75.5	0	0	0	0	113.6	K95 Y148	K95-C146 HydrophobicContact CD-CB 4.24Å; K95-C146 WeakPolarHBondContact CD-SG 3.43Å; K95-C146 WeakPolarHBondContact CE-SG 3.33Å; K95-C146 HydrophobicContact CG-CB 3.86Å; K95-C146 WeakPolarHBondContact CG-SG 3.48Å; C146-Y148 PolarHBondContact O-N 2.99Å
147	A	67.4	Low	87.2	Confident	63 Å²	63	45.6 Å²	45.6	52%	0.521	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6.5	178.3	0	0	0	0	0	112.9
148	Y	78.6	Confident	86.8	Confident	13 Å²	13	44.7 Å²	44.7	5%	0.051	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	114.9	-174.3	-53	-60.5	0	0	0	111.1	L74 L94 D98 L103 S145 C146 Q170	L74-Y148 HydrophobicContact CD1-CD1 4.03Å; L74-Y148 HydrophobicContact CD1-CD2 4.19Å; L74-Y148 HydrophobicContact CD1-CE1 3.77Å; L74-Y148 HydrophobicContact CD1-CE2 3.94Å; L74-Y148 HydrophobicContact CD1-CG 4.22Å; L74-Y148 HydrophobicContact CD2-CE1 4.02Å; L94-Y148 HydrophobicContact CD1-CE2 4.5Å; L94-Y148 HydrophobicContact CD2-CD2 4.01Å; L94-Y148 HydrophobicContact CD2-CE2 3.88Å; L94-Y148 HydrophobicContact CG-CE2 4.06Å; D98-Y148 PolarHBondContact OD1-OH 2.59Å; L103-Y148 WeakPolarHBondContact CD1-OH 3.18Å; S145-Y148 PolarHBondContact N-O 3.49Å; S145-Y148 PolarHBondContact O-N 3.31Å; C146-Y148 PolarHBondContact O-N 2.99Å; Y148-Q170 HydrophobicContact CD1-CB 4.39Å; Y148-Q170 HydrophobicContact CD1-CG 4.44Å
149	N	80.1	Confident	85.7	Confident	104 Å²	104	44.1 Å²	44.1	56%	0.556	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	-23.9	-178	-63.2	-31.3	0	0	0	112.6	E144	E144-N149 PolarHBondContact N-O 3.47Å
150	S	92.3	Very high	84.3	Confident	14 Å²	14	55.1 Å²	55.1	10%	0.098	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	101.4	-179.2	-148.4	0	0	0	0	111.2	Q170 C171 A176	S150-Q170 WeakPolarHBondContact O-CA 3.36Å; S150-C171 PolarHBondContact O-N 3.3Å; S150-A176 WeakPolarHBondContact OG-CB 3.12Å; S150-A176 PolarHBondContact OG-N 2.99Å
151	L	94.4	Very high	83.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	120.4	-176.3	-174.3	76.9	0	0	0	110.6	L74 V91 L94 A141 V142 V153 M168 F169 A176	L74-L151 HydrophobicContact CD1-CD1 3.6Å; V91-L151 HydrophobicContact CG2-CD2 4.13Å; L94-L151 HydrophobicContact CD2-CD1 3.97Å; L94-L151 HydrophobicContact CD2-CD2 3.92Å; A141-L151 CarbonylContact C-O 3.58Å; A141-L151 WeakPolarHBondContact CA-O 3.45Å; V142-L151 HydrophobicContact CB-CB 4.26Å; V142-L151 HydrophobicContact CB-CD2 4.39Å; V142-L151 PolarHBondContact N-O 2.9Å; V142-L151 WeakPolarHBondContact O-CB 3.32Å; V142-L151 PolarHBondContact O-N 3.09Å; L151-V153 HydrophobicContact CD2-CG2 4.03Å; L151-V153 HydrophobicContact CG-CG2 4.18Å; L151-M168 HydrophobicContact CD1-CB 4.33Å; L151-F169 CarbonylContact C-O 3.55Å; L151-F169 WeakPolarHBondContact CA-O 3.28Å; L151-A176 VanDerWaalsContact C-CB 3.48Å
152	L	96.3	Very high	82	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.2	169.6	179.5	70.1	0	0	0	109.7	L154 M168 F169 C171 A176 I179 K180	L152-L154 HydrophobicContact CD1-CD2 4.03Å; L152-L154 HydrophobicContact CD2-CD1 4.42Å; L152-L154 HydrophobicContact CD2-CD2 4.13Å; L152-L154 HydrophobicContact CD2-CG 4.28Å; L152-L154 HydrophobicContact CG-CD2 3.97Å; L152-L154 HydrophobicContact CG-CG 4.22Å; L152-M168 WeakPolarHBondContact O-CA 3.34Å; L152-F169 HydrophobicContact CB-CB 4.34Å; L152-F169 HydrophobicContact CD2-CD2 4.37Å; L152-F169 PolarHBondContact N-O 2.89Å; L152-F169 PolarHBondContact O-N 3.36Å; L152-C171 VanDerWaalsContact CB-SG 3.54Å; L152-A176 HydrophobicContact CB-CB 4Å; L152-I179 HydrophobicContact CD2-CB 4.5Å; L152-I179 HydrophobicContact CD2-CG2 3.7Å; L152-K180 HydrophobicContact CD1-CB 3.99Å
153	V	96.1	Very high	81.4	Confident	1 Å²	1	69 Å²	69	1%	0.006	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121	178.1	-176.8	0	0	0	0	108.6	E87 V91 T139 R140 V142 L151 V166 F167 M168	E87-V153 HydrophobicContact CG-CG1 4.45Å; V91-V153 HydrophobicContact CG2-CG2 4.35Å; T139-V153 CarbonylContact C-O 3.41Å; R140-V153 HydrophobicContact CB-CB 4.27Å; R140-V153 PolarHBondContact N-O 3.07Å; R140-V153 PolarHBondContact O-N 3.12Å; V142-V153 HydrophobicContact CG2-CG2 4.11Å; L151-V153 HydrophobicContact CD2-CG2 4.03Å; L151-V153 HydrophobicContact CG-CG2 4.18Å; V153-V166 HydrophobicContact CG1-CG1 3.39Å; V153-F167 CarbonylContact C-O 3.59Å; V153-F167 WeakPolarHBondContact CA-O 3.42Å; V153-M168 HydrophobicContact CG1-CE 4.4Å; V153-M168 HydrophobicContact CG2-CG 4.41Å
154	L	96.4	Very high	81.6	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.5	178.6	-55.5	-177.2	0	0	0	110.1	T139 L152 V166 F167 F169 L183	T139-L154 HydrophobicContact CG2-CD2 3.84Å; L152-L154 HydrophobicContact CD1-CD2 4.03Å; L152-L154 HydrophobicContact CD2-CD1 4.42Å; L152-L154 HydrophobicContact CD2-CD2 4.13Å; L152-L154 HydrophobicContact CD2-CG 4.28Å; L152-L154 HydrophobicContact CG-CD2 3.97Å; L152-L154 HydrophobicContact CG-CG 4.22Å; L154-V166 CarbonylContact O-C 3.53Å; L154-V166 WeakPolarHBondContact O-CA 3.48Å; L154-F167 HydrophobicContact CB-CB 4.29Å; L154-F167 PolarHBondContact N-O 2.74Å; L154-F167 PolarHBondContact O-N 3.07Å; L154-F169 HydrophobicContact CD1-CD2 4.42Å; L154-F169 HydrophobicContact CD1-CE2 3.81Å; L154-F169 HydrophobicContact CG-CE2 4.19Å; L154-L183 HydrophobicContact CD1-CD2 4.08Å; L154-L183 HydrophobicContact CD2-CD2 3.42Å; L154-L183 VanDerWaalsContact CD2-CD2 3.42Å; L154-L183 HydrophobicContact CG-CD2 4.43Å
155	T	94.7	Very high	82.6	Confident	10 Å²	10	58.8 Å²	58.8	6%	0.061	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	116.5	176.5	-55.3	0	0	0	0	109.3	L79 E87 V137 K138 A164 Q165 V166	L79-T155 HydrophobicContact CD1-CG2 4.18Å; E87-T155 PolarHBondContact OE1-OG1 2.89Å; V137-T155 PolarHBondContact N-O 3.28Å; K138-T155 PolarHBondContact N-O 3.37Å; K138-T155 PolarHBondContact O-N 3.19Å; T155-A164 HydrophobicContact CG2-CB 3.89Å; T155-Q165 CarbonylContact C-O 3.54Å; T155-Q165 WeakPolarHBondContact CA-O 3.44Å; T155-V166 HydrophobicContact CG2-CG2 4.22Å
156	V	94.7	Very high	84.1	Confident	9 Å²	9	58.4 Å²	58.4	6%	0.055	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.9	-171.9	-175.7	0	0	0	0	109.5	I131 S135 I136 A164 Q165 F167	I131-V156 HydrophobicContact CG2-CG1 3.89Å; I131-V156 HydrophobicContact CG2-CG2 3.81Å; S135-V156 CarbonylContact O-C 3.48Å; S135-V156 WeakPolarHBondContact O-CA 3.34Å; S135-V156 WeakPolarHBondContact OG-CG1 3.36Å; I136-V156 HydrophobicContact CG1-CG2 4.37Å; V156-A164 CarbonylContact O-C 3.53Å; V156-A164 WeakPolarHBondContact O-CA 3.3Å; V156-Q165 PolarHBondContact N-O 2.96Å; V156-Q165 PolarHBondContact O-N 3.23Å; V156-F167 HydrophobicContact CB-CD2 4.43Å; V156-F167 HydrophobicContact CB-CE2 4.08Å; V156-F167 HydrophobicContact CG2-CD2 3.76Å; V156-F167 HydrophobicContact CG2-CE2 3.75Å
157	Q	91.2	Very high	85.6	Confident	74 Å²	74	54.9 Å²	54.9	35%	0.346	28%	0.279	S	S	.	.			trans	-111.2	109.3	173.9	-175.4	68.8	51.3	0	0	109.5	S135 V137 R161 A164	S135-Q157 PolarHBondContact O-N 3.1Å; V137-Q157 HydrophobicContact CG2-CB 3.37Å; Q157-R161 PolarHBondContact NE2-O 3.35Å; Q157-A164 VanDerWaalsContact OE1-CB 3.28Å
158	E	83.3	Confident	87	Confident	86 Å²	86	51.9 Å²	51.9	40%	0.402	25%	0.254	S	S	.	.			trans	-90.4	129.5	173.2	-163.5	175.8	-161.5	0	0	109.9	R160 R161	E158-R160 PolarHBondContact O-N 3.15Å; E158-R161 HydrophobicContact CB-CG 4.34Å; E158-R161 PolarHBondContact O-N 2.95Å; E158-R161 IonicContact OE2-NE 2.99Å; E158-R161 PolarHBondContact OE2-NE 3.24Å
159	G	70	Confident	87.8	Confident	88 Å²	88	51.2 Å²	51.2	91%	0.907	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-9.9	-173.3	0	0	0	0	0	115.6
160	R	66.4	Low	88.5	Confident	241 Å²	241	47.6 Å²	47.6	91%	0.909	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-15.9	175.2	-64	-175.8	178.5	-165.1	0.9	113.4	E158	E158-R160 PolarHBondContact O-N 3.15Å
161	R	72.6	Confident	88.6	Confident	112 Å²	112	46.9 Å²	46.9	42%	0.423	23%	0.226	S	C	.	.	S	Bend	trans	-98.9	144.5	-177	-65.7	-170.8	-176.4	-128.2	3.7	111	E78 Q157 E158 G163	E78-R161 IonicContact OE1-NH1 2.59Å; E78-R161 PolarHBondContact OE1-NH1 2.89Å; Q157-R161 PolarHBondContact NE2-O 3.35Å; E158-R161 HydrophobicContact CB-CG 4.34Å; E158-R161 PolarHBondContact O-N 2.95Å; E158-R161 IonicContact OE2-NE 2.99Å; E158-R161 PolarHBondContact OE2-NE 3.24Å; R161-G163 VanDerWaalsContact C-N 3.3Å; R161-G163 PolarHBondContact O-N 2.84Å
162	R	68.9	Low	88.2	Confident	264 Å²	264	53.4 Å²	53.4	100%	0.996	26%	0.256	S	S	*	.	S	Bend	trans	-78.5	-9.7	178.9	-69.7	-171.7	178.2	-167.8	0.2	113.9
163	G	79.3	Confident	87.7	Confident	24 Å²	24	60.3 Å²	60.3	25%	0.247	29%	0.289	C	S	.	.	S	Bend	trans	-138.8	157.4	179.5	0	0	0	0	0	112.1	R161	R161-G163 VanDerWaalsContact C-N 3.3Å; R161-G163 PolarHBondContact O-N 2.84Å
164	A	89.8	Confident	87.3	Confident	12 Å²	12	62.7 Å²	62.7	10%	0.099	30%	0.304	C	S	.	.			trans	-81.1	143.4	175.1	0	0	0	0	0	110	L79 T155 V156 Q157	L79-A164 HydrophobicContact CB-CB 4.43Å; L79-A164 WeakPolarHBondContact CB-O 3.41Å; L79-A164 HydrophobicContact CD1-CB 4.09Å; L79-A164 PolarHBondContact N-O 2.77Å; T155-A164 HydrophobicContact CG2-CB 3.89Å; V156-A164 CarbonylContact O-C 3.53Å; V156-A164 WeakPolarHBondContact O-CA 3.3Å; Q157-A164 VanDerWaalsContact OE1-CB 3.28Å
165	Q	93.6	Very high	87	Confident	31 Å²	31	63.6 Å²	63.6	15%	0.145	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	142.9	171.2	-63.1	-170.5	-54.6	0	0	109.9	I76 C77 E78 T155 V156 F167	I76-Q165 HydrophobicContact CG2-CB 4.39Å; C77-Q165 CarbonylContact O-C 3.52Å; C77-Q165 VanDerWaalsContact O-CA 3.3Å; C77-Q165 WeakPolarHBondContact O-CA 3.08Å; E78-Q165 HydrophobicContact CG-CG 4.27Å; E78-Q165 PolarHBondContact OE1-NE2 2.74Å; T155-Q165 CarbonylContact C-O 3.54Å; T155-Q165 WeakPolarHBondContact CA-O 3.44Å; V156-Q165 PolarHBondContact N-O 2.96Å; V156-Q165 PolarHBondContact O-N 3.23Å; Q165-F167 HydrophobicContact CB-CD2 4.49Å; Q165-F167 HydrophobicContact CB-CE2 3.94Å
166	V	95.1	Very high	87	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	110.8	179.7	178.8	0	0	0	0	107.9	I76 C77 L79 C90 V153 L154 T155 M168	I76-V166 WeakPolarHBondContact CA-O 3.43Å; C77-V166 HydrophobicContact CB-CB 4.37Å; C77-V166 PolarHBondContact N-O 2.77Å; C77-V166 PolarHBondContact O-N 3.06Å; L79-V166 HydrophobicContact CD1-CG2 3.59Å; L79-V166 HydrophobicContact CD2-CG2 4.09Å; L79-V166 HydrophobicContact CG-CG2 3.6Å; C90-V166 HydrophobicContact CB-CG1 4.4Å; V153-V166 HydrophobicContact CG1-CG1 3.39Å; L154-V166 CarbonylContact O-C 3.53Å; L154-V166 WeakPolarHBondContact O-CA 3.48Å; T155-V166 HydrophobicContact CG2-CG2 4.22Å; V166-M168 HydrophobicContact CG1-CE 3.65Å; V166-M168 HydrophobicContact CG1-CG 4.43Å
167	F	96.8	Very high	86.9	Confident	6 Å²	6	68.2 Å²	68.2	3%	0.026	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	139.8	175.4	-64	-108.8	0	0	0	109.6	I76 I131 V153 L154 V156 Q165 F169	I76-F167 HydrophobicContact CD1-CD1 3.81Å; I76-F167 HydrophobicContact CD1-CE1 3.48Å; I76-F167 VanDerWaalsContact CD1-CE1 3.48Å; I76-F167 HydrophobicContact CD1-CZ 4.27Å; I76-F167 HydrophobicContact CG1-CD1 3.75Å; I76-F167 HydrophobicContact CG1-CE1 3.94Å; I76-F167 HydrophobicContact CG1-CG 4.42Å; I76-F167 HydrophobicContact CG2-CD1 4.43Å; I76-F167 HydrophobicContact CG2-CE1 4.33Å; I76-F167 HydrophobicContact CG2-CE2 4.44Å; I76-F167 HydrophobicContact CG2-CZ 4.32Å; I131-F167 HydrophobicContact CD1-CD1 4.17Å; I131-F167 HydrophobicContact CD1-CD2 4.34Å; I131-F167 HydrophobicContact CD1-CE1 3.91Å; I131-F167 HydrophobicContact CD1-CE2 4.12Å; I131-F167 HydrophobicContact CD1-CG 4.38Å; I131-F167 HydrophobicContact CD1-CZ 3.9Å; I131-F167 HydrophobicContact CG1-CZ 4.42Å; V153-F167 CarbonylContact C-O 3.59Å; V153-F167 WeakPolarHBondContact CA-O 3.42Å; L154-F167 HydrophobicContact CB-CB 4.29Å; L154-F167 PolarHBondContact N-O 2.74Å; L154-F167 PolarHBondContact O-N 3.07Å; V156-F167 HydrophobicContact CB-CD2 4.43Å; V156-F167 HydrophobicContact CB-CE2 4.08Å; V156-F167 HydrophobicContact CG2-CD2 3.76Å; V156-F167 HydrophobicContact CG2-CE2 3.75Å; Q165-F167 HydrophobicContact CB-CD2 4.49Å; Q165-F167 HydrophobicContact CB-CE2 3.94Å; F167-F169 HydrophobicContact CB-CD2 4.38Å; F167-F169 HydrophobicContact CB-CE2 3.46Å; F167-F169 VanDerWaalsContact CB-CE2 3.46Å; F167-F169 HydrophobicContact CB-CZ 3.87Å; F167-F169 HydrophobicContact CD1-CZ 4.19Å; F167-F169 HydrophobicContact CG-CE2 4.41Å; F167-F169 HydrophobicContact CG-CZ 4.44Å
168	M	95.8	Very high	86.9	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125.7	-178.7	-63.3	-173.2	177.6	0	0	111	L74 L75 C90 V91 L94 L151 L152 V153 V166	L74-M168 PolarHBondContact N-O 2.89Å; L75-M168 PolarHBondContact O-N 3.5Å; C90-M168 HydrophobicContact CB-CE 3.2Å; V91-M168 HydrophobicContact CG2-CE 3.97Å; L94-M168 HydrophobicContact CB-SD 4.02Å; L94-M168 HydrophobicContact CD1-SD 4.48Å; L94-M168 HydrophobicContact CD2-SD 3.91Å; L94-M168 HydrophobicContact CG-SD 4.37Å; L151-M168 HydrophobicContact CD1-CB 4.33Å; L152-M168 WeakPolarHBondContact O-CA 3.34Å; V153-M168 HydrophobicContact CG1-CE 4.4Å; V153-M168 HydrophobicContact CG2-CG 4.41Å; V166-M168 HydrophobicContact CG1-CE 3.65Å; V166-M168 HydrophobicContact CG1-CG 4.43Å
169	F	96.2	Very high	87.4	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	134.1	-178.4	-53	-92.2	0	0	0	110.9	V71 E72 H73 M108 L119 L151 L152 L154 F167	V71-F169 HydrophobicContact CB-CB 4.24Å; V71-F169 HydrophobicContact CB-CD1 4.42Å; V71-F169 HydrophobicContact CG2-CB 4.47Å; V71-F169 HydrophobicContact CG2-CD1 3.77Å; V71-F169 HydrophobicContact CG2-CE1 4.41Å; V71-F169 HydrophobicContact CG2-CG 4.39Å; E72-F169 CarbonylContact O-C 3.57Å; E72-F169 VanDerWaalsContact O-CA 3.23Å; E72-F169 WeakPolarHBondContact O-CA 3.48Å; H73-F169 HydrophobicContact CB-CD1 3.89Å; H73-F169 HydrophobicContact CB-CE1 3.95Å; H73-F169 AromaticContact CD2-CE1 3.53Å; H73-F169 AromaticContact CD2-CZ 3.99Å; M108-F169 HydrophobicContact SD-CD1 4.48Å; M108-F169 HydrophobicContact SD-CE1 3.98Å; L119-F169 HydrophobicContact CD1-CE1 4.1Å; L119-F169 HydrophobicContact CD1-CZ 4.09Å; L119-F169 HydrophobicContact CD2-CE1 4.09Å; L119-F169 HydrophobicContact CD2-CZ 4.21Å; L151-F169 CarbonylContact C-O 3.55Å; L151-F169 WeakPolarHBondContact CA-O 3.28Å; L152-F169 HydrophobicContact CB-CB 4.34Å; L152-F169 HydrophobicContact CD2-CD2 4.37Å; L152-F169 PolarHBondContact N-O 2.89Å; L152-F169 PolarHBondContact O-N 3.36Å; L154-F169 HydrophobicContact CD1-CD2 4.42Å; L154-F169 HydrophobicContact CD1-CE2 3.81Å; L154-F169 HydrophobicContact CG-CE2 4.19Å; F167-F169 HydrophobicContact CB-CD2 4.38Å; F167-F169 HydrophobicContact CB-CE2 3.46Å; F167-F169 VanDerWaalsContact CB-CE2 3.46Å; F167-F169 HydrophobicContact CB-CZ 3.87Å; F167-F169 HydrophobicContact CD1-CZ 4.19Å; F167-F169 HydrophobicContact CG-CE2 4.41Å; F167-F169 HydrophobicContact CG-CZ 4.44Å
170	Q	94.8	Very high	88.6	Confident	27 Å²	27	63.8 Å²	63.8	13%	0.126	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.1	163.6	170	171.2	-3.2	0	0	109.5	E72 L74 Y148 S150 E172	E72-Q170 HydrophobicContact CB-CB 4.22Å; E72-Q170 PolarHBondContact N-O 2.91Å; E72-Q170 PolarHBondContact O-N 2.77Å; E72-Q170 PolarHBondContact OE2-OE1 3.48Å; E72-Q170 VanDerWaalsContact OE2-OE1 3.08Å; L74-Q170 HydrophobicContact CD1-CB 4.08Å; L74-Q170 HydrophobicContact CD2-CB 4.41Å; L74-Q170 HydrophobicContact CG-CB 4.35Å; Y148-Q170 HydrophobicContact CD1-CB 4.39Å; Y148-Q170 HydrophobicContact CD1-CG 4.44Å; S150-Q170 WeakPolarHBondContact O-CA 3.36Å; Q170-E172 HydrophobicContact CG-CB 4.48Å; Q170-E172 PolarHBondContact NE2-OE2 3.5Å
171	C	93.9	Very high	89.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.263	C	S	.	.			trans	-127.8	56.2	-172.2	-59.3	0	0	0	0	110.6	S150 L152 G175 A176 I179	S150-C171 PolarHBondContact O-N 3.3Å; L152-C171 VanDerWaalsContact CB-SG 3.54Å; C171-G175 WeakPolarHBondContact O-CA 3.45Å; C171-G175 PolarHBondContact O-N 3.32Å; C171-A176 HydrophobicContact CB-CB 4.07Å; C171-I179 HydrophobicContact CB-CD1 3.62Å
172	E	86.8	Confident	90.7	Very high	136 Å²	136	51.8 Å²	51.8	64%	0.636	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-35.1	-173.9	-172.8	169.4	176.8	0	0	113.4	Q170	Q170-E172 HydrophobicContact CG-CB 4.48Å; Q170-E172 PolarHBondContact NE2-OE2 3.5Å
173	E	85.1	Confident	91.8	Very high	146 Å²	146	39.2 Å²	39.2	68%	0.682	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-52.5	-175.4	-173.6	174.5	178	0	0	112.8	R70	R70-E173 WeakPolarHBondContact CB-OE2 3.47Å; R70-E173 WeakPolarHBondContact CD-OE2 3.08Å
174	T	88.2	Confident	92.4	Very high	51 Å²	51	40 Å²	40	31%	0.313	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-23.8	-176.7	-46.6	0	0	0	0	113	V69 I178 I179	V69-T174 HydrophobicContact CG1-CG2 4.17Å; T174-I178 HydrophobicContact CG2-CB 4.45Å; T174-I178 HydrophobicContact CG2-CG2 4.09Å; T174-I178 WeakPolarHBondContact O-CD1 3.45Å; T174-I179 HydrophobicContact CG2-CG1 4.01Å
175	G	90.5	Very high	92.4	Very high	18 Å²	18	44.7 Å²	44.7	19%	0.186	23%	0.227	C	C	.	.			trans	86.4	129.8	-174.1	0	0	0	0	0	113.2	C171 E177 I178 I179	C171-G175 WeakPolarHBondContact O-CA 3.45Å; C171-G175 PolarHBondContact O-N 3.32Å; G175-E177 VanDerWaalsContact C-N 3.28Å; G175-E177 PolarHBondContact O-N 2.85Å; G175-I178 PolarHBondContact O-N 3.39Å; G175-I179 WeakPolarHBondContact O-CG1 3.31Å; G175-I179 PolarHBondContact O-N 3.23Å
176	A	94.3	Very high	92.2	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-31.7	-178.1	0	0	0	0	0	113.4	A141 S150 L151 L152 C171 K180	A141-A176 HydrophobicContact CB-CB 3.97Å; S150-A176 WeakPolarHBondContact OG-CB 3.12Å; S150-A176 PolarHBondContact OG-N 2.99Å; L151-A176 VanDerWaalsContact C-CB 3.48Å; L152-A176 HydrophobicContact CB-CB 4Å; C171-A176 HydrophobicContact CB-CB 4.07Å; A176-K180 WeakPolarHBondContact O-CB 3.47Å; A176-K180 PolarHBondContact O-N 2.79Å
177	E	92.7	Very high	91.9	Very high	117 Å²	117	46 Å²	46	55%	0.547	24%	0.237	S	C	.	.	H	α-helix	trans	-66.9	-41	178	-73	-166.4	159.7	0	0	112.9	A141 L143 G175 A181	A141-E177 HydrophobicContact CB-CB 4.46Å; A141-E177 HydrophobicContact CB-CG 3.79Å; L143-E177 HydrophobicContact CD1-CG 4.17Å; L143-E177 VanDerWaalsContact CD1-OE1 3.29Å; L143-E177 WeakPolarHBondContact CD1-OE1 3.31Å; L143-E177 HydrophobicContact CD2-CG 4.22Å; L143-E177 HydrophobicContact CG-CG 4.36Å; G175-E177 VanDerWaalsContact C-N 3.28Å; G175-E177 PolarHBondContact O-N 2.85Å; E177-A181 WeakPolarHBondContact O-CB 3.41Å; E177-A181 PolarHBondContact O-N 3.23Å
178	I	90.7	Very high	91.4	Very high	96 Å²	96	52.8 Å²	52.8	49%	0.492	27%	0.269	S	S	.	.	H	α-helix	trans	-67.2	-50.5	178.8	-66	173.3	0	0	0	108.8	T174 G175 K180 A181 D182	T174-I178 HydrophobicContact CG2-CB 4.45Å; T174-I178 HydrophobicContact CG2-CG2 4.09Å; T174-I178 WeakPolarHBondContact O-CD1 3.45Å; G175-I178 PolarHBondContact O-N 3.39Å; I178-K180 VanDerWaalsContact C-N 3.3Å; I178-K180 PolarHBondContact O-N 3.43Å; I178-A181 PolarHBondContact O-N 3.23Å; I178-A181 VanDerWaalsContact O-N 3.15Å; I178-D182 PolarHBondContact O-N 2.85Å
179	I	93.4	Very high	90.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.2	-44.2	178.3	-60.2	172.6	0	0	0	110.8	F67 V69 V71 L152 C171 T174 G175 D182 L183	F67-I179 HydrophobicContact CE2-CG2 4.07Å; F67-I179 HydrophobicContact CZ-CG2 3.63Å; V69-I179 HydrophobicContact CB-CD1 4.25Å; V69-I179 HydrophobicContact CB-CG1 4.43Å; V69-I179 HydrophobicContact CG1-CG1 4.25Å; V69-I179 HydrophobicContact CG2-CD1 3.94Å; V69-I179 HydrophobicContact CG2-CG1 4.14Å; V69-I179 HydrophobicContact CG2-CG2 4.17Å; V71-I179 HydrophobicContact CG1-CD1 4.02Å; L152-I179 HydrophobicContact CD2-CB 4.5Å; L152-I179 HydrophobicContact CD2-CG2 3.7Å; C171-I179 HydrophobicContact CB-CD1 3.62Å; T174-I179 HydrophobicContact CG2-CG1 4.01Å; G175-I179 WeakPolarHBondContact O-CG1 3.31Å; G175-I179 PolarHBondContact O-N 3.23Å; I179-D182 PolarHBondContact O-N 3.01Å; I179-L183 VanDerWaalsContact O-CB 3.3Å; I179-L183 WeakPolarHBondContact O-CB 3.34Å; I179-L183 PolarHBondContact O-N 3.25Å
180	K	95	Very high	89	Confident	58 Å²	58	63 Å²	63	25%	0.252	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-49.5	175.7	-178.9	-156	-179.9	-72.1	0	111.6	T139 A141 L152 A176 I178 D182 L183 D184	T139-K180 VanDerWaalsContact O-CE 3.31Å; T139-K180 WeakPolarHBondContact O-CE 3.35Å; T139-K180 VanDerWaalsContact OG1-CG 3.3Å; T139-K180 WeakPolarHBondContact OG1-CG 3.35Å; A141-K180 HydrophobicContact CB-CB 4.44Å; A141-K180 HydrophobicContact CB-CD 4.06Å; L152-K180 HydrophobicContact CD1-CB 3.99Å; A176-K180 WeakPolarHBondContact O-CB 3.47Å; A176-K180 PolarHBondContact O-N 2.79Å; I178-K180 VanDerWaalsContact C-N 3.3Å; I178-K180 PolarHBondContact O-N 3.43Å; K180-D182 VanDerWaalsContact C-N 3.29Å; K180-D182 PolarHBondContact O-N 2.75Å; K180-L183 PolarHBondContact O-N 2.88Å; K180-D184 IonicContact NZ-OD2 2.78Å; K180-D184 PolarHBondContact NZ-OD2 3.26Å; K180-D184 WeakPolarHBondContact O-CB 3.33Å; K180-D184 VanDerWaalsContact O-CG 3.32Å; K180-D184 PolarHBondContact O-N 3.19Å
181	A	92	Very high	87.1	Confident	42 Å²	42	65 Å²	65	35%	0.347	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-39.2	-177.4	0	0	0	0	0	112	E177 I178 K185	E177-A181 WeakPolarHBondContact O-CB 3.41Å; E177-A181 PolarHBondContact O-N 3.23Å; I178-A181 PolarHBondContact O-N 3.23Å; I178-A181 VanDerWaalsContact O-N 3.15Å; A181-K185 WeakPolarHBondContact O-CG 3.48Å; A181-K185 PolarHBondContact O-N 3.49Å
182	D	90.9	Very high	84.9	Confident	59 Å²	59	69.2 Å²	69.2	32%	0.316	38%	0.381	S	S	.	.	H	α-helix	trans	-74.2	-37.3	178.1	-69.9	-21.9	0	0	0	112.2	F67 I178 I179 K180 K185 A186	F67-D182 HydrophobicContact CD2-CB 3.61Å; F67-D182 HydrophobicContact CE2-CB 3.57Å; I178-D182 PolarHBondContact O-N 2.85Å; I179-D182 PolarHBondContact O-N 3.01Å; K180-D182 VanDerWaalsContact C-N 3.29Å; K180-D182 PolarHBondContact O-N 2.75Å; D182-K185 WeakPolarHBondContact O-CB 3.38Å; D182-K185 PolarHBondContact O-N 3.22Å; D182-K185 IonicContact OD1-NZ 2.72Å; D182-K185 PolarHBondContact OD1-NZ 2.86Å; D182-A186 PolarHBondContact O-N 2.81Å
183	L	92.3	Very high	83.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-64	-41.1	172.9	-174.1	61.2	0	0	0	111.7	F67 I112 V117 L133 I136 T139 L154 I179 K180 K185 A186 I187	F67-L183 HydrophobicContact CZ-CB 4.27Å; I112-L183 HydrophobicContact CD1-CD1 4.03Å; I112-L183 HydrophobicContact CG1-CD1 4.49Å; V117-L183 HydrophobicContact CG2-CD1 3.52Å; L133-L183 HydrophobicContact CD2-CD1 3.81Å; I136-L183 HydrophobicContact CD1-CD1 4.36Å; I136-L183 HydrophobicContact CD1-CD2 4.4Å; T139-L183 HydrophobicContact CG2-CD2 3.76Å; T139-L183 HydrophobicContact CG2-CG 4.16Å; L154-L183 HydrophobicContact CD1-CD2 4.08Å; L154-L183 HydrophobicContact CD2-CD2 3.42Å; L154-L183 VanDerWaalsContact CD2-CD2 3.42Å; L154-L183 HydrophobicContact CG-CD2 4.43Å; I179-L183 VanDerWaalsContact O-CB 3.3Å; I179-L183 WeakPolarHBondContact O-CB 3.34Å; I179-L183 PolarHBondContact O-N 3.25Å; K180-L183 PolarHBondContact O-N 2.88Å; L183-K185 VanDerWaalsContact C-N 3.33Å; L183-K185 PolarHBondContact O-N 3.34Å; L183-A186 PolarHBondContact O-N 3.37Å; L183-A186 VanDerWaalsContact O-N 3.14Å; L183-I187 HydrophobicContact CD1-CD1 4.39Å; L183-I187 HydrophobicContact CD1-CG1 4.43Å; L183-I187 HydrophobicContact CG-CD1 3.91Å; L183-I187 HydrophobicContact CG-CG1 4.41Å; L183-I187 VanDerWaalsContact O-CG1 3.27Å; L183-I187 WeakPolarHBondContact O-CG1 3.17Å; L183-I187 PolarHBondContact O-N 2.79Å
184	D	92.6	Very high	81	Confident	41 Å²	41	71.9 Å²	71.9	22%	0.219	40%	0.4	C	S	.	.	H	α-helix	trans	-61.1	-41.3	175.5	-76.4	-20.7	0	0	0	111.7	T139 K180 A186 I187 Q188	T139-D184 WeakPolarHBondContact CG2-OD1 3.32Å; T139-D184 VanDerWaalsContact OG1-CG 3.27Å; T139-D184 PolarHBondContact OG1-OD1 3.45Å; T139-D184 PolarHBondContact OG1-OD2 3.13Å; K180-D184 IonicContact NZ-OD2 2.78Å; K180-D184 PolarHBondContact NZ-OD2 3.26Å; K180-D184 WeakPolarHBondContact O-CB 3.33Å; K180-D184 VanDerWaalsContact O-CG 3.32Å; K180-D184 PolarHBondContact O-N 3.19Å; D184-A186 VanDerWaalsContact C-N 3.33Å; D184-A186 PolarHBondContact O-N 3.16Å; D184-I187 PolarHBondContact O-N 3.19Å; D184-Q188 WeakPolarHBondContact O-CB 3.45Å; D184-Q188 VanDerWaalsContact O-CG 3.23Å; D184-Q188 WeakPolarHBondContact O-CG 3.49Å; D184-Q188 PolarHBondContact O-N 3.06Å
185	K	89.8	Confident	78.3	Confident	110 Å²	110	77.9 Å²	77.9	48%	0.478	43%	0.425	S	S	.	.	H	α-helix	trans	-61.8	-42.5	173.4	-68.8	168.8	-159.9	158.4	0	111.2	A181 D182 L183 Q188 R189	A181-K185 WeakPolarHBondContact O-CG 3.48Å; A181-K185 PolarHBondContact O-N 3.49Å; D182-K185 WeakPolarHBondContact O-CB 3.38Å; D182-K185 PolarHBondContact O-N 3.22Å; D182-K185 IonicContact OD1-NZ 2.72Å; D182-K185 PolarHBondContact OD1-NZ 2.86Å; L183-K185 VanDerWaalsContact C-N 3.33Å; L183-K185 PolarHBondContact O-N 3.34Å; K185-Q188 PolarHBondContact O-N 3.23Å; K185-R189 WeakPolarHBondContact O-CG 3.44Å; K185-R189 PolarHBondContact O-N 3.31Å
186	A	88.4	Confident	75.9	Confident	18 Å²	18	81.9 Å²	81.9	15%	0.149	45%	0.447	C	S	.	.	H	α-helix	trans	-68.5	-40	-179.8	0	0	0	0	0	112.8	I112 D182 L183 D184 Q188 R189 G190	I112-A186 HydrophobicContact CD1-CB 3.44Å; I112-A186 VanDerWaalsContact CD1-CB 3.44Å; D182-A186 PolarHBondContact O-N 2.81Å; L183-A186 PolarHBondContact O-N 3.37Å; L183-A186 VanDerWaalsContact O-N 3.14Å; D184-A186 VanDerWaalsContact C-N 3.33Å; D184-A186 PolarHBondContact O-N 3.16Å; A186-Q188 VanDerWaalsContact C-N 3.31Å; A186-Q188 PolarHBondContact O-N 2.9Å; A186-R189 PolarHBondContact O-N 2.8Å; A186-G190 PolarHBondContact O-N 3.06Å
187	I	89.3	Confident	72.8	Confident	41 Å²	41	93.6 Å²	93.6	21%	0.21	49%	0.492	C	S	.	.	H	α-helix	trans	-61.5	-41.5	174	-67.2	165	0	0	0	110.3	L133 I136 T139 L183 D184 G190 G191	L133-I187 HydrophobicContact CD2-CG1 3.86Å; I136-I187 HydrophobicContact CB-CD1 3.9Å; I136-I187 HydrophobicContact CD1-CD1 4.29Å; I136-I187 HydrophobicContact CG2-CD1 3.71Å; T139-I187 HydrophobicContact CG2-CD1 3.83Å; L183-I187 HydrophobicContact CD1-CD1 4.39Å; L183-I187 HydrophobicContact CD1-CG1 4.43Å; L183-I187 HydrophobicContact CG-CD1 3.91Å; L183-I187 HydrophobicContact CG-CG1 4.41Å; L183-I187 VanDerWaalsContact O-CG1 3.27Å; L183-I187 WeakPolarHBondContact O-CG1 3.17Å; L183-I187 PolarHBondContact O-N 2.79Å; D184-I187 PolarHBondContact O-N 3.19Å; I187-G190 PolarHBondContact O-N 3.36Å; I187-G191 PolarHBondContact O-N 2.86Å
188	Q	85.7	Confident	70	Confident	149 Å²	149	98 Å²	98	70%	0.696	50%	0.503	S	S	*	.	H	α-helix	trans	-64.7	-40.7	175.7	-71.8	170.2	27.7	0	0	112.5	D184 K185 A186	D184-Q188 WeakPolarHBondContact O-CB 3.45Å; D184-Q188 VanDerWaalsContact O-CG 3.23Å; D184-Q188 WeakPolarHBondContact O-CG 3.49Å; D184-Q188 PolarHBondContact O-N 3.06Å; K185-Q188 PolarHBondContact O-N 3.23Å; A186-Q188 VanDerWaalsContact C-N 3.31Å; A186-Q188 PolarHBondContact O-N 2.9Å
189	R	79.9	Confident	67	Low	163 Å²	163	102.6 Å²	102.6	62%	0.615	53%	0.525	S	S	*	.	H	α-helix	trans	-68.4	-38.7	176.5	-72.2	-179.3	-177.1	-161.7	5.7	112.6	D65 K185 A186 G191 S192	D65-R189 IonicContact OD2-NH1 2.98Å; D65-R189 PolarHBondContact OD2-NH1 2.87Å; D65-R189 VanDerWaalsContact OD2-NH1 3.13Å; K185-R189 WeakPolarHBondContact O-CG 3.44Å; K185-R189 PolarHBondContact O-N 3.31Å; A186-R189 PolarHBondContact O-N 2.8Å; R189-G191 PolarHBondContact O-N 2.92Å; R189-S192 PolarHBondContact O-N 3.24Å; R189-S192 PolarHBondContact O-OG 3.33Å
190	G	63.3	Low	64	Low	50 Å²	50	107.8 Å²	107.8	52%	0.515	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.4	-7.1	179.6	0	0	0	0	0	115.1	A186 I187	A186-G190 PolarHBondContact O-N 3.06Å; I187-G190 PolarHBondContact O-N 3.36Å
191	G	53.6	Low	61.1	Low	70 Å²	70	111 Å²	111	72%	0.722	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-15.6	176	0	0	0	0	0	114.8	I187 R189	I187-G191 PolarHBondContact O-N 2.86Å; R189-G191 PolarHBondContact O-N 2.92Å
192	S	49.2	Very low	58	Low	89 Å²	89	116.6 Å²	116.6	62%	0.622	61%	0.608	S	S	*	*	S	Bend	trans	-104.2	98.9	177	55.5	0	0	0	0	110.9	R189	R189-S192 PolarHBondContact O-N 3.24Å; R189-S192 PolarHBondContact O-OG 3.33Å
193	D	48.8	Very low	55.1	Low	154 Å²	154	121.5 Å²	121.5	82%	0.824	63%	0.632	S	S	*	*			trans	51.4	76.7	155.4	-133.1	10.6	0	0	0	117.2
194	M	39.4	Very low	52.2	Low	183 Å²	183	126.2 Å²	126.2	90%	0.901	67%	0.665	S	S	*	*			trans	-130.6	98.4	149.7	-100.1	-156.3	154.8	0	0	109.1
195	E	32.6	Very low	49.1	Very low	178 Å²	178	135.9 Å²	135.9	83%	0.832	70%	0.698	S	S	*	*			trans	-55.9	138.5	164.9	-94.9	-167	145.8	0	0	110.3	R197	E195-R197 PolarHBondContact O-N 3.35Å; E195-R197 VanDerWaalsContact O-N 3.11Å
196	P	39.3	Very low	46.1	Very low	101 Å²	101	140 Å²	140	66%	0.656	72%	0.72	S	S	*	*			trans	-71.3	111	175.6	28.1	-30.2	0	0	0	109	R198	P196-R198 VanDerWaalsContact C-N 3.28Å; P196-R198 PolarHBondContact O-N 3.09Å
197	R	29.4	Very low	43	Very low	246 Å²	246	144.3 Å²	144.3	93%	0.928	75%	0.748	S	S	*	*			trans	-62	94.6	164.2	-133	-178.1	-173.4	176.9	2.1	107.7	E195 M199	E195-R197 PolarHBondContact O-N 3.35Å; E195-R197 VanDerWaalsContact O-N 3.11Å; R197-M199 PolarHBondContact O-N 3.3Å; R197-M199 VanDerWaalsContact O-N 3.1Å
198	R	33.9	Very low	40	Very low	211 Å²	211	148.1 Å²	148.1	80%	0.796	77%	0.774	S	S	*	*			trans	-59.6	108.5	167.9	-68.1	-176.8	-175.9	-179.5	2.4	107.8	P196 T200	P196-R198 VanDerWaalsContact C-N 3.28Å; P196-R198 PolarHBondContact O-N 3.09Å; R198-T200 VanDerWaalsContact C-N 3.27Å; R198-T200 PolarHBondContact O-N 3.34Å
199	M	27.5	Very low	37.1	Very low	192 Å²	192	147.7 Å²	147.7	95%	0.946	78%	0.782	S	S	*	*			trans	-88.2	77.2	154.1	-86.5	-166.5	164.7	0	0	108.1	R197	R197-M199 PolarHBondContact O-N 3.3Å; R197-M199 VanDerWaalsContact O-N 3.1Å
200	T	31.1	Very low	34.5	Very low	108 Å²	108	143.6 Å²	143.6	66%	0.663	79%	0.79	S	S	*	*			trans	-77.8	130	153.8	32.8	0	0	0	0	108	R198 D202	R198-T200 VanDerWaalsContact C-N 3.27Å; R198-T200 PolarHBondContact O-N 3.34Å; T200-D202 PolarHBondContact O-N 2.77Å
201	P	34.6	Very low	32.8	Very low	127 Å²	127	151.2 Å²	151.2	83%	0.825	81%	0.809	S	S	*	*			trans	-68.5	129.1	170.8	-12.1	26.8	0	0	0	109.8	I203	P201-I203 PolarHBondContact O-N 2.8Å
202	D	26.8	Very low	31.5	Very low	158 Å²	158	159.1 Å²	159.1	85%	0.845	82%	0.817	S	S	*	*			trans	-78.5	115.5	-176.7	-147.7	-12.4	0	0	0	110.3	T200	T200-D202 PolarHBondContact O-N 2.77Å
203	I	30.4	Very low	30.3	Very low	163 Å²	163	164.8 Å²	164.8	84%	0.836	83%	0.825	S	S	*	*			trans	-127.3	98.5	152.8	-66.6	-177.9	0	0	0	107.8	P201	P201-I203 PolarHBondContact O-N 2.8Å
204	S	30	Very low	29.2	Very low	98 Å²	98	162.6 Å²	162.6	69%	0.685	81%	0.81	S	S	*	*			trans	25.6	120.5	140.9	-91.4	0	0	0	0	118
205	R	28.4	Very low	28.5	Very low	244 Å²	244	162.9 Å²	162.9	92%	0.921	80%	0.801	S	S	*	*				-171.6	101.5	126.4	-107.2	168.7	149.2	-163.9	-8.6	111.6
206	Q	25.7	Very low	28.2	Very low	198 Å²	198	162.2 Å²	162.2	93%	0.925	80%	0.795	S	S	*	*			trans	-133.7	108.5	149	-76.6	-172.2	11.6	0	0	109.8
207	S	24.2	Very low	27.7	Very low	107 Å²	107	162.5 Å²	162.5	75%	0.748	80%	0.8	S	S	*	*			trans	-122.9	142.5	144	-44.3	0	0	0	0	107.2
208	T	25.7	Very low	27.9	Very low	122 Å²	122	156.3 Å²	156.3	75%	0.748	79%	0.791	S	S	*	*			trans	86.2	93.2	155.5	61.6	0	0	0	0	118.7
209	T	25.5	Very low	27.5	Very low	140 Å²	140	151.7 Å²	151.7	86%	0.859	79%	0.787	S	S	*	*				65.3	129.3	117.4	56.6	0	0	0	0	119.8
210	G	25.6	Very low	27.5	Very low	76 Å²	76	149.9 Å²	149.9	78%	0.784	78%	0.776	S	S	*	*			trans	156.9	87.7	147.9	0	0	0	0	0	115.9
211	F	26.7	Very low	27.4	Very low	211 Å²	211	151.2 Å²	151.2	93%	0.925	77%	0.774	S	S	*	*			trans	-59.3	138.9	168.7	-74	-99.7	0	0	0	114.2
212	R	25.7	Very low	27	Very low	236 Å²	236	152.4 Å²	152.4	89%	0.891	77%	0.769	S	S	*	*				165.8	119.5	124.8	-105.6	-178.7	165.3	-175	-4.5	109.6
213	R	25.2	Very low	27	Very low	208 Å²	208	153 Å²	153	79%	0.785	77%	0.767	S	S	*	*				47.4	125.8	80.1	-107.2	-174.2	-170.7	-147.3	13.8	110.9
214	E	25.3	Very low	26.8	Very low	108 Å²	108	151.5 Å²	151.5	51%	0.505	76%	0.76	S	S	.	*			cis	170.5	140.7	40	-152	177.7	-112.8	0	0	102.5
215	R	25.3	Very low	27	Very low	189 Å²	189	154.7 Å²	154.7	71%	0.713	77%	0.769	S	S	*	*				157.9	133.5	92.6	-93.5	-173.2	177	-140.2	-7.4	112.2
216	F	26.1	Very low	27.6	Very low	163 Å²	163	148.8 Å²	148.8	72%	0.715	76%	0.762	S	S	*	*			trans	68	120.7	133.6	-59.9	-55.8	0	0	0	125.1
217	S	28.6	Very low	28.7	Very low	108 Å²	108	144.8 Å²	144.8	76%	0.755	75%	0.753	S	S	*	*			trans	-60	172	149.2	-41.3	0	0	0	0	113.6
218	P	32.9	Very low	30.3	Very low	115 Å²	115	144.3 Å²	144.3	75%	0.747	75%	0.748	S	S	*	*				-147.8	142.3	95.3	37.6	-18.7	0	0	0	114.9
219	V	26.5	Very low	30.4	Very low	115 Å²	115	145.3 Å²	145.3	70%	0.697	75%	0.748	S	S	*	*				76.2	131.9	100.3	-179.6	0	0	0	0	112.8
220	Q	27.6	Very low	30.8	Very low	154 Å²	154	148.8 Å²	148.8	72%	0.72	75%	0.747	S	S	*	*				-175.2	134	54	-132.1	137.7	19.4	0	0	109.3
221	Q	28.4	Very low	30.9	Very low	136 Å²	136	150.8 Å²	150.8	64%	0.636	74%	0.744	S	S	*	*				68.9	145.4	98.8	-73.8	179.6	-58.7	0	0	116
222	E	27.3	Very low	31.6	Very low	151 Å²	151	144.9 Å²	144.9	71%	0.706	73%	0.734	S	S	*	*			cis	-172.6	159.9	14.2	-127.1	156.6	-179.9	0	0	110.1
223	E	25.1	Very low	32.3	Very low	171 Å²	171	139 Å²	139	80%	0.799	73%	0.726	S	S	*	*				-175.8	123.6	122.4	-101.9	-168.8	129.1	0	0	114.5
224	N	27.3	Very low	32.6	Very low	132 Å²	132	137.4 Å²	137.4	71%	0.706	73%	0.728	S	S	*	*			trans	71.7	124.2	138.6	-59	-33.8	0	0	0	123.9
225	L	33.9	Very low	32.9	Very low	165 Å²	165	142.4 Å²	142.4	86%	0.864	74%	0.742	S	S	*	*			trans	-119.1	161.1	158.5	-78.7	172.6	0	0	0	107.5
226	P	40.3	Very low	33.1	Very low	119 Å²	119	140 Å²	140	77%	0.773	74%	0.743	S	S	*	*				-157.3	-152.2	68.5	46.5	-21.3	0	0	0	115.5
227	P	50.3	Low	33.3	Very low	114 Å²	114	135.4 Å²	135.4	74%	0.74	73%	0.732	S	S	*	*				-130.5	-143.4	-114.5	41.8	-16.9	0	0	0	112.7
228	P	56.3	Low	33.4	Very low	98 Å²	98	140.9 Å²	140.9	64%	0.636	74%	0.736	S	S	*	*			cis	-130.2	179.9	-30.7	31.6	-9.4	0	0	0	114
229	D	28.8	Very low	33.4	Very low	142 Å²	142	144.5 Å²	144.5	76%	0.759	74%	0.743	S	S	*	*				171.6	110.1	122.6	-86.2	-22	0	0	0	114.9
230	Y	32.8	Very low	33.5	Very low	213 Å²	213	144.6 Å²	144.6	84%	0.835	75%	0.748	S	S	*	*				37.3	142.2	128	-93.2	-79.4	0	0	0	120.7
231	V	29.2	Very low	34	Very low	119 Å²	119	143.9 Å²	143.9	72%	0.721	75%	0.75	S	S	*	*			cis	-159.7	147	26.3	-170.3	0	0	0	0	109.1
232	A	39.9	Very low	34.4	Very low	86 Å²	86	148 Å²	148	71%	0.711	76%	0.761	S	S	*	*			trans	-123.5	149.1	149.5	0	0	0	0	0	108.8
233	P	41.5	Very low	34.6	Very low	113 Å²	113	151.5 Å²	151.5	73%	0.734	77%	0.768	S	S	*	*			trans	-118.9	122.9	150	19.4	-1.1	0	0	0	109.6
234	Q	30.5	Very low	35.1	Very low	175 Å²	175	149.6 Å²	149.6	82%	0.818	77%	0.77	S	S	*	*				58	140.9	67.8	-74.1	-169	-1	0	0	112.7
235	W	33.1	Very low	35.3	Very low	213 Å²	213	150 Å²	150	81%	0.807	77%	0.772	S	S	*	*			cis	178.5	166.4	-3.9	176.6	-86.2	0	0	0	105.5
236	D	27.6	Very low	35.7	Very low	137 Å²	137	147.2 Å²	147.2	73%	0.733	77%	0.767	S	S	*	*			trans	116.2	143	157.9	-96.6	-12.5	0	0	0	113.6
237	S	30.4	Very low	35.6	Very low	67 Å²	67	153 Å²	153	47%	0.469	77%	0.773	S	S	.	*			cis	179.5	146.3	-22.2	-115.4	0	0	0	0	104.7
238	R	30.6	Very low	35.1	Very low	223 Å²	223	153 Å²	153	84%	0.842	77%	0.773	S	S	*	*			trans	65.9	109.9	146.7	-64	174.9	-175.1	-171	1.2	119
239	Q	34.6	Very low	34.3	Very low	192 Å²	192	156.6 Å²	156.6	90%	0.897	78%	0.775	S	S	*	*				72.8	109.3	114.9	-155.8	173.9	62.7	0	0	117.8
240	S	28.6	Very low	34.8	Very low	116 Å²	116	153.9 Å²	153.9	81%	0.811	76%	0.764	S	S	*	*			trans	-165.6	131	130.2	-162.3	0	0	0	0	111.2
241	D	37.8	Very low	35.4	Very low	140 Å²	140	147.8 Å²	147.8	75%	0.749	75%	0.75	S	S	*	*			trans	-59.9	159.2	162.1	-78.1	-57.2	0	0	0	111.9
242	Y	35.7	Very low	35.9	Very low	221 Å²	221	149.5 Å²	149.5	87%	0.867	75%	0.75	S	S	*	*			trans	119.1	116.2	157.1	-74.4	-84.7	0	0	0	118.2
243	R	32.4	Very low	35.9	Very low	226 Å²	226	152.9 Å²	152.9	85%	0.853	75%	0.751	S	S	*	*			trans	91.6	126.4	159.2	-67	-170.2	172.4	-169.2	-1.4	118.6	D245	R243-D245 PolarHBondContact O-N 3.25Å
244	P	36.2	Very low	35.7	Very low	130 Å²	130	152.5 Å²	152.5	84%	0.844	74%	0.74	S	S	*	*			trans	-82	112.7	163.3	32.6	-24.6	0	0	0	108
245	D	30.5	Very low	36	Very low	142 Å²	142	150.6 Å²	150.6	76%	0.759	73%	0.733	S	S	*	*			trans	-97.3	111.1	164.1	-117.7	-30.8	0	0	0	109.3	R243 R247	R243-D245 PolarHBondContact O-N 3.25Å; D245-R247 PolarHBondContact O-N 2.96Å
246	S	42.9	Very low	36.5	Very low	106 Å²	106	143.5 Å²	143.5	74%	0.741	72%	0.716	S	S	*	*			trans	28.4	84.7	140.3	-43.5	0	0	0	0	116.9
247	R	38.2	Very low	37.1	Very low	241 Å²	241	142 Å²	142	91%	0.909	71%	0.707	S	S	*	*			trans	-75.3	131.3	156.7	-74.6	-171.6	179.1	-173.3	0.2	109	D245 Y249	D245-R247 PolarHBondContact O-N 2.96Å; R247-Y249 PolarHBondContact O-N 3.43Å
248	P	39.8	Very low	37.9	Very low	114 Å²	114	146.9 Å²	146.9	74%	0.74	72%	0.717	S	S	*	*			trans	-66.3	126.6	174.7	26	-30.1	0	0	0	109.4	T250	P248-T250 PolarHBondContact O-N 3.34Å; P248-T250 VanDerWaalsContact O-N 3.12Å
249	Y	38.8	Very low	38.8	Very low	172 Å²	172	139.2 Å²	139.2	68%	0.675	70%	0.698	S	S	*	*			trans	-57.5	109.4	170.4	-155.7	-92.2	0	0	0	108.3	R247 P251 E254	R247-Y249 PolarHBondContact O-N 3.43Å; Y249-P251 WeakPolarHBondContact O-CD 3.2Å; Y249-E254 PolarHBondContact OH-OE1 2.97Å; Y249-E254 PolarHBondContact OH-OE2 2.95Å
250	T	40.1	Very low	39.5	Very low	85 Å²	85	135.6 Å²	135.6	52%	0.521	68%	0.684	S	S	.	*			trans	-84	114.2	166.8	39.3	0	0	0	0	108.2	P248 Q252	P248-T250 PolarHBondContact O-N 3.34Å; P248-T250 VanDerWaalsContact O-N 3.12Å; T250-Q252 PolarHBondContact O-N 3.04Å
251	P	44.2	Very low	40.4	Very low	85 Å²	85	136.9 Å²	136.9	55%	0.552	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	8	-178.2	-18.2	32.5	0	0	0	115.1	Y249	Y249-P251 WeakPolarHBondContact O-CD 3.2Å
252	Q	41.6	Very low	41.1	Very low	155 Å²	155	136.7 Å²	136.7	72%	0.724	67%	0.67	S	S	*	*	H	α-helix	trans	-85.5	-28.3	-170.5	-87	165.8	-59.6	0	0	114.1	T250 M255 S256	T250-Q252 PolarHBondContact O-N 3.04Å; Q252-M255 PolarHBondContact O-N 3.24Å; Q252-S256 PolarHBondContact O-OG 3.09Å
253	E	39	Very low	42.1	Very low	157 Å²	157	131 Å²	131	73%	0.734	65%	0.654	S	S	*	*	H	α-helix	trans	-77.6	-25.1	-178.8	-70.7	-178.1	159.6	0	0	113	S256	E253-S256 PolarHBondContact O-OG 2.64Å
254	E	37.8	Very low	43.4	Very low	105 Å²	105	123.9 Å²	123.9	49%	0.491	64%	0.639	S	S	.	*	H	α-helix	trans	-76.8	-33.6	170.8	-76.9	-176	137.7	0	0	111.9	Y249 S256 N257 Y258	Y249-E254 PolarHBondContact OH-OE1 2.97Å; Y249-E254 PolarHBondContact OH-OE2 2.95Å; E254-S256 PolarHBondContact O-N 2.87Å; E254-N257 PolarHBondContact O-N 3.2Å; E254-Y258 WeakPolarHBondContact O-CD2 3.46Å; E254-Y258 PolarHBondContact O-N 3.34Å
255	M	36.6	Very low	44.8	Very low	136 Å²	136	121.9 Å²	121.9	67%	0.67	62%	0.622	S	S	*	*	H	α-helix	trans	-68.8	-31.1	-176.1	-151.3	89.9	89	0	0	113.5	Q252 Y258 S259	Q252-M255 PolarHBondContact O-N 3.24Å; M255-Y258 PolarHBondContact O-N 2.9Å; M255-S259 PolarHBondContact O-N 3.49Å
256	S	42.5	Very low	46.6	Very low	64 Å²	64	119.4 Å²	119.4	45%	0.448	61%	0.607	S	S	.	*	H	α-helix	trans	-69.6	-31.1	176.3	30.9	0	0	0	0	113.3	Q252 E253 E254 Y258	Q252-S256 PolarHBondContact O-OG 3.09Å; E253-S256 PolarHBondContact O-OG 2.64Å; E254-S256 PolarHBondContact O-N 2.87Å; S256-Y258 VanDerWaalsContact C-N 3.32Å
257	N	41.5	Very low	48.1	Very low	105 Å²	105	116.6 Å²	116.6	56%	0.561	59%	0.59	S	S	*	*	H	α-helix	trans	-79.8	-11.2	174.1	-80.3	-12.4	0	0	0	112.9	E254 F261	E254-N257 PolarHBondContact O-N 3.2Å; N257-F261 WeakPolarHBondContact O-CD2 3.38Å; N257-F261 WeakPolarHBondContact O-CE2 3.27Å
258	Y	45.7	Very low	49.7	Very low	169 Å²	169	108.1 Å²	108.1	66%	0.663	56%	0.561	S	S	*	*	H	α-helix	trans	-88.4	-29.1	171.8	-80.1	-80.3	0	0	0	112.5	E254 M255 S256 Q262	E254-Y258 WeakPolarHBondContact O-CD2 3.46Å; E254-Y258 PolarHBondContact O-N 3.34Å; M255-Y258 PolarHBondContact O-N 2.9Å; S256-Y258 VanDerWaalsContact C-N 3.32Å; Y258-Q262 WeakPolarHBondContact O-CB 3.22Å; Y258-Q262 PolarHBondContact O-N 3.09Å
259	S	49.7	Very low	51.5	Low	63 Å²	63	107.9 Å²	107.9	44%	0.441	55%	0.553	S	S	.	*	H	α-helix	trans	-75.5	-37.5	179.5	79	0	0	0	0	113.3	M255 F261 Q262 D263	M255-S259 PolarHBondContact O-N 3.49Å; S259-F261 PolarHBondContact O-N 2.99Å; S259-Q262 PolarHBondContact O-N 2.83Å; S259-D263 PolarHBondContact O-N 2.83Å
260	D	49.1	Very low	53.3	Low	115 Å²	115	105.3 Å²	105.3	62%	0.615	54%	0.543	S	S	*	.	H	α-helix	trans	-66	-35.9	-179.1	-110.6	-1.4	0	0	0	112.8	S264	D260-S264 WeakPolarHBondContact O-CB 3.45Å; D260-S264 PolarHBondContact O-N 2.92Å
261	F	47.8	Very low	55.1	Low	144 Å²	144	103 Å²	103	63%	0.632	53%	0.532	S	S	*	.	H	α-helix	trans	-72	-36.4	175.1	-74.2	-102.3	0	0	0	111.4	N257 S259 S264 D265	N257-F261 WeakPolarHBondContact O-CD2 3.38Å; N257-F261 WeakPolarHBondContact O-CE2 3.27Å; S259-F261 PolarHBondContact O-N 2.99Å; F261-S264 PolarHBondContact O-N 2.88Å; F261-D265 WeakPolarHBondContact O-CB 3.44Å; F261-D265 PolarHBondContact O-N 2.92Å
262	Q	53.3	Low	56.8	Low	135 Å²	135	101 Å²	101	63%	0.631	52%	0.516	S	S	*	.	H	α-helix	trans	-72.9	-34.4	179.9	-150	161.8	14.9	0	0	112.1	Y258 S259 M266	Y258-Q262 WeakPolarHBondContact O-CB 3.22Å; Y258-Q262 PolarHBondContact O-N 3.09Å; S259-Q262 PolarHBondContact O-N 2.83Å; Q262-M266 WeakPolarHBondContact O-CB 3.14Å; Q262-M266 WeakPolarHBondContact O-CG 3.4Å; Q262-M266 PolarHBondContact O-N 3.01Å
263	D	56.8	Low	58.9	Low	101 Å²	101	97.4 Å²	97.4	54%	0.54	50%	0.499	S	S	.	.	H	α-helix	trans	-70.2	-37.1	172.8	-100.8	-25.3	0	0	0	112.3	S259 M266 A267	S259-D263 PolarHBondContact O-N 2.83Å; D263-M266 PolarHBondContact O-N 2.75Å; D263-A267 VanDerWaalsContact O-CB 3.31Å; D263-A267 WeakPolarHBondContact O-CB 3.28Å; D263-A267 PolarHBondContact O-N 2.84Å
264	S	59.3	Low	61	Low	77 Å²	77	96 Å²	96	54%	0.538	49%	0.493	S	S	.	.	H	α-helix	trans	-64.4	-44.7	173.2	-176.4	0	0	0	0	112	D260 F261 A267 M268	D260-S264 WeakPolarHBondContact O-CB 3.45Å; D260-S264 PolarHBondContact O-N 2.92Å; F261-S264 PolarHBondContact O-N 2.88Å; S264-A267 PolarHBondContact O-N 3.3Å; S264-M268 WeakPolarHBondContact O-CB 3.27Å; S264-M268 PolarHBondContact O-N 2.78Å
265	D	66.1	Low	63.3	Low	88 Å²	88	92.1 Å²	92.1	47%	0.471	47%	0.474	S	S	.	.	H	α-helix	trans	-65.3	-39.7	177.7	-75.9	-15.5	0	0	0	111.7	F261 M268 L269	F261-D265 WeakPolarHBondContact O-CB 3.44Å; F261-D265 PolarHBondContact O-N 2.92Å; D265-M268 PolarHBondContact O-N 3.49Å; D265-L269 WeakPolarHBondContact O-CG 3.23Å; D265-L269 PolarHBondContact O-N 2.64Å
266	M	68.8	Low	65.8	Low	90 Å²	90	86.1 Å²	86.1	44%	0.443	44%	0.444	S	S	.	.	H	α-helix	trans	-69.9	-34.7	175.8	-71.5	-59.9	-62	0	0	112.7	Q262 D263 L269 R270	Q262-M266 WeakPolarHBondContact O-CB 3.14Å; Q262-M266 WeakPolarHBondContact O-CG 3.4Å; Q262-M266 PolarHBondContact O-N 3.01Å; D263-M266 PolarHBondContact O-N 2.75Å; M266-L269 HydrophobicContact SD-CD1 4.07Å; M266-R270 WeakPolarHBondContact O-CG 2.88Å; M266-R270 PolarHBondContact O-N 3.22Å; M266-R270 VanDerWaalsContact O-N 3.08Å
267	A	73	Confident	68.1	Low	48 Å²	48	85 Å²	85	40%	0.397	44%	0.435	S	S	.	.	H	α-helix	trans	-65.2	-40.5	172.7	0	0	0	0	0	111.6	D263 S264 R270 A271	D263-A267 VanDerWaalsContact O-CB 3.31Å; D263-A267 WeakPolarHBondContact O-CB 3.28Å; D263-A267 PolarHBondContact O-N 2.84Å; S264-A267 PolarHBondContact O-N 3.3Å; A267-R270 PolarHBondContact O-N 2.78Å; A267-A271 PolarHBondContact O-N 3.21Å
268	M	71.8	Confident	70.3	Confident	62 Å²	62	84.1 Å²	84.1	31%	0.305	43%	0.43	S	S	.	.	H	α-helix	trans	-66.8	-42.4	176.7	-173.3	173.9	63.4	0	0	112.4	S264 D265 R270 A271 E272 H446	S264-M268 WeakPolarHBondContact O-CB 3.27Å; S264-M268 PolarHBondContact O-N 2.78Å; D265-M268 PolarHBondContact O-N 3.49Å; M268-R270 VanDerWaalsContact C-N 3.3Å; M268-R270 PolarHBondContact O-N 3.15Å; M268-A271 PolarHBondContact O-N 2.86Å; M268-E272 PolarHBondContact O-N 3.29Å; M268-H446 WeakPolarHBondContact CE-NE2 2.91Å; M268-H446 PolarHBondContact SD-CE1 3.29Å; M268-H446 PolarHBondContact SD-NE2 3.25Å
269	L	77.6	Confident	72.5	Confident	109 Å²	109	76 Å²	76	57%	0.571	40%	0.398	S	S	*	.	H	α-helix	trans	-62	-36.6	173.7	-73.1	171	0	0	0	112.2	D265 M266 M273	D265-L269 WeakPolarHBondContact O-CG 3.23Å; D265-L269 PolarHBondContact O-N 2.64Å; M266-L269 HydrophobicContact SD-CD1 4.07Å; L269-M273 WeakPolarHBondContact O-CB 3.39Å; L269-M273 PolarHBondContact O-N 2.8Å
270	R	76.4	Confident	74.6	Confident	119 Å²	119	73.1 Å²	73.1	45%	0.449	38%	0.378	S	S	.	.	H	α-helix	trans	-65.3	-44.8	172.8	-73.3	-178	-142.1	112.6	2.3	111.6	M266 A267 M268 E272 M273 E274	M266-R270 WeakPolarHBondContact O-CG 2.88Å; M266-R270 PolarHBondContact O-N 3.22Å; M266-R270 VanDerWaalsContact O-N 3.08Å; A267-R270 PolarHBondContact O-N 2.78Å; M268-R270 VanDerWaalsContact C-N 3.3Å; M268-R270 PolarHBondContact O-N 3.15Å; R270-E272 PolarHBondContact O-N 2.83Å; R270-M273 WeakPolarHBondContact O-CB 3.34Å; R270-M273 PolarHBondContact O-N 3.11Å; R270-M273 VanDerWaalsContact O-N 3.15Å; R270-E274 WeakPolarHBondContact O-CG 3.38Å; R270-E274 PolarHBondContact O-N 2.7Å
271	A	77.8	Confident	76.6	Confident	36 Å²	36	70.9 Å²	70.9	30%	0.298	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-40.1	177.9	0	0	0	0	0	112.5	A267 M268 M273 E274 R275 L445	A267-A271 PolarHBondContact O-N 3.21Å; M268-A271 PolarHBondContact O-N 2.86Å; A271-M273 VanDerWaalsContact C-N 3.33Å; A271-E274 PolarHBondContact O-N 2.95Å; A271-R275 VanDerWaalsContact O-CB 3.26Å; A271-R275 WeakPolarHBondContact O-CB 3.38Å; A271-R275 PolarHBondContact O-N 3.18Å; A271-L445 HydrophobicContact CB-CD1 3.89Å
272	E	80.9	Confident	78.6	Confident	44 Å²	44	66.1 Å²	66.1	21%	0.206	35%	0.346	C	S	.	.	H	α-helix	trans	-67.6	-34.9	174.7	-167.9	65	-150.2	0	0	111.4	M268 R270 R275 N276	M268-E272 PolarHBondContact O-N 3.29Å; R270-E272 PolarHBondContact O-N 2.83Å; E272-R275 IonicContact OE1-NE 2.67Å; E272-R275 PolarHBondContact OE1-NE 2.9Å; E272-N276 VanDerWaalsContact O-CB 3.31Å; E272-N276 WeakPolarHBondContact O-CB 3.33Å; E272-N276 PolarHBondContact O-N 3.45Å; E272-N276 PolarHBondContact O-ND2 2.83Å
273	M	85.1	Confident	80.7	Confident	78 Å²	78	59.7 Å²	59.7	38%	0.384	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-41.5	175.5	-171.2	166.9	66.3	0	0	112.6	L269 R270 A271 N276 T277 L350 A353	L269-M273 WeakPolarHBondContact O-CB 3.39Å; L269-M273 PolarHBondContact O-N 2.8Å; R270-M273 WeakPolarHBondContact O-CB 3.34Å; R270-M273 PolarHBondContact O-N 3.11Å; R270-M273 VanDerWaalsContact O-N 3.15Å; A271-M273 VanDerWaalsContact C-N 3.33Å; M273-N276 PolarHBondContact O-N 2.91Å; M273-T277 WeakPolarHBondContact O-CB 3.42Å; M273-T277 PolarHBondContact O-N 3.09Å; M273-T277 PolarHBondContact O-OG1 2.94Å; M273-L350 HydrophobicContact CG-CD2 3.67Å; M273-A353 HydrophobicContact CE-CB 4.42Å; M273-A353 HydrophobicContact SD-CB 3.44Å; M273-A353 WeakPolarHBondContact SD-CB 3.33Å
274	E	82.8	Confident	82.5	Confident	127 Å²	127	56.1 Å²	56.1	59%	0.593	30%	0.296	S	S	*	.	H	α-helix	trans	-61.2	-50.5	173.1	-74.7	170.6	-171.4	0	0	110.5	R270 A271 N276 T277 D278	R270-E274 WeakPolarHBondContact O-CG 3.38Å; R270-E274 PolarHBondContact O-N 2.7Å; A271-E274 PolarHBondContact O-N 2.95Å; E274-N276 VanDerWaalsContact C-N 3.33Å; E274-N276 PolarHBondContact O-N 3.44Å; E274-T277 WeakPolarHBondContact O-CA 3.37Å; E274-T277 VanDerWaalsContact O-CB 3.32Å; E274-T277 WeakPolarHBondContact O-CB 3.32Å; E274-T277 PolarHBondContact O-N 3.13Å; E274-D278 PolarHBondContact O-N 2.55Å
275	R	86.6	Confident	84	Confident	25 Å²	25	55.5 Å²	55.5	9%	0.094	29%	0.289	C	S	.	.	H	α-helix	trans	-52	-49.8	173.3	170	-170.5	160.4	66.9	-1.8	112.1	A271 E272 T277 D278 I279 P442	A271-R275 VanDerWaalsContact O-CB 3.26Å; A271-R275 WeakPolarHBondContact O-CB 3.38Å; A271-R275 PolarHBondContact O-N 3.18Å; E272-R275 IonicContact OE1-NE 2.67Å; E272-R275 PolarHBondContact OE1-NE 2.9Å; R275-T277 VanDerWaalsContact C-N 3.26Å; R275-T277 PolarHBondContact O-N 3.45Å; R275-D278 PolarHBondContact O-N 3.09Å; R275-I279 HydrophobicContact CG-CD1 4.01Å; R275-I279 VanDerWaalsContact O-CG1 3.27Å; R275-I279 WeakPolarHBondContact O-CG1 3.43Å; R275-I279 PolarHBondContact O-N 2.96Å; R275-P442 VanDerWaalsContact NH1-CA 3.34Å; R275-P442 VanDerWaalsContact NH1-CB 3.31Å; R275-P442 VanDerWaalsContact NH1-CD 3.3Å; R275-P442 PolarHBondContact NH1-O 2.78Å; R275-P442 PolarHBondContact NH2-O 3.36Å
276	N	89.8	Confident	85.4	Confident	9 Å²	9	51.4 Å²	51.4	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-64.4	-33.4	179.8	-78.9	-21.3	0	0	0	112.2	E272 M273 E274 F280 L346 Q349 L350	E272-N276 VanDerWaalsContact O-CB 3.31Å; E272-N276 WeakPolarHBondContact O-CB 3.33Å; E272-N276 PolarHBondContact O-N 3.45Å; E272-N276 PolarHBondContact O-ND2 2.83Å; M273-N276 PolarHBondContact O-N 2.91Å; E274-N276 VanDerWaalsContact C-N 3.33Å; E274-N276 PolarHBondContact O-N 3.44Å; N276-F280 VanDerWaalsContact O-CB 3.26Å; N276-F280 WeakPolarHBondContact O-CB 3.24Å; N276-F280 PolarHBondContact O-N 3.39Å; N276-L346 HydrophobicContact CB-CD2 3.94Å; N276-L346 WeakPolarHBondContact OD1-CD2 3.27Å; N276-Q349 PolarHBondContact ND2-OE1 3.16Å; N276-L350 HydrophobicContact CB-CD1 4.48Å; N276-L350 HydrophobicContact CB-CD2 3.95Å; N276-L350 HydrophobicContact CB-CG 4.34Å
277	T	89.8	Confident	86.7	Confident	42 Å²	42	47.2 Å²	47.2	26%	0.258	25%	0.247	S	C	.	.	H	α-helix	trans	-66.6	-44.6	175.3	-58.1	0	0	0	0	111	M273 E274 R275 F280 N281	M273-T277 WeakPolarHBondContact O-CB 3.42Å; M273-T277 PolarHBondContact O-N 3.09Å; M273-T277 PolarHBondContact O-OG1 2.94Å; E274-T277 WeakPolarHBondContact O-CA 3.37Å; E274-T277 VanDerWaalsContact O-CB 3.32Å; E274-T277 WeakPolarHBondContact O-CB 3.32Å; E274-T277 PolarHBondContact O-N 3.13Å; R275-T277 VanDerWaalsContact C-N 3.26Å; R275-T277 PolarHBondContact O-N 3.45Å; T277-F280 PolarHBondContact O-N 3.16Å; T277-N281 VanDerWaalsContact O-CG 3.29Å; T277-N281 PolarHBondContact O-N 2.98Å; T277-N281 PolarHBondContact O-ND2 3.18Å
278	D	88.3	Confident	87.7	Confident	85 Å²	85	48.9 Å²	48.9	46%	0.455	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-49.7	177.3	-68.9	-18.7	0	0	0	111.3	E274 R275 F280 N281 H282	E274-D278 PolarHBondContact O-N 2.55Å; R275-D278 PolarHBondContact O-N 3.09Å; D278-F280 VanDerWaalsContact C-N 3.26Å; D278-F280 PolarHBondContact O-N 3.35Å; D278-N281 PolarHBondContact O-N 3.45Å; D278-N281 VanDerWaalsContact O-N 3.14Å; D278-H282 PolarHBondContact O-CD2 3.14Å; D278-H282 VanDerWaalsContact O-CD2 3.25Å; D278-H282 PolarHBondContact O-N 3.21Å; D278-H282 VanDerWaalsContact O-N 3.12Å
279	I	91.1	Very high	88.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57	-43.4	176.7	-63.3	170.5	0	0	0	110.6	R275 N281 H282 I283 Y342 L346 F435 W439 P441	R275-I279 HydrophobicContact CG-CD1 4.01Å; R275-I279 VanDerWaalsContact O-CG1 3.27Å; R275-I279 WeakPolarHBondContact O-CG1 3.43Å; R275-I279 PolarHBondContact O-N 2.96Å; I279-N281 VanDerWaalsContact C-N 3.35Å; I279-N281 PolarHBondContact O-N 3.15Å; I279-H282 PolarHBondContact O-N 3.29Å; I279-I283 HydrophobicContact CG2-CD1 4.16Å; I279-I283 WeakPolarHBondContact O-CG1 3.35Å; I279-I283 PolarHBondContact O-N 2.93Å; I279-Y342 HydrophobicContact CG2-CD1 4.3Å; I279-Y342 HydrophobicContact CG2-CE1 3.56Å; I279-L346 HydrophobicContact CB-CD1 4.05Å; I279-L346 HydrophobicContact CG2-CD1 3.56Å; I279-F435 HydrophobicContact CG2-CZ 4.33Å; I279-W439 HydrophobicContact CB-CH2 4.42Å; I279-W439 HydrophobicContact CG1-CH2 3.69Å; I279-W439 HydrophobicContact CG1-CZ3 4.04Å; I279-P441 HydrophobicContact CD1-CB 3.79Å; I279-P441 HydrophobicContact CG1-CB 3.88Å
280	F	94.3	Very high	89.4	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-39.8	179.3	-178.5	-100.9	0	0	0	112.4	N276 T277 D278 I283 L284 L346 L347 L350 Y362 F366	N276-F280 VanDerWaalsContact O-CB 3.26Å; N276-F280 WeakPolarHBondContact O-CB 3.24Å; N276-F280 PolarHBondContact O-N 3.39Å; T277-F280 PolarHBondContact O-N 3.16Å; D278-F280 VanDerWaalsContact C-N 3.26Å; D278-F280 PolarHBondContact O-N 3.35Å; F280-I283 WeakPolarHBondContact O-CB 3.16Å; F280-I283 PolarHBondContact O-N 2.81Å; F280-L284 PolarHBondContact O-N 2.74Å; F280-L346 HydrophobicContact CB-CB 4.5Å; F280-L346 HydrophobicContact CB-CD1 4.18Å; F280-L346 HydrophobicContact CD2-CB 4.3Å; F280-L347 HydrophobicContact CD2-CD2 4.34Å; F280-L347 HydrophobicContact CD2-CG 4.18Å; F280-L347 HydrophobicContact CE1-CD2 4.12Å; F280-L347 HydrophobicContact CE2-CD1 3.84Å; F280-L347 HydrophobicContact CE2-CD2 3.62Å; F280-L347 HydrophobicContact CE2-CG 3.45Å; F280-L347 VanDerWaalsContact CE2-CG 3.45Å; F280-L347 HydrophobicContact CZ-CD1 4.1Å; F280-L347 HydrophobicContact CZ-CD2 3.51Å; F280-L347 HydrophobicContact CZ-CG 3.85Å; F280-L350 HydrophobicContact CB-CD1 4.26Å; F280-Y362 AromaticContact CE1-CD1 3.85Å; F280-Y362 HydrophobicContact CE1-CD1 3.85Å; F280-Y362 HydrophobicContact CE1-CD2 4.21Å; F280-Y362 AromaticContact CE1-CE1 3.86Å; F280-Y362 HydrophobicContact CE1-CE1 3.86Å; F280-Y362 HydrophobicContact CE1-CE2 4.19Å; F280-Y362 HydrophobicContact CE1-CG 4.01Å; F280-Y362 AromaticContact CE1-CZ 4Å; F280-Y362 AromaticContact CZ-CD1 3.8Å; F280-Y362 HydrophobicContact CZ-CD1 3.8Å; F280-Y362 HydrophobicContact CZ-CD2 4.37Å; F280-Y362 HydrophobicContact CZ-CE1 4.28Å; F280-Y362 AromaticContact CZ-CG 3.83Å; F280-Y362 HydrophobicContact CZ-CG 3.83Å; F280-F366 HydrophobicContact CD2-CZ 4.47Å; F280-F366 AromaticContact CE2-CE2 3.75Å; F280-F366 HydrophobicContact CE2-CE2 3.75Å; F280-F366 AromaticContact CE2-CZ 3.51Å; F280-F366 HydrophobicContact CE2-CZ 3.51Å; F280-F366 HydrophobicContact CZ-CE2 4.34Å; F280-F366 AromaticContact CZ-CZ 3.92Å; F280-F366 HydrophobicContact CZ-CZ 3.92Å
281	N	91.8	Very high	90.1	Very high	69 Å²	69	38.3 Å²	38.3	37%	0.369	20%	0.202	S	C	.	.	H	α-helix	trans	-64.2	-40	176.6	-69.3	-29.1	0	0	0	112.2	T277 D278 I279 L284 T285	T277-N281 VanDerWaalsContact O-CG 3.29Å; T277-N281 PolarHBondContact O-N 2.98Å; T277-N281 PolarHBondContact O-ND2 3.18Å; D278-N281 PolarHBondContact O-N 3.45Å; D278-N281 VanDerWaalsContact O-N 3.14Å; I279-N281 VanDerWaalsContact C-N 3.35Å; I279-N281 PolarHBondContact O-N 3.15Å; N281-L284 PolarHBondContact O-N 2.89Å; N281-T285 PolarHBondContact O-N 2.78Å; N281-T285 PolarHBondContact O-OG1 3.27Å
282	H	90.5	Very high	90.7	Very high	44 Å²	44	41.8 Å²	41.8	20%	0.204	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-37.8	173.6	-76	-81.8	0	0	0	111.9	D278 I279 T285 D286 F435 D437 W439	D278-H282 PolarHBondContact O-CD2 3.14Å; D278-H282 VanDerWaalsContact O-CD2 3.25Å; D278-H282 PolarHBondContact O-N 3.21Å; D278-H282 VanDerWaalsContact O-N 3.12Å; I279-H282 PolarHBondContact O-N 3.29Å; H282-T285 PolarHBondContact O-N 3.45Å; H282-D286 PolarHBondContact O-N 2.83Å; H282-F435 VanDerWaalsContact C-CE1 3.49Å; H282-F435 HydrophobicContact CB-CD1 3.73Å; H282-F435 HydrophobicContact CB-CD2 4.49Å; H282-F435 HydrophobicContact CB-CE1 3.57Å; H282-F435 HydrophobicContact CB-CE2 4.33Å; H282-F435 HydrophobicContact CB-CG 4.19Å; H282-F435 HydrophobicContact CB-CZ 3.86Å; H282-D437 IonicContact CE1-OD2 3.23Å; H282-D437 PolarHBondContact CE1-OD2 2.98Å; H282-D437 VanDerWaalsContact CE1-OD2 3.28Å; H282-D437 IonicContact ND1-OD2 2.74Å; H282-D437 PolarHBondContact ND1-OD2 3.29Å; H282-W439 HydrophobicContact CB-CE3 4.07Å; H282-W439 HydrophobicContact CB-CZ3 4.21Å; H282-W439 AromaticContact CD2-CD2 3.58Å; H282-W439 AromaticContact CD2-CE2 3.75Å; H282-W439 AromaticContact CD2-CE3 3.53Å; H282-W439 AromaticContact CD2-CH2 3.83Å; H282-W439 AromaticContact CD2-CZ2 3.89Å; H282-W439 AromaticContact CD2-CZ3 3.67Å; H282-W439 AromaticContact CE1-CD1 3.86Å; H282-W439 AromaticContact CE1-CD2 3.76Å; H282-W439 AromaticContact CE1-CG 3.57Å; H282-W439 AromaticContact CG-CD2 3.94Å; H282-W439 AromaticContact CG-CE3 3.66Å; H282-W439 AromaticContact NE2-CD1 3.81Å; H282-W439 AromaticContact NE2-CD2 3.48Å; H282-W439 AromaticContact NE2-CE2 3.5Å; H282-W439 AromaticContact NE2-CE3 3.96Å; H282-W439 AromaticContact NE2-CG 3.71Å; H282-W439 AromaticContact NE2-CZ2 3.99Å; H282-W439 AromaticContact NE2-NE1 3.69Å
283	I	95.8	Very high	91.1	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.5	-46.5	173.6	-71.8	170.3	0	0	0	110.9	I279 F280 T285 D286 V287 K339 Y342 L346 F366 F435	I279-I283 HydrophobicContact CG2-CD1 4.16Å; I279-I283 WeakPolarHBondContact O-CG1 3.35Å; I279-I283 PolarHBondContact O-N 2.93Å; F280-I283 WeakPolarHBondContact O-CB 3.16Å; F280-I283 PolarHBondContact O-N 2.81Å; I283-T285 VanDerWaalsContact C-N 3.32Å; I283-T285 PolarHBondContact O-N 2.97Å; I283-D286 PolarHBondContact O-N 3.46Å; I283-V287 HydrophobicContact CG2-CG2 4.21Å; I283-V287 WeakPolarHBondContact O-CB 3.44Å; I283-V287 VanDerWaalsContact O-CG2 3.27Å; I283-V287 WeakPolarHBondContact O-CG2 3.36Å; I283-V287 PolarHBondContact O-N 3.32Å; I283-K339 HydrophobicContact CG2-CB 4.19Å; I283-K339 WeakPolarHBondContact CG2-O 3.17Å; I283-Y342 HydrophobicContact CD1-CD1 3.52Å; I283-Y342 HydrophobicContact CD1-CE1 4.25Å; I283-Y342 HydrophobicContact CD1-CG 4.21Å; I283-L346 HydrophobicContact CD1-CD1 3.6Å; I283-F366 HydrophobicContact CG2-CZ 4.05Å; I283-F435 HydrophobicContact CB-CE1 4.42Å; I283-F435 HydrophobicContact CG1-CE1 3.72Å; I283-F435 HydrophobicContact CG1-CZ 3.97Å
284	L	94.4	Very high	91.4	Very high	25 Å²	25	40.6 Å²	40.6	13%	0.131	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-45.4	-179.9	-174.9	64.3	0	0	0	110.8	F280 N281 D286 V287 E288 Y362 I365 F366	F280-L284 PolarHBondContact O-N 2.74Å; N281-L284 PolarHBondContact O-N 2.89Å; L284-D286 PolarHBondContact O-N 3.3Å; L284-V287 PolarHBondContact O-N 2.81Å; L284-E288 WeakPolarHBondContact O-CB 3.31Å; L284-E288 VanDerWaalsContact O-CG 3.32Å; L284-E288 WeakPolarHBondContact O-CG 3.14Å; L284-E288 PolarHBondContact O-N 3.33Å; L284-Y362 HydrophobicContact CD2-CE1 4.02Å; L284-I365 HydrophobicContact CD1-CG2 4.37Å; L284-F366 HydrophobicContact CD1-CE1 4.04Å
285	T	92.1	Very high	91.6	Very high	64 Å²	64	36.5 Å²	36.5	39%	0.393	19%	0.193	S	C	.	.	H	α-helix	trans	-58.4	-47.1	177.1	-55.2	0	0	0	0	111.7	N281 H282 I283 E288 I289	N281-T285 PolarHBondContact O-N 2.78Å; N281-T285 PolarHBondContact O-OG1 3.27Å; H282-T285 PolarHBondContact O-N 3.45Å; I283-T285 VanDerWaalsContact C-N 3.32Å; I283-T285 PolarHBondContact O-N 2.97Å; T285-E288 PolarHBondContact O-N 2.78Å; T285-I289 HydrophobicContact CG2-CD1 3.99Å; T285-I289 VanDerWaalsContact O-CG1 3.27Å; T285-I289 WeakPolarHBondContact O-CG1 3.46Å; T285-I289 PolarHBondContact O-N 2.86Å
286	D	94.8	Very high	91.7	Very high	3 Å²	3	40 Å²	40	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-67.1	-38.2	179.5	-97.8	31.1	0	0	0	113.1	H282 I283 L284 I289 F290 K339 F435 Y436	H282-D286 PolarHBondContact O-N 2.83Å; I283-D286 PolarHBondContact O-N 3.46Å; L284-D286 PolarHBondContact O-N 3.3Å; D286-I289 PolarHBondContact O-N 2.86Å; D286-F290 WeakPolarHBondContact O-CB 3.43Å; D286-F290 PolarHBondContact O-N 2.78Å; D286-K339 HydrophobicContact CB-CD 3.94Å; D286-K339 VanDerWaalsContact OD2-CE 3.26Å; D286-K339 WeakPolarHBondContact OD2-CE 3.38Å; D286-K339 IonicContact OD2-NZ 2.7Å; D286-K339 PolarHBondContact OD2-NZ 3.48Å; D286-F435 HydrophobicContact CB-CD1 4.41Å; D286-F435 WeakPolarHBondContact OD2-CA 3.17Å; D286-Y436 HydrophobicContact CB-CD2 4.04Å; D286-Y436 HydrophobicContact CB-CE2 4.29Å; D286-Y436 VanDerWaalsContact OD1-CD2 3.28Å; D286-Y436 WeakPolarHBondContact OD1-CD2 3.4Å; D286-Y436 PolarHBondContact OD1-N 3.35Å; D286-Y436 VanDerWaalsContact OD1-N 3.17Å; D286-Y436 WeakPolarHBondContact OD2-CD2 3.26Å; D286-Y436 PolarHBondContact OD2-N 2.97Å; D286-Y436 VanDerWaalsContact OD2-N 3.12Å
287	V	95.9	Very high	91.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-43.2	174.9	160.2	0	0	0	0	110.5	I283 L284 F290 G291 F336 K339 I340 F366 F369	I283-V287 HydrophobicContact CG2-CG2 4.21Å; I283-V287 WeakPolarHBondContact O-CB 3.44Å; I283-V287 VanDerWaalsContact O-CG2 3.27Å; I283-V287 WeakPolarHBondContact O-CG2 3.36Å; I283-V287 PolarHBondContact O-N 3.32Å; L284-V287 PolarHBondContact O-N 2.81Å; V287-F290 PolarHBondContact O-N 3.47Å; V287-G291 PolarHBondContact O-N 3.14Å; V287-F336 HydrophobicContact CB-CE2 4.41Å; V287-F336 HydrophobicContact CG1-CE2 3.95Å; V287-F336 HydrophobicContact CG2-CD2 4.2Å; V287-F336 HydrophobicContact CG2-CE2 4.26Å; V287-K339 HydrophobicContact CG2-CB 4.47Å; V287-I340 HydrophobicContact CB-CD1 4.49Å; V287-I340 HydrophobicContact CG1-CD1 3.93Å; V287-I340 HydrophobicContact CG2-CD1 3.66Å; V287-I340 HydrophobicContact CG2-CG1 4.12Å; V287-F366 HydrophobicContact CG1-CD1 4.37Å; V287-F366 HydrophobicContact CG1-CE1 4.41Å; V287-F369 HydrophobicContact CG1-CB 4.24Å; V287-F369 HydrophobicContact CG1-CD1 4.2Å; V287-F369 HydrophobicContact CG1-CD2 3.55Å; V287-F369 HydrophobicContact CG1-CE1 4.48Å; V287-F369 HydrophobicContact CG1-CE2 3.87Å; V287-F369 HydrophobicContact CG1-CG 3.74Å; V287-F369 HydrophobicContact CG1-CZ 4.34Å
288	E	94.1	Very high	91.1	Very high	84 Å²	84	43 Å²	43	39%	0.393	23%	0.225	S	C	.	.	H	α-helix	trans	-63.4	-48.9	175	-75.3	175.2	178.7	0	0	111.5	L284 T285 F290 G291 D292 F369	L284-E288 WeakPolarHBondContact O-CB 3.31Å; L284-E288 VanDerWaalsContact O-CG 3.32Å; L284-E288 WeakPolarHBondContact O-CG 3.14Å; L284-E288 PolarHBondContact O-N 3.33Å; T285-E288 PolarHBondContact O-N 2.78Å; E288-F290 VanDerWaalsContact C-N 3.29Å; E288-F290 PolarHBondContact O-N 3.36Å; E288-G291 PolarHBondContact O-N 2.58Å; E288-G291 VanDerWaalsContact O-N 3.11Å; E288-D292 WeakPolarHBondContact O-CB 3.32Å; E288-D292 PolarHBondContact O-N 3.32Å; E288-F369 HydrophobicContact CG-CE2 4.37Å; E288-F369 HydrophobicContact CG-CZ 3.81Å
289	I	90.3	Very high	90.8	Very high	57 Å²	57	45.5 Å²	45.5	29%	0.292	24%	0.238	S	C	.	.	H	α-helix	trans	-56	-44.5	177	-70.4	165.3	0	0	0	111.1	T285 D286 R293 Y436	T285-I289 HydrophobicContact CG2-CD1 3.99Å; T285-I289 VanDerWaalsContact O-CG1 3.27Å; T285-I289 WeakPolarHBondContact O-CG1 3.46Å; T285-I289 PolarHBondContact O-N 2.86Å; D286-I289 PolarHBondContact O-N 2.86Å; I289-R293 WeakPolarHBondContact O-CG 3.25Å; I289-R293 PolarHBondContact O-N 2.82Å; I289-R293 VanDerWaalsContact O-N 3.17Å; I289-Y436 HydrophobicContact CB-CD2 4.11Å; I289-Y436 HydrophobicContact CB-CE2 4.23Å; I289-Y436 HydrophobicContact CD1-CD2 4.15Å; I289-Y436 HydrophobicContact CG2-CD2 3.81Å; I289-Y436 HydrophobicContact CG2-CE2 3.88Å
290	F	94.8	Very high	89.9	Confident	1 Å²	1	52 Å²	52	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-65.7	-45.5	177.2	-178.7	-92.9	0	0	0	111.5	D286 V287 E288 D292 R293 V294 P328 E332 Y333 F336 T373 Y377	D286-F290 WeakPolarHBondContact O-CB 3.43Å; D286-F290 PolarHBondContact O-N 2.78Å; V287-F290 PolarHBondContact O-N 3.47Å; E288-F290 VanDerWaalsContact C-N 3.29Å; E288-F290 PolarHBondContact O-N 3.36Å; F290-D292 PolarHBondContact O-N 3.1Å; F290-R293 PolarHBondContact O-N 2.86Å; F290-V294 HydrophobicContact CD1-CG2 4.12Å; F290-V294 HydrophobicContact CE1-CG2 3.72Å; F290-V294 HydrophobicContact CZ-CG2 3.98Å; F290-V294 WeakPolarHBondContact O-CG2 3.49Å; F290-V294 PolarHBondContact O-N 3.13Å; F290-P328 HydrophobicContact CD2-CB 4.3Å; F290-P328 HydrophobicContact CD2-CG 4.43Å; F290-P328 HydrophobicContact CE2-CB 3.65Å; F290-P328 HydrophobicContact CE2-CG 4.01Å; F290-P328 HydrophobicContact CZ-CB 4.35Å; F290-E332 HydrophobicContact CD2-CB 4.27Å; F290-E332 HydrophobicContact CE2-CB 3.93Å; F290-Y333 HydrophobicContact CE1-CD2 4.08Å; F290-Y333 AromaticContact CZ-CD2 3.82Å; F290-Y333 HydrophobicContact CZ-CD2 3.82Å; F290-Y333 HydrophobicContact CZ-CG 4.38Å; F290-F336 HydrophobicContact CB-CD2 4.01Å; F290-F336 HydrophobicContact CD1-CB 3.86Å; F290-F336 HydrophobicContact CD1-CD1 4.13Å; F290-F336 AromaticContact CD1-CD2 3.32Å; F290-F336 HydrophobicContact CD1-CD2 3.32Å; F290-F336 AromaticContact CD1-CE2 3.8Å; F290-F336 HydrophobicContact CD1-CE2 3.8Å; F290-F336 AromaticContact CD1-CG 3.5Å; F290-F336 HydrophobicContact CD1-CG 3.5Å; F290-F336 HydrophobicContact CD1-CZ 4.41Å; F290-F336 HydrophobicContact CD2-CB 4.18Å; F290-F336 HydrophobicContact CE1-CB 4Å; F290-F336 AromaticContact CE1-CD1 3.91Å; F290-F336 HydrophobicContact CE1-CD1 3.91Å; F290-F336 AromaticContact CE1-CD2 3.97Å; F290-F336 HydrophobicContact CE1-CD2 3.97Å; F290-F336 HydrophobicContact CE1-CE1 4.38Å; F290-F336 HydrophobicContact CE1-CE2 4.4Å; F290-F336 AromaticContact CE1-CG 3.7Å; F290-F336 HydrophobicContact CE1-CG 3.7Å; F290-F336 HydrophobicContact CE2-CB 4.32Å; F290-F336 HydrophobicContact CG-CB 3.94Å; F290-F336 AromaticContact CG-CD2 3.83Å; F290-F336 HydrophobicContact CG-CD2 3.83Å; F290-F336 HydrophobicContact CG-CG 4.05Å; F290-F336 HydrophobicContact CZ-CB 4.23Å; F290-F336 HydrophobicContact CZ-CG 4.39Å; F290-T373 HydrophobicContact CD1-CG2 4.36Å; F290-T373 HydrophobicContact CE1-CG2 3.93Å; F290-Y377 HydrophobicContact CE1-CE2 4.42Å; F290-Y377 HydrophobicContact CZ-CE2 4.02Å; F290-Y377 AromaticContact CZ-CZ 3.86Å; F290-Y377 WeakPolarHBondContact CZ-OH 3.12Å
291	G	91.8	Very high	87.6	Confident	9 Å²	9	55.7 Å²	55.7	9%	0.093	30%	0.297	C	S	.	.	H	α-helix	trans	-58.1	-44.2	177.1	0	0	0	0	0	112.8	V287 E288 V294 A295	V287-G291 PolarHBondContact O-N 3.14Å; E288-G291 PolarHBondContact O-N 2.58Å; E288-G291 VanDerWaalsContact O-N 3.11Å; G291-V294 PolarHBondContact O-N 3.46Å; G291-A295 WeakPolarHBondContact O-CB 3.47Å; G291-A295 PolarHBondContact O-N 2.65Å
292	D	90	Very high	85.8	Confident	109 Å²	109	58.3 Å²	58.3	58%	0.583	32%	0.318	S	S	*	.	H	α-helix	trans	-64.1	-41.8	178	-77.8	-13.8	0	0	0	112.1	E288 F290 V294 A295 E296	E288-D292 WeakPolarHBondContact O-CB 3.32Å; E288-D292 PolarHBondContact O-N 3.32Å; F290-D292 PolarHBondContact O-N 3.1Å; D292-V294 VanDerWaalsContact C-N 3.34Å; D292-V294 PolarHBondContact O-N 2.85Å; D292-A295 PolarHBondContact O-N 2.64Å; D292-E296 WeakPolarHBondContact O-CB 3.43Å; D292-E296 PolarHBondContact O-N 3.25Å
293	R	89.7	Confident	83.4	Confident	91 Å²	91	65.2 Å²	65.2	34%	0.343	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-43.7	174.6	-72.2	177.4	-169.7	-174.7	4.5	111.5	I289 F290 E296 V297 P328 E332	I289-R293 WeakPolarHBondContact O-CG 3.25Å; I289-R293 PolarHBondContact O-N 2.82Å; I289-R293 VanDerWaalsContact O-N 3.17Å; F290-R293 PolarHBondContact O-N 2.86Å; R293-E296 PolarHBondContact O-N 3.11Å; R293-V297 VanDerWaalsContact O-CG2 3.28Å; R293-V297 WeakPolarHBondContact O-CG2 3.42Å; R293-V297 PolarHBondContact O-N 3.02Å; R293-V297 VanDerWaalsContact O-N 3.16Å; R293-P328 HydrophobicContact CB-CG 4.16Å; R293-E332 IonicContact NH1-OE2 2.81Å; R293-E332 PolarHBondContact NH1-OE2 2.86Å
294	V	90.8	Very high	80.6	Confident	6 Å²	6	74.9 Å²	74.9	4%	0.036	39%	0.392	C	S	.	.	H	α-helix	trans	-63	-46.5	176.2	172	0	0	0	0	110.4	F290 G291 D292 E296 V297 M298 L327 P328 T373 L376	F290-V294 HydrophobicContact CD1-CG2 4.12Å; F290-V294 HydrophobicContact CE1-CG2 3.72Å; F290-V294 HydrophobicContact CZ-CG2 3.98Å; F290-V294 WeakPolarHBondContact O-CG2 3.49Å; F290-V294 PolarHBondContact O-N 3.13Å; G291-V294 PolarHBondContact O-N 3.46Å; D292-V294 VanDerWaalsContact C-N 3.34Å; D292-V294 PolarHBondContact O-N 2.85Å; V294-E296 PolarHBondContact O-N 2.71Å; V294-V297 PolarHBondContact O-N 3.05Å; V294-M298 HydrophobicContact CG1-CG 4.44Å; V294-M298 VanDerWaalsContact O-CG 3.28Å; V294-M298 WeakPolarHBondContact O-CG 2.97Å; V294-M298 PolarHBondContact O-N 3.05Å; V294-L327 HydrophobicContact CG1-CD2 4.23Å; V294-P328 HydrophobicContact CG2-CG 3.94Å; V294-T373 HydrophobicContact CG1-CG2 4.39Å; V294-T373 HydrophobicContact CG2-CG2 4.46Å; V294-L376 HydrophobicContact CG1-CD1 3.32Å
295	A	87.8	Confident	77.8	Confident	41 Å²	41	83 Å²	83	34%	0.339	43%	0.43	S	S	.	.	H	α-helix	trans	-63	-40.2	178.4	0	0	0	0	0	112.3	G291 D292 V297 M298 N299	G291-A295 WeakPolarHBondContact O-CB 3.47Å; G291-A295 PolarHBondContact O-N 2.65Å; D292-A295 PolarHBondContact O-N 2.64Å; A295-V297 VanDerWaalsContact C-N 3.33Å; A295-V297 PolarHBondContact O-N 3.43Å; A295-M298 PolarHBondContact O-N 3.27Å; A295-N299 VanDerWaalsContact O-CB 3.3Å; A295-N299 WeakPolarHBondContact O-CB 3.45Å; A295-N299 VanDerWaalsContact O-CG 3.23Å; A295-N299 PolarHBondContact O-N 3.31Å; A295-N299 PolarHBondContact O-ND2 2.88Å; A295-N299 VanDerWaalsContact O-ND2 3.1Å
296	E	87.2	Confident	74.9	Confident	100 Å²	100	85 Å²	85	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-60.4	-43.2	176.4	-170	-173	164.5	0	0	111.3	D292 R293 V294 N299 K300	D292-E296 WeakPolarHBondContact O-CB 3.43Å; D292-E296 PolarHBondContact O-N 3.25Å; R293-E296 PolarHBondContact O-N 3.11Å; V294-E296 PolarHBondContact O-N 2.71Å; E296-N299 PolarHBondContact O-N 3.25Å; E296-K300 WeakPolarHBondContact O-CG 3.5Å; E296-K300 PolarHBondContact O-N 3.4Å; E296-K300 VanDerWaalsContact O-N 3.11Å; E296-K300 VanDerWaalsContact OE1-CE 3.27Å; E296-K300 WeakPolarHBondContact OE1-CE 3.23Å; E296-K300 IonicContact OE1-NZ 3.11Å; E296-K300 PolarHBondContact OE1-NZ 3.2Å
297	V	86.6	Confident	72.1	Confident	25 Å²	25	94.7 Å²	94.7	15%	0.152	49%	0.488	C	S	.	.	H	α-helix	trans	-65.8	-40.4	176.5	173.4	0	0	0	0	111.1	R293 V294 A295 P324 N326 L327	R293-V297 VanDerWaalsContact O-CG2 3.28Å; R293-V297 WeakPolarHBondContact O-CG2 3.42Å; R293-V297 PolarHBondContact O-N 3.02Å; R293-V297 VanDerWaalsContact O-N 3.16Å; V294-V297 PolarHBondContact O-N 3.05Å; A295-V297 VanDerWaalsContact C-N 3.33Å; A295-V297 PolarHBondContact O-N 3.43Å; V297-P324 HydrophobicContact CG1-CB 3.72Å; V297-P324 HydrophobicContact CG1-CG 4.38Å; V297-N326 HydrophobicContact CG1-CB 4.13Å; V297-N326 HydrophobicContact CG2-CB 4.41Å; V297-N326 WeakPolarHBondContact CG2-O 3.32Å; V297-L327 HydrophobicContact CB-CD2 4.43Å; V297-L327 HydrophobicContact CG1-CD2 4.06Å; V297-L327 HydrophobicContact CG1-CG 4.26Å
298	M	82	Confident	69	Low	89 Å²	89	98.6 Å²	98.6	44%	0.438	53%	0.528	S	S	.	.	H	α-helix	trans	-70.1	-31	178.8	-69.5	-58.6	-62.1	0	0	113.1	V294 A295 P324 L376	V294-M298 HydrophobicContact CG1-CG 4.44Å; V294-M298 VanDerWaalsContact O-CG 3.28Å; V294-M298 WeakPolarHBondContact O-CG 2.97Å; V294-M298 PolarHBondContact O-N 3.05Å; A295-M298 PolarHBondContact O-N 3.27Å; M298-P324 HydrophobicContact SD-CG 3.55Å; M298-P324 VanDerWaalsContact SD-CG 3.55Å; M298-L376 HydrophobicContact CE-CD2 3.8Å; M298-L376 HydrophobicContact CG-CD1 3.88Å; M298-L376 HydrophobicContact SD-CD1 3.86Å; M298-L376 HydrophobicContact SD-CD2 3.59Å; M298-L376 VanDerWaalsContact SD-CD2 3.59Å; M298-L376 HydrophobicContact SD-CG 4.39Å
299	N	80.9	Confident	66.3	Low	137 Å²	137	104.4 Å²	104.4	73%	0.733	55%	0.552	S	S	*	*	H	α-helix	trans	-86.8	-16.2	-179.2	-71.5	-33.6	0	0	0	113.6	A295 E296 A301	A295-N299 VanDerWaalsContact O-CB 3.3Å; A295-N299 WeakPolarHBondContact O-CB 3.45Å; A295-N299 VanDerWaalsContact O-CG 3.23Å; A295-N299 PolarHBondContact O-N 3.31Å; A295-N299 PolarHBondContact O-ND2 2.88Å; A295-N299 VanDerWaalsContact O-ND2 3.1Å; E296-N299 PolarHBondContact O-N 3.25Å; N299-A301 PolarHBondContact O-N 2.73Å
300	K	72.3	Confident	63.3	Low	135 Å²	135	110.6 Å²	110.6	59%	0.587	58%	0.582	S	S	*	*	S	Bend	trans	-73.2	107.2	172.5	-81.2	175.4	-176.1	167.4	0	110.2	E296	E296-K300 WeakPolarHBondContact O-CG 3.5Å; E296-K300 PolarHBondContact O-N 3.4Å; E296-K300 VanDerWaalsContact O-N 3.11Å; E296-K300 VanDerWaalsContact OE1-CE 3.27Å; E296-K300 WeakPolarHBondContact OE1-CE 3.23Å; E296-K300 IonicContact OE1-NZ 3.11Å; E296-K300 PolarHBondContact OE1-NZ 3.2Å
301	A	45.3	Very low	60.6	Low	80 Å²	80	118.7 Å²	118.7	66%	0.661	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-56.8	146.4	174.6	0	0	0	0	0	111.4	N299 E303	N299-A301 PolarHBondContact O-N 2.73Å; A301-E303 PolarHBondContact O-N 2.76Å; A301-E303 VanDerWaalsContact O-N 3.12Å
302	P	53.9	Low	57.7	Low	123 Å²	123	128.2 Å²	128.2	80%	0.799	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-62.9	119.8	-179.9	25.5	-32.3	0	0	0	109.5	K304	P302-K304 PolarHBondContact O-N 3.06Å
303	E	40.2	Very low	54.9	Low	189 Å²	189	132.7 Å²	132.7	88%	0.883	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-55	124	174.6	-73.5	-172.5	156.4	0	0	109.6	A301 E305	A301-E303 PolarHBondContact O-N 2.76Å; A301-E303 VanDerWaalsContact O-N 3.12Å; E303-E305 PolarHBondContact O-N 3.08Å
304	K	37.9	Very low	52.7	Low	204 Å²	204	133.7 Å²	133.7	89%	0.887	69%	0.693	S	S	*	*			trans	-68.3	99.2	172.1	-76.8	179	177.7	173	0	108.3	P302 S306	P302-K304 PolarHBondContact O-N 3.06Å; K304-S306 PolarHBondContact O-N 3.22Å; K304-S306 VanDerWaalsContact O-N 3.13Å
305	E	34.6	Very low	49.8	Very low	196 Å²	196	143.3 Å²	143.3	92%	0.916	74%	0.735	S	S	*	*			trans	-58.5	116.3	158.4	-79.9	-172.4	152.7	0	0	109.1	E303	E303-E305 PolarHBondContact O-N 3.08Å
306	S	32.6	Very low	47.7	Very low	104 Å²	104	151.6 Å²	151.6	73%	0.727	76%	0.763	S	S	*	*			trans	-88.1	115.8	171.8	58.4	0	0	0	0	109.2	K304	K304-S306 PolarHBondContact O-N 3.22Å; K304-S306 VanDerWaalsContact O-N 3.13Å
307	K	35.6	Very low	45	Very low	208 Å²	208	156.6 Å²	156.6	90%	0.904	78%	0.783	S	S	*	*			trans	166.5	133.1	130.9	-89.6	162.2	-174.8	178.9	0	112
308	G	31.4	Very low	42.6	Very low	82 Å²	82	165.4 Å²	165.4	85%	0.845	82%	0.82	S	S	*	*			trans	113	107.6	146.7	0	0	0	0	0	117.4
309	K	36.1	Very low	40.1	Very low	207 Å²	207	166.9 Å²	166.9	90%	0.9	84%	0.838	S	S	*	*			trans	-60.8	139.1	177.3	-63.2	167.3	175.3	173.9	0	113.5
310	M	28.9	Very low	38.1	Very low	187 Å²	187	169.6 Å²	169.6	92%	0.921	84%	0.844	S	S	*	*				-178.9	150.2	109.8	-100.2	-177.1	79.9	0	0	113.1
311	M	37.3	Very low	36.4	Very low	171 Å²	171	168.5 Å²	168.5	84%	0.842	85%	0.853	S	S	*	*			trans	-63	140.9	-171.3	-61.8	-90.6	-104.9	0	0	115.1
312	K	31.2	Very low	36.6	Very low	209 Å²	209	174.1 Å²	174.1	91%	0.909	86%	0.862	S	S	*	*				171.4	124.4	128.6	-91.7	164.9	-174	-179.4	0	112
313	F	30.6	Very low	36.6	Very low	203 Å²	203	172.6 Å²	172.6	89%	0.89	85%	0.851	S	S	*	*			trans	-90.5	172.3	167.3	-76.1	-87.2	0	0	0	110.9
314	P	43.6	Very low	37.6	Very low	111 Å²	111	165.5 Å²	165.5	72%	0.721	82%	0.821	S	S	*	*				-130.5	158.7	-60	35.5	-18.8	0	0	0	111.9
315	K	30.6	Very low	38.7	Very low	208 Å²	208	161.4 Å²	161.4	90%	0.904	82%	0.818	S	S	*	*			trans	-130.8	122.1	157.3	-83.2	-171.7	179.2	175.9	0	110.4	K317	K315-K317 PolarHBondContact O-N 2.84Å
316	K	42.1	Very low	40.8	Very low	216 Å²	216	157.7 Å²	157.7	94%	0.939	81%	0.805	S	S	*	*			trans	-52.1	120.3	179	-70.5	175.8	175	176.2	0	111.4
317	K	32.3	Very low	43.4	Very low	205 Å²	205	154.2 Å²	154.2	89%	0.891	78%	0.778	S	S	*	*			trans	-134.7	132.2	152.8	-86.3	-172.1	176.5	178.8	0	108.7	K315 S319	K315-K317 PolarHBondContact O-N 2.84Å; K317-S319 PolarHBondContact O-N 2.85Å
318	K	34.4	Very low	46.1	Very low	210 Å²	210	145.1 Å²	145.1	91%	0.913	74%	0.74	S	S	*	*			trans	-51.4	125.3	-175.4	-67.2	176.9	175.1	-179.5	0	110.6	K320	K318-K320 PolarHBondContact O-N 2.78Å; K318-K320 VanDerWaalsContact O-N 3.16Å
319	S	31.2	Very low	48.9	Very low	119 Å²	119	146 Å²	146	83%	0.832	72%	0.722	S	S	*	*			trans	-68.9	105.2	172.4	54.2	0	0	0	0	109.3	K317	K317-S319 PolarHBondContact O-N 2.85Å
320	K	37.1	Very low	51.3	Low	195 Å²	195	143 Å²	143	85%	0.848	71%	0.705	S	S	*	*			trans	-69.7	128.6	153	-77.6	-173.2	174	-173.6	0	106.6	K318 K322	K318-K320 PolarHBondContact O-N 2.78Å; K318-K320 VanDerWaalsContact O-N 3.16Å; K320-K322 PolarHBondContact O-N 2.92Å
321	S	38.1	Very low	54.3	Low	111 Å²	111	137.4 Å²	137.4	78%	0.776	68%	0.681	S	S	*	*			trans	-43.6	121.4	174.7	-178.5	0	0	0	0	109.8	V323	S321-V323 PolarHBondContact O-N 2.83Å
322	K	48	Very low	56.9	Low	198 Å²	198	131.9 Å²	131.9	86%	0.861	65%	0.653	S	S	*	*			trans	-74.2	104	172.8	-85.7	-175.1	173.3	-173.5	0	106.8	K320	K320-K322 PolarHBondContact O-N 2.92Å
323	V	55.5	Low	60	Low	92 Å²	92	122 Å²	122	56%	0.558	61%	0.61	S	S	*	*			trans	-55.9	128.1	166.9	-179.1	0	0	0	0	107.8	S321 L327	S321-V323 PolarHBondContact O-N 2.83Å; V323-L327 HydrophobicContact CG1-CD1 3.58Å
324	P	61.2	Low	63	Low	40 Å²	40	113.5 Å²	113.5	26%	0.26	58%	0.575	S	S	.	*			trans	-61.3	136.1	177.7	-18.2	28.2	0	0	0	111	V297 M298 N326	V297-P324 HydrophobicContact CG1-CB 3.72Å; V297-P324 HydrophobicContact CG1-CG 4.38Å; M298-P324 HydrophobicContact SD-CG 3.55Å; M298-P324 VanDerWaalsContact SD-CG 3.55Å; P324-N326 PolarHBondContact O-N 2.92Å; P324-N326 VanDerWaalsContact O-N 3.13Å
325	S	61	Low	65.5	Low	117 Å²	117	109.5 Å²	109.5	82%	0.818	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-4.4	-176.1	53.5	0	0	0	0	115.1
326	N	77.9	Confident	68.6	Low	119 Å²	119	99.9 Å²	99.9	64%	0.636	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.6	19.4	-170.3	-63.9	5.3	0	0	0	113.2	V297 P324	V297-N326 HydrophobicContact CG1-CB 4.13Å; V297-N326 HydrophobicContact CG2-CB 4.41Å; V297-N326 WeakPolarHBondContact CG2-O 3.32Å; P324-N326 PolarHBondContact O-N 2.92Å; P324-N326 VanDerWaalsContact O-N 3.13Å
327	L	87.9	Confident	71.3	Confident	31 Å²	31	89.6 Å²	89.6	16%	0.162	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-64.9	151.1	175.7	-73.4	167.3	0	0	0	111.1	V294 V297 V323 L376	V294-L327 HydrophobicContact CG1-CD2 4.23Å; V297-L327 HydrophobicContact CB-CD2 4.43Å; V297-L327 HydrophobicContact CG1-CD2 4.06Å; V297-L327 HydrophobicContact CG1-CG 4.26Å; V323-L327 HydrophobicContact CG1-CD1 3.58Å; L327-L376 HydrophobicContact CD1-CB 4.02Å; L327-L376 HydrophobicContact CD2-CD1 4.24Å
328	P	91	Very high	74.3	Confident	16 Å²	16	82 Å²	82	10%	0.104	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-47.4	147.2	168.3	-27	33.4	0	0	0	112.1	F290 R293 V294 E332 Y377	F290-P328 HydrophobicContact CD2-CB 4.3Å; F290-P328 HydrophobicContact CD2-CG 4.43Å; F290-P328 HydrophobicContact CE2-CB 3.65Å; F290-P328 HydrophobicContact CE2-CG 4.01Å; F290-P328 HydrophobicContact CZ-CB 4.35Å; R293-P328 HydrophobicContact CB-CG 4.16Å; V294-P328 HydrophobicContact CG2-CG 3.94Å; P328-E332 HydrophobicContact CB-CB 4.25Å; P328-Y377 WeakPolarHBondContact CD-OH 3.44Å; P328-Y377 WeakPolarHBondContact O-CE1 3.41Å; P328-Y377 PolarHBondContact O-OH 2.85Å
329	H	90.4	Very high	77.3	Confident	102 Å²	102	72.2 Å²	72.2	47%	0.472	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-64.5	153.4	-176.6	-172.5	-108.3	0	0	0	111.1	T331 E332 Y333	H329-T331 PolarHBondContact ND1-N 2.8Å; H329-T331 PolarHBondContact ND1-OG1 2.77Å; H329-T331 PolarHBondContact O-N 3.38Å; H329-E332 WeakPolarHBondContact O-CB 3.43Å; H329-E332 PolarHBondContact O-N 3.07Å; H329-Y333 PolarHBondContact O-N 2.92Å
330	W	86.5	Confident	80.5	Confident	143 Å²	143	66.6 Å²	66.6	54%	0.542	35%	0.349	S	S	.	.	H	α-helix	trans	-59.6	-25.8	-175.8	69.6	-94.1	0	0	0	113.2	Y333 V334 I381	W330-Y333 PolarHBondContact O-N 2.79Å; W330-V334 HydrophobicContact CE3-CG2 3.92Å; W330-V334 HydrophobicContact CZ3-CG2 4.16Å; W330-V334 WeakPolarHBondContact O-CG2 3.42Å; W330-V334 PolarHBondContact O-N 2.93Å; W330-I381 HydrophobicContact CB-CD1 4.01Å
331	T	91.3	Very high	83.4	Confident	70 Å²	70	57.3 Å²	57.3	43%	0.429	31%	0.309	S	S	.	.	H	α-helix	trans	-66.4	-37.6	173.5	52.6	0	0	0	0	112.6	H329 Y333 V334 S335	H329-T331 PolarHBondContact ND1-N 2.8Å; H329-T331 PolarHBondContact ND1-OG1 2.77Å; H329-T331 PolarHBondContact O-N 3.38Å; T331-Y333 VanDerWaalsContact C-N 3.35Å; T331-V334 PolarHBondContact O-N 2.78Å; T331-S335 PolarHBondContact O-N 2.85Å
332	E	92.8	Very high	86.1	Confident	54 Å²	54	54 Å²	54	25%	0.252	28%	0.279	S	S	.	.	H	α-helix	trans	-68.4	-37.8	173.2	-70.5	178.2	-108.7	0	0	110.5	F290 R293 P328 H329 S335 F336 Y436	F290-E332 HydrophobicContact CD2-CB 4.27Å; F290-E332 HydrophobicContact CE2-CB 3.93Å; R293-E332 IonicContact NH1-OE2 2.81Å; R293-E332 PolarHBondContact NH1-OE2 2.86Å; P328-E332 HydrophobicContact CB-CB 4.25Å; H329-E332 WeakPolarHBondContact O-CB 3.43Å; H329-E332 PolarHBondContact O-N 3.07Å; E332-S335 PolarHBondContact O-N 2.69Å; E332-F336 WeakPolarHBondContact O-CB 3.45Å; E332-F336 PolarHBondContact O-N 2.91Å; E332-Y436 PolarHBondContact OE2-OH 3.34Å
333	Y	95.5	Very high	88.5	Confident	1 Å²	1	44.6 Å²	44.6	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-64.3	-40.9	174.5	-179.7	-124.6	0	0	0	112.5	F290 H329 W330 T331 F336 L337 Y377 I381	F290-Y333 HydrophobicContact CE1-CD2 4.08Å; F290-Y333 AromaticContact CZ-CD2 3.82Å; F290-Y333 HydrophobicContact CZ-CD2 3.82Å; F290-Y333 HydrophobicContact CZ-CG 4.38Å; H329-Y333 PolarHBondContact O-N 2.92Å; W330-Y333 PolarHBondContact O-N 2.79Å; T331-Y333 VanDerWaalsContact C-N 3.35Å; Y333-F336 AromaticContact CD2-CD1 3.91Å; Y333-F336 HydrophobicContact CD2-CD1 3.91Å; Y333-F336 AromaticContact CE2-CD1 3.97Å; Y333-F336 HydrophobicContact CE2-CD1 3.97Å; Y333-F336 HydrophobicContact CE2-CE1 4.2Å; Y333-F336 WeakPolarHBondContact O-CB 3.5Å; Y333-F336 PolarHBondContact O-N 3.12Å; Y333-L337 HydrophobicContact CD1-CD1 4.24Å; Y333-L337 HydrophobicContact CD2-CG 4.39Å; Y333-L337 HydrophobicContact CE1-CD1 3.73Å; Y333-L337 HydrophobicContact CE1-CG 4.39Å; Y333-L337 HydrophobicContact CE2-CD1 4.23Å; Y333-L337 HydrophobicContact CE2-CD2 4.08Å; Y333-L337 HydrophobicContact CE2-CG 4Å; Y333-L337 WeakPolarHBondContact O-CG 3.44Å; Y333-L337 PolarHBondContact O-N 3.16Å; Y333-Y377 AromaticContact CD1-CD1 3.72Å; Y333-Y377 HydrophobicContact CD1-CD1 3.72Å; Y333-Y377 AromaticContact CD1-CD2 3.98Å; Y333-Y377 HydrophobicContact CD1-CD2 3.98Å; Y333-Y377 HydrophobicContact CD1-CE1 4.4Å; Y333-Y377 AromaticContact CD1-CG 3.48Å; Y333-Y377 HydrophobicContact CD1-CG 3.48Å; Y333-Y377 VanDerWaalsContact CD1-CG 3.48Å; Y333-Y377 HydrophobicContact CD2-CD1 4.41Å; Y333-Y377 AromaticContact CD2-CD2 3.56Å; Y333-Y377 HydrophobicContact CD2-CD2 3.56Å; Y333-Y377 AromaticContact CD2-CE2 3.68Å; Y333-Y377 HydrophobicContact CD2-CE2 3.68Å; Y333-Y377 AromaticContact CD2-CG 3.96Å; Y333-Y377 HydrophobicContact CD2-CG 3.96Å; Y333-Y377 HydrophobicContact CE1-CD1 4.37Å; Y333-Y377 HydrophobicContact CE1-CD2 4.06Å; Y333-Y377 AromaticContact CE1-CG 3.69Å; Y333-Y377 HydrophobicContact CE1-CG 3.69Å; Y333-Y377 AromaticContact CE2-CD2 3.65Å; Y333-Y377 HydrophobicContact CE2-CD2 3.65Å; Y333-Y377 HydrophobicContact CE2-CE2 4.13Å; Y333-Y377 HydrophobicContact CE2-CG 4.14Å; Y333-Y377 AromaticContact CG-CD1 3.74Å; Y333-Y377 HydrophobicContact CG-CD1 3.74Å; Y333-Y377 AromaticContact CG-CD2 3.73Å; Y333-Y377 HydrophobicContact CG-CD2 3.73Å; Y333-Y377 AromaticContact CG-CE1 3.96Å; Y333-Y377 HydrophobicContact CG-CE1 3.96Å; Y333-Y377 AromaticContact CG-CE2 3.96Å; Y333-Y377 HydrophobicContact CG-CE2 3.96Å; Y333-Y377 AromaticContact CG-CG 3.62Å; Y333-Y377 HydrophobicContact CG-CG 3.62Å; Y333-Y377 AromaticContact CZ-CD2 3.9Å; Y333-I381 HydrophobicContact CD1-CB 4.34Å; Y333-I381 HydrophobicContact CD1-CD1 4.13Å; Y333-I381 HydrophobicContact CD1-CG2 3.84Å; Y333-I381 HydrophobicContact CE1-CB 4.16Å; Y333-I381 HydrophobicContact CE1-CG2 3.96Å
334	V	94.8	Very high	90.4	Very high	25 Å²	25	40.3 Å²	40.3	15%	0.152	21%	0.212	C	C	.	.	H	α-helix	trans	-59.9	-49.3	171.6	169.6	0	0	0	0	110.2	W330 T331 F336 L337 Q338 I381 V385	W330-V334 HydrophobicContact CE3-CG2 3.92Å; W330-V334 HydrophobicContact CZ3-CG2 4.16Å; W330-V334 WeakPolarHBondContact O-CG2 3.42Å; W330-V334 PolarHBondContact O-N 2.93Å; T331-V334 PolarHBondContact O-N 2.78Å; V334-F336 VanDerWaalsContact C-N 3.3Å; V334-F336 PolarHBondContact O-N 2.86Å; V334-L337 PolarHBondContact O-N 3.44Å; V334-L337 VanDerWaalsContact O-N 3.1Å; V334-Q338 HydrophobicContact CG1-CG 4.24Å; V334-Q338 VanDerWaalsContact O-CG 3.27Å; V334-Q338 WeakPolarHBondContact O-CG 3.3Å; V334-Q338 PolarHBondContact O-N 3.14Å; V334-I381 HydrophobicContact CG2-CG2 3.68Å; V334-V385 HydrophobicContact CB-CG2 4.48Å; V334-V385 HydrophobicContact CG1-CG1 4.5Å; V334-V385 HydrophobicContact CG1-CG2 4.07Å; V334-V385 HydrophobicContact CG2-CG2 4.18Å
335	S	95.1	Very high	92.1	Very high	28 Å²	28	38.9 Å²	38.9	20%	0.196	20%	0.203	C	C	.	.	H	α-helix	trans	-57.1	-42.7	177.2	-175.9	0	0	0	0	112.2	T331 E332 Q338 K339	T331-S335 PolarHBondContact O-N 2.85Å; E332-S335 PolarHBondContact O-N 2.69Å; S335-Q338 PolarHBondContact O-N 2.87Å; S335-K339 WeakPolarHBondContact O-CB 3.33Å; S335-K339 VanDerWaalsContact O-CG 3.31Å; S335-K339 WeakPolarHBondContact O-CG 3.45Å; S335-K339 PolarHBondContact O-N 3.39Å; S335-K339 WeakPolarHBondContact OG-CE 3.32Å; S335-K339 PolarHBondContact OG-NZ 3.28Å; S335-K339 VanDerWaalsContact OG-NZ 3.1Å
336	F	97.2	Very high	93.7	Very high	5 Å²	5	33.4 Å²	33.4	2%	0.022	16%	0.164	C	C	.	.	H	α-helix	trans	-57.6	-49.6	173.6	163.1	-94.9	0	0	0	111.7	V287 F290 E332 Y333 V334 Q338 K339 I340 F369 L370 T373	V287-F336 HydrophobicContact CB-CE2 4.41Å; V287-F336 HydrophobicContact CG1-CE2 3.95Å; V287-F336 HydrophobicContact CG2-CD2 4.2Å; V287-F336 HydrophobicContact CG2-CE2 4.26Å; F290-F336 HydrophobicContact CB-CD2 4.01Å; F290-F336 HydrophobicContact CD1-CB 3.86Å; F290-F336 HydrophobicContact CD1-CD1 4.13Å; F290-F336 AromaticContact CD1-CD2 3.32Å; F290-F336 HydrophobicContact CD1-CD2 3.32Å; F290-F336 AromaticContact CD1-CE2 3.8Å; F290-F336 HydrophobicContact CD1-CE2 3.8Å; F290-F336 AromaticContact CD1-CG 3.5Å; F290-F336 HydrophobicContact CD1-CG 3.5Å; F290-F336 HydrophobicContact CD1-CZ 4.41Å; F290-F336 HydrophobicContact CD2-CB 4.18Å; F290-F336 HydrophobicContact CE1-CB 4Å; F290-F336 AromaticContact CE1-CD1 3.91Å; F290-F336 HydrophobicContact CE1-CD1 3.91Å; F290-F336 AromaticContact CE1-CD2 3.97Å; F290-F336 HydrophobicContact CE1-CD2 3.97Å; F290-F336 HydrophobicContact CE1-CE1 4.38Å; F290-F336 HydrophobicContact CE1-CE2 4.4Å; F290-F336 AromaticContact CE1-CG 3.7Å; F290-F336 HydrophobicContact CE1-CG 3.7Å; F290-F336 HydrophobicContact CE2-CB 4.32Å; F290-F336 HydrophobicContact CG-CB 3.94Å; F290-F336 AromaticContact CG-CD2 3.83Å; F290-F336 HydrophobicContact CG-CD2 3.83Å; F290-F336 HydrophobicContact CG-CG 4.05Å; F290-F336 HydrophobicContact CZ-CB 4.23Å; F290-F336 HydrophobicContact CZ-CG 4.39Å; E332-F336 WeakPolarHBondContact O-CB 3.45Å; E332-F336 PolarHBondContact O-N 2.91Å; Y333-F336 AromaticContact CD2-CD1 3.91Å; Y333-F336 HydrophobicContact CD2-CD1 3.91Å; Y333-F336 AromaticContact CE2-CD1 3.97Å; Y333-F336 HydrophobicContact CE2-CD1 3.97Å; Y333-F336 HydrophobicContact CE2-CE1 4.2Å; Y333-F336 WeakPolarHBondContact O-CB 3.5Å; Y333-F336 PolarHBondContact O-N 3.12Å; V334-F336 VanDerWaalsContact C-N 3.3Å; V334-F336 PolarHBondContact O-N 2.86Å; F336-Q338 VanDerWaalsContact C-N 3.35Å; F336-Q338 PolarHBondContact O-N 3.46Å; F336-K339 PolarHBondContact O-N 3.49Å; F336-I340 HydrophobicContact CD2-CG1 4.49Å; F336-I340 HydrophobicContact CE1-CG1 4.29Å; F336-I340 HydrophobicContact CE2-CD1 4.31Å; F336-I340 HydrophobicContact CE2-CG1 4.17Å; F336-I340 HydrophobicContact CZ-CD1 4.32Å; F336-I340 HydrophobicContact CZ-CG1 4.04Å; F336-I340 WeakPolarHBondContact O-CG1 3.31Å; F336-I340 PolarHBondContact O-N 3.31Å; F336-F369 HydrophobicContact CE2-CB 4.2Å; F336-F369 HydrophobicContact CZ-CB 3.96Å; F336-L370 HydrophobicContact CE1-CD2 4.02Å; F336-L370 HydrophobicContact CZ-CD2 4.42Å; F336-T373 HydrophobicContact CE1-CG2 4.31Å; F336-T373 WeakPolarHBondContact CE1-OG1 3.41Å; F336-T373 HydrophobicContact CZ-CG2 4.14Å
337	L	97.4	Very high	94.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.8	-41.5	177.6	-71.4	179.5	0	0	0	112.1	Y333 V334 K339 I340 K341 L370 I381 P382 V385 M413 W417	Y333-L337 HydrophobicContact CD1-CD1 4.24Å; Y333-L337 HydrophobicContact CD2-CG 4.39Å; Y333-L337 HydrophobicContact CE1-CD1 3.73Å; Y333-L337 HydrophobicContact CE1-CG 4.39Å; Y333-L337 HydrophobicContact CE2-CD1 4.23Å; Y333-L337 HydrophobicContact CE2-CD2 4.08Å; Y333-L337 HydrophobicContact CE2-CG 4Å; Y333-L337 WeakPolarHBondContact O-CG 3.44Å; Y333-L337 PolarHBondContact O-N 3.16Å; V334-L337 PolarHBondContact O-N 3.44Å; V334-L337 VanDerWaalsContact O-N 3.1Å; L337-K339 VanDerWaalsContact C-N 3.34Å; L337-K339 PolarHBondContact O-N 3.26Å; L337-I340 PolarHBondContact O-N 3.4Å; L337-K341 WeakPolarHBondContact O-CG 3.43Å; L337-K341 PolarHBondContact O-N 3.46Å; L337-L370 HydrophobicContact CD2-CD2 3.74Å; L337-I381 HydrophobicContact CD1-CG2 4.36Å; L337-P382 HydrophobicContact CD1-CB 4.2Å; L337-P382 HydrophobicContact CD1-CG 4.22Å; L337-V385 HydrophobicContact CB-CG1 4.29Å; L337-V385 HydrophobicContact CB-CG2 4.29Å; L337-V385 HydrophobicContact CD1-CG2 3.91Å; L337-M413 HydrophobicContact CD2-CE 3.92Å; L337-W417 HydrophobicContact CB-CH2 4.18Å; L337-W417 HydrophobicContact CB-CZ2 3.97Å; L337-W417 HydrophobicContact CD1-CZ2 4.45Å; L337-W417 HydrophobicContact CD2-CH2 3.91Å; L337-W417 HydrophobicContact CD2-CZ2 3.94Å; L337-W417 HydrophobicContact CG-CZ2 4.34Å
338	Q	96.8	Very high	94.7	Very high	46 Å²	46	27 Å²	27	22%	0.215	13%	0.132	C	C	.	.	H	α-helix	trans	-62.1	-41.9	176.6	-66.1	-178.9	-62.5	0	0	111.9	V334 S335 F336 K341 Y342 V385 S387 Y431	V334-Q338 HydrophobicContact CG1-CG 4.24Å; V334-Q338 VanDerWaalsContact O-CG 3.27Å; V334-Q338 WeakPolarHBondContact O-CG 3.3Å; V334-Q338 PolarHBondContact O-N 3.14Å; S335-Q338 PolarHBondContact O-N 2.87Å; F336-Q338 VanDerWaalsContact C-N 3.35Å; F336-Q338 PolarHBondContact O-N 3.46Å; Q338-K341 PolarHBondContact O-N 3.39Å; Q338-Y342 WeakPolarHBondContact O-CB 3.25Å; Q338-Y342 PolarHBondContact O-N 3.04Å; Q338-V385 HydrophobicContact CB-CG1 4.46Å; Q338-V385 HydrophobicContact CG-CG1 3.37Å; Q338-S387 VanDerWaalsContact CG-O 3.27Å; Q338-S387 WeakPolarHBondContact CG-O 3.4Å; Q338-S387 PolarHBondContact NE2-O 3.33Å; Q338-Y431 HydrophobicContact CB-CD2 4.41Å; Q338-Y431 HydrophobicContact CB-CE2 3.62Å; Q338-Y431 HydrophobicContact CG-CE2 4.25Å
339	K	97.1	Very high	94.7	Very high	5 Å²	5	31.4 Å²	31.4	2%	0.022	15%	0.151	C	C	.	.	H	α-helix	trans	-64.3	-39.9	175.2	-75.1	169.5	-177	156.8	0	112	I283 D286 V287 S335 F336 L337 Y342 G343 E434	I283-K339 HydrophobicContact CG2-CB 4.19Å; I283-K339 WeakPolarHBondContact CG2-O 3.17Å; D286-K339 HydrophobicContact CB-CD 3.94Å; D286-K339 VanDerWaalsContact OD2-CE 3.26Å; D286-K339 WeakPolarHBondContact OD2-CE 3.38Å; D286-K339 IonicContact OD2-NZ 2.7Å; D286-K339 PolarHBondContact OD2-NZ 3.48Å; V287-K339 HydrophobicContact CG2-CB 4.47Å; S335-K339 WeakPolarHBondContact O-CB 3.33Å; S335-K339 VanDerWaalsContact O-CG 3.31Å; S335-K339 WeakPolarHBondContact O-CG 3.45Å; S335-K339 PolarHBondContact O-N 3.39Å; S335-K339 WeakPolarHBondContact OG-CE 3.32Å; S335-K339 PolarHBondContact OG-NZ 3.28Å; S335-K339 VanDerWaalsContact OG-NZ 3.1Å; F336-K339 PolarHBondContact O-N 3.49Å; L337-K339 VanDerWaalsContact C-N 3.34Å; L337-K339 PolarHBondContact O-N 3.26Å; K339-Y342 PolarHBondContact O-N 3.5Å; K339-G343 PolarHBondContact O-N 3.19Å; K339-E434 WeakPolarHBondContact CE-O 3.46Å; K339-E434 PolarHBondContact NZ-O 2.93Å
340	I	97.7	Very high	94.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-47.4	173.2	-66.8	-72.3	0	0	0	111.1	V287 F336 L337 Y342 G343 F344 F366 L370 W417	V287-I340 HydrophobicContact CB-CD1 4.49Å; V287-I340 HydrophobicContact CG1-CD1 3.93Å; V287-I340 HydrophobicContact CG2-CD1 3.66Å; V287-I340 HydrophobicContact CG2-CG1 4.12Å; F336-I340 HydrophobicContact CD2-CG1 4.49Å; F336-I340 HydrophobicContact CE1-CG1 4.29Å; F336-I340 HydrophobicContact CE2-CD1 4.31Å; F336-I340 HydrophobicContact CE2-CG1 4.17Å; F336-I340 HydrophobicContact CZ-CD1 4.32Å; F336-I340 HydrophobicContact CZ-CG1 4.04Å; F336-I340 WeakPolarHBondContact O-CG1 3.31Å; F336-I340 PolarHBondContact O-N 3.31Å; L337-I340 PolarHBondContact O-N 3.4Å; I340-Y342 VanDerWaalsContact C-N 3.31Å; I340-Y342 PolarHBondContact O-N 3.2Å; I340-G343 PolarHBondContact O-N 3.12Å; I340-F344 HydrophobicContact CG2-CD2 4.03Å; I340-F344 HydrophobicContact CG2-CE2 3.41Å; I340-F344 VanDerWaalsContact CG2-CE2 3.41Å; I340-F344 HydrophobicContact CG2-CZ 3.83Å; I340-F344 WeakPolarHBondContact O-CD2 3.44Å; I340-F344 PolarHBondContact O-N 3.13Å; I340-F366 HydrophobicContact CD1-CB 3.92Å; I340-F366 HydrophobicContact CD1-CD1 3.61Å; I340-F366 HydrophobicContact CD1-CD2 4.24Å; I340-F366 HydrophobicContact CD1-CE1 4.13Å; I340-F366 HydrophobicContact CD1-CG 3.67Å; I340-F366 HydrophobicContact CG2-CB 4.49Å; I340-L370 HydrophobicContact CG1-CD2 4.45Å; I340-L370 HydrophobicContact CG2-CD1 4.05Å; I340-L370 HydrophobicContact CG2-CD2 4.24Å; I340-L370 HydrophobicContact CG2-CG 4.32Å; I340-W417 HydrophobicContact CG2-CH2 4.42Å; I340-W417 HydrophobicContact CG2-CZ3 4.2Å
341	K	97	Very high	94.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.9	-44.1	176.1	-67.3	-178.9	90.4	-173.6	0	111.5	L337 Q338 F344 N345 V385 T386 P388 L390 C416 W417	L337-K341 WeakPolarHBondContact O-CG 3.43Å; L337-K341 PolarHBondContact O-N 3.46Å; Q338-K341 PolarHBondContact O-N 3.39Å; K341-F344 PolarHBondContact O-N 2.67Å; K341-N345 PolarHBondContact O-N 3.37Å; K341-V385 HydrophobicContact CD-CG1 4.36Å; K341-V385 PolarHBondContact NZ-O 3.1Å; K341-T386 PolarHBondContact NZ-O 3.16Å; K341-P388 HydrophobicContact CB-CG 3.93Å; K341-P388 VanDerWaalsContact CD-O 3.31Å; K341-P388 WeakPolarHBondContact CD-O 3.5Å; K341-P388 WeakPolarHBondContact CE-O 3.37Å; K341-P388 PolarHBondContact NZ-O 3.47Å; K341-L390 HydrophobicContact CB-CD2 3.98Å; K341-L390 HydrophobicContact CG-CD2 4.37Å; K341-L390 WeakPolarHBondContact O-CD2 3.23Å; K341-C416 VanDerWaalsContact CE-O 3.31Å; K341-C416 WeakPolarHBondContact CE-O 3.39Å; K341-C416 PolarHBondContact NZ-O 3.06Å; K341-W417 HydrophobicContact CD-CD2 4.19Å; K341-W417 HydrophobicContact CD-CE3 4.38Å; K341-W417 HydrophobicContact CD-CH2 4Å; K341-W417 HydrophobicContact CD-CZ2 3.77Å; K341-W417 HydrophobicContact CD-CZ3 4.3Å; K341-W417 HydrophobicContact CG-CD2 4.18Å; K341-W417 HydrophobicContact CG-CE3 3.86Å; K341-W417 HydrophobicContact CG-CH2 3.41Å; K341-W417 VanDerWaalsContact CG-CH2 3.41Å; K341-W417 HydrophobicContact CG-CZ2 3.75Å; K341-W417 HydrophobicContact CG-CZ3 3.48Å; K341-W417 VanDerWaalsContact CG-CZ3 3.48Å
342	Y	96.6	Very high	93.5	Very high	42 Å²	42	23.7 Å²	23.7	17%	0.165	14%	0.139	C	C	.	.	H	α-helix	trans	-66.5	-40	178.4	-164.5	-136.3	0	0	0	112	I279 I283 Q338 K339 I340 F344 N345 L346 P388 Y431 P433	I279-Y342 HydrophobicContact CG2-CD1 4.3Å; I279-Y342 HydrophobicContact CG2-CE1 3.56Å; I283-Y342 HydrophobicContact CD1-CD1 3.52Å; I283-Y342 HydrophobicContact CD1-CE1 4.25Å; I283-Y342 HydrophobicContact CD1-CG 4.21Å; Q338-Y342 WeakPolarHBondContact O-CB 3.25Å; Q338-Y342 PolarHBondContact O-N 3.04Å; K339-Y342 PolarHBondContact O-N 3.5Å; I340-Y342 VanDerWaalsContact C-N 3.31Å; I340-Y342 PolarHBondContact O-N 3.2Å; Y342-F344 VanDerWaalsContact C-N 3.34Å; Y342-F344 PolarHBondContact O-N 2.9Å; Y342-N345 WeakPolarHBondContact O-CB 3.38Å; Y342-N345 PolarHBondContact O-N 3.31Å; Y342-N345 VanDerWaalsContact O-N 3.12Å; Y342-L346 HydrophobicContact CD1-CD1 4.25Å; Y342-L346 HydrophobicContact CE1-CD1 4.09Å; Y342-L346 WeakPolarHBondContact O-CG 3.45Å; Y342-L346 PolarHBondContact O-N 2.92Å; Y342-P388 HydrophobicContact CD2-CG 4.33Å; Y342-P388 HydrophobicContact CG-CG 4.46Å; Y342-Y431 HydrophobicContact CD1-CD1 4.05Å; Y342-Y431 AromaticContact CD1-CE1 3.87Å; Y342-Y431 HydrophobicContact CD1-CE1 3.87Å; Y342-Y431 HydrophobicContact CD2-CD1 4.05Å; Y342-Y431 AromaticContact CG-CD1 3.74Å; Y342-Y431 HydrophobicContact CG-CD1 3.74Å; Y342-Y431 AromaticContact CG-CE1 3.82Å; Y342-Y431 HydrophobicContact CG-CE1 3.82Å; Y342-P433 HydrophobicContact CD1-CB 4.37Å; Y342-P433 HydrophobicContact CD1-CG 4.21Å; Y342-P433 HydrophobicContact CE1-CB 4.49Å; Y342-P433 HydrophobicContact CE1-CG 3.84Å
343	G	96.7	Very high	92.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.1	-41.6	174.2	0	0	0	0	0	112.5	K339 I340 N345 L346 L347	K339-G343 PolarHBondContact O-N 3.19Å; I340-G343 PolarHBondContact O-N 3.12Å; G343-N345 VanDerWaalsContact C-N 3.33Å; G343-N345 PolarHBondContact O-N 3.28Å; G343-L346 PolarHBondContact O-N 3.2Å; G343-L347 WeakPolarHBondContact O-CB 3.47Å; G343-L347 WeakPolarHBondContact O-CG 3.45Å; G343-L347 PolarHBondContact O-N 3.47Å
344	F	96.9	Very high	92	Very high	2 Å²	2	25 Å²	25	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-62.1	-39.2	173.6	-68.6	-45.1	0	0	0	112.9	I340 K341 Y342 L347 A348 V363 F366 F367 L370 L390 A394 L398 W417	I340-F344 HydrophobicContact CG2-CD2 4.03Å; I340-F344 HydrophobicContact CG2-CE2 3.41Å; I340-F344 VanDerWaalsContact CG2-CE2 3.41Å; I340-F344 HydrophobicContact CG2-CZ 3.83Å; I340-F344 WeakPolarHBondContact O-CD2 3.44Å; I340-F344 PolarHBondContact O-N 3.13Å; K341-F344 PolarHBondContact O-N 2.67Å; Y342-F344 VanDerWaalsContact C-N 3.34Å; Y342-F344 PolarHBondContact O-N 2.9Å; F344-L347 HydrophobicContact CD1-CD1 4.37Å; F344-L347 PolarHBondContact O-N 2.98Å; F344-A348 PolarHBondContact O-N 3.01Å; F344-V363 HydrophobicContact CD1-CG2 4.24Å; F344-V363 HydrophobicContact CE1-CB 4.48Å; F344-V363 HydrophobicContact CE1-CG1 4.26Å; F344-V363 HydrophobicContact CE1-CG2 4.21Å; F344-F366 AromaticContact CD1-CD2 3.9Å; F344-F366 HydrophobicContact CD1-CD2 3.9Å; F344-F366 HydrophobicContact CE1-CB 3.89Å; F344-F366 AromaticContact CE1-CD2 3.63Å; F344-F366 HydrophobicContact CE1-CD2 3.63Å; F344-F366 HydrophobicContact CE1-CG 4.29Å; F344-F366 HydrophobicContact CZ-CB 3.93Å; F344-F366 HydrophobicContact CZ-CD2 4.16Å; F344-F367 HydrophobicContact CE1-CD2 4.36Å; F344-F367 HydrophobicContact CE1-CE2 4.07Å; F344-F367 HydrophobicContact CE2-CE2 4.31Å; F344-F367 AromaticContact CZ-CD2 3.93Å; F344-F367 HydrophobicContact CZ-CD2 3.93Å; F344-F367 AromaticContact CZ-CE2 3.51Å; F344-F367 HydrophobicContact CZ-CE2 3.51Å; F344-F367 HydrophobicContact CZ-CZ 4.43Å; F344-L370 HydrophobicContact CZ-CD1 4.49Å; F344-L390 HydrophobicContact CB-CD2 4.02Å; F344-L390 HydrophobicContact CD2-CD2 4.31Å; F344-A394 HydrophobicContact CB-CB 4.5Å; F344-L398 HydrophobicContact CD1-CD2 3.82Å; F344-L398 HydrophobicContact CD2-CD1 4.22Å; F344-L398 HydrophobicContact CE1-CD2 3.79Å; F344-L398 HydrophobicContact CE2-CD1 4.48Å; F344-L398 HydrophobicContact CG-CD1 4.32Å; F344-L398 HydrophobicContact CG-CD2 4.3Å; F344-L398 HydrophobicContact CZ-CD2 4.22Å; F344-W417 HydrophobicContact CE2-CZ3 4.35Å
345	N	95.9	Very high	90.8	Very high	11 Å²	11	29 Å²	29	6%	0.059	18%	0.184	C	C	.	.	H	α-helix	trans	-63.5	-41.1	175.8	-70.3	-18.3	0	0	0	112.1	K341 Y342 G343 Q349 L389 L390 T391 A394	K341-N345 PolarHBondContact O-N 3.37Å; Y342-N345 WeakPolarHBondContact O-CB 3.38Å; Y342-N345 PolarHBondContact O-N 3.31Å; Y342-N345 VanDerWaalsContact O-N 3.12Å; G343-N345 VanDerWaalsContact C-N 3.33Å; G343-N345 PolarHBondContact O-N 3.28Å; N345-Q349 PolarHBondContact O-N 2.76Å; N345-L389 PolarHBondContact ND2-O 3.46Å; N345-L390 WeakPolarHBondContact OD1-CA 3.28Å; N345-T391 HydrophobicContact CB-CG2 4.22Å; N345-T391 PolarHBondContact OD1-N 3.46Å; N345-A394 WeakPolarHBondContact OD1-CB 3.38Å
346	L	94.6	Very high	89.3	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-68.5	-43.4	176	-65.7	171.6	0	0	0	111.4	N276 I279 F280 I283 Y342 G343 A348 Q349 L350	N276-L346 HydrophobicContact CB-CD2 3.94Å; N276-L346 WeakPolarHBondContact OD1-CD2 3.27Å; I279-L346 HydrophobicContact CB-CD1 4.05Å; I279-L346 HydrophobicContact CG2-CD1 3.56Å; F280-L346 HydrophobicContact CB-CB 4.5Å; F280-L346 HydrophobicContact CB-CD1 4.18Å; F280-L346 HydrophobicContact CD2-CB 4.3Å; I283-L346 HydrophobicContact CD1-CD1 3.6Å; Y342-L346 HydrophobicContact CD1-CD1 4.25Å; Y342-L346 HydrophobicContact CE1-CD1 4.09Å; Y342-L346 WeakPolarHBondContact O-CG 3.45Å; Y342-L346 PolarHBondContact O-N 2.92Å; G343-L346 PolarHBondContact O-N 3.2Å; L346-A348 PolarHBondContact O-N 2.86Å; L346-Q349 WeakPolarHBondContact O-CB 3.09Å; L346-Q349 PolarHBondContact O-N 3.1Å; L346-L350 WeakPolarHBondContact O-CB 3.23Å; L346-L350 VanDerWaalsContact O-CG 3.3Å; L346-L350 WeakPolarHBondContact O-CG 3.27Å; L346-L350 PolarHBondContact O-N 2.65Å
347	L	94.9	Very high	88.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-35.7	176.5	-77.1	173	0	0	0	112.6	F280 G343 F344 Q349 L350 N351 L354 A359 Y362 V363 F366 L397	F280-L347 HydrophobicContact CD2-CD2 4.34Å; F280-L347 HydrophobicContact CD2-CG 4.18Å; F280-L347 HydrophobicContact CE1-CD2 4.12Å; F280-L347 HydrophobicContact CE2-CD1 3.84Å; F280-L347 HydrophobicContact CE2-CD2 3.62Å; F280-L347 HydrophobicContact CE2-CG 3.45Å; F280-L347 VanDerWaalsContact CE2-CG 3.45Å; F280-L347 HydrophobicContact CZ-CD1 4.1Å; F280-L347 HydrophobicContact CZ-CD2 3.51Å; F280-L347 HydrophobicContact CZ-CG 3.85Å; G343-L347 WeakPolarHBondContact O-CB 3.47Å; G343-L347 WeakPolarHBondContact O-CG 3.45Å; G343-L347 PolarHBondContact O-N 3.47Å; F344-L347 HydrophobicContact CD1-CD1 4.37Å; F344-L347 PolarHBondContact O-N 2.98Å; L347-Q349 VanDerWaalsContact C-N 3.34Å; L347-L350 PolarHBondContact O-N 3.12Å; L347-N351 WeakPolarHBondContact O-CB 3.39Å; L347-N351 PolarHBondContact O-N 2.99Å; L347-L354 HydrophobicContact CD2-CD1 3.65Å; L347-A359 HydrophobicContact CD2-CB 4.38Å; L347-Y362 HydrophobicContact CD2-CD2 4.06Å; L347-Y362 HydrophobicContact CD2-CG 4.12Å; L347-V363 HydrophobicContact CD1-CG2 4.12Å; L347-F366 HydrophobicContact CD1-CD2 4.13Å; L347-F366 HydrophobicContact CD1-CE2 3.88Å; L347-L397 HydrophobicContact CB-CD2 4.25Å
348	A	92.3	Very high	88.2	Confident	15 Å²	15	39.1 Å²	39.1	12%	0.124	24%	0.241	C	C	.	.	H	α-helix	trans	-65.3	-37.8	175.5	0	0	0	0	0	112.5	F344 L346 N351 E393 A394	F344-A348 PolarHBondContact O-N 3.01Å; L346-A348 PolarHBondContact O-N 2.86Å; A348-N351 WeakPolarHBondContact O-CB 3.45Å; A348-E393 HydrophobicContact CB-CB 3.85Å; A348-A394 HydrophobicContact CB-CB 3.86Å
349	Q	90.2	Very high	87.8	Confident	110 Å²	110	37 Å²	37	51%	0.514	23%	0.231	S	C	.	.	H	α-helix	trans	-74.8	-35.5	176.8	-65.7	178	42.3	0	0	112.2	N276 N345 L346 L347 N351	N276-Q349 PolarHBondContact ND2-OE1 3.16Å; N345-Q349 PolarHBondContact O-N 2.76Å; L346-Q349 WeakPolarHBondContact O-CB 3.09Å; L346-Q349 PolarHBondContact O-N 3.1Å; L347-Q349 VanDerWaalsContact C-N 3.34Å; Q349-N351 VanDerWaalsContact C-N 3.27Å; Q349-N351 PolarHBondContact O-N 3.25Å
350	L	87.2	Confident	87.5	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	25%	0.246	C	C	.	.	S	Bend	trans	-84.2	-0.3	178.6	-61.2	175.3	0	0	0	113	M273 N276 F280 L346 L347 G352 A353 L354	M273-L350 HydrophobicContact CG-CD2 3.67Å; N276-L350 HydrophobicContact CB-CD1 4.48Å; N276-L350 HydrophobicContact CB-CD2 3.95Å; N276-L350 HydrophobicContact CB-CG 4.34Å; F280-L350 HydrophobicContact CB-CD1 4.26Å; L346-L350 WeakPolarHBondContact O-CB 3.23Å; L346-L350 VanDerWaalsContact O-CG 3.3Å; L346-L350 WeakPolarHBondContact O-CG 3.27Å; L346-L350 PolarHBondContact O-N 2.65Å; L347-L350 PolarHBondContact O-N 3.12Å; L350-G352 PolarHBondContact O-N 2.93Å; L350-A353 WeakPolarHBondContact O-CB 3.49Å; L350-A353 PolarHBondContact O-N 3.17Å; L350-L354 HydrophobicContact CB-CD1 3.9Å; L350-L354 HydrophobicContact CB-CD2 4.45Å; L350-L354 HydrophobicContact CB-CG 3.95Å; L350-L354 PolarHBondContact O-N 3.28Å
351	N	82.9	Confident	87.2	Confident	76 Å²	76	46.3 Å²	46.3	41%	0.406	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	122.6	-176.6	-170.1	21.9	0	0	0	110.9	L347 A348 Q349 A359	L347-N351 WeakPolarHBondContact O-CB 3.39Å; L347-N351 PolarHBondContact O-N 2.99Å; A348-N351 WeakPolarHBondContact O-CB 3.45Å; Q349-N351 VanDerWaalsContact C-N 3.27Å; Q349-N351 PolarHBondContact O-N 3.25Å; N351-A359 HydrophobicContact CB-CB 4.46Å
352	G	74.9	Confident	87.1	Confident	75 Å²	75	47.7 Å²	47.7	77%	0.773	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	-17	-174.5	0	0	0	0	0	115.1	L350	L350-G352 PolarHBondContact O-N 2.93Å
353	A	75.9	Confident	87.1	Confident	51 Å²	51	45.7 Å²	45.7	42%	0.421	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-30.2	169.7	0	0	0	0	0	112.1	M273 L350 S355	M273-A353 HydrophobicContact CE-CB 4.42Å; M273-A353 HydrophobicContact SD-CB 3.44Å; M273-A353 WeakPolarHBondContact SD-CB 3.33Å; L350-A353 WeakPolarHBondContact O-CB 3.49Å; L350-A353 PolarHBondContact O-N 3.17Å; A353-S355 PolarHBondContact O-N 2.6Å
354	L	79	Confident	86.9	Confident	31 Å²	31	47.5 Å²	47.5	16%	0.162	28%	0.278	C	S	.	.			trans	-78.5	118.3	176.7	-59.6	174.7	0	0	0	110.8	L347 L350 A359 Y362	L347-L354 HydrophobicContact CD2-CD1 3.65Å; L350-L354 HydrophobicContact CB-CD1 3.9Å; L350-L354 HydrophobicContact CB-CD2 4.45Å; L350-L354 HydrophobicContact CB-CG 3.95Å; L350-L354 PolarHBondContact O-N 3.28Å; L354-A359 HydrophobicContact CD1-CB 4.34Å; L354-Y362 HydrophobicContact CD1-CD2 4.08Å; L354-Y362 HydrophobicContact CD1-CE2 4.23Å
355	S	69.7	Low	86.8	Confident	110 Å²	110	50.1 Å²	50.1	77%	0.769	29%	0.291	S	S	*	.			trans	-110.7	-19	-176.6	56.4	0	0	0	0	114.7	A353	A353-S355 PolarHBondContact O-N 2.6Å
356	N	64.6	Low	86.9	Confident	150 Å²	150	49.6 Å²	49.6	80%	0.802	29%	0.289	S	S	*	.	S	Bend	trans	-165.8	103.8	176.6	-175.9	36.9	0	0	0	112.3
357	P	83	Confident	87	Confident	40 Å²	40	49.5 Å²	49.5	26%	0.26	29%	0.288	S	S	.	.	S	Bend	cis	-65.3	155.1	-9.3	-9.2	23	0	0	0	112.6	R361 Y362	P357-R361 HydrophobicContact CB-CB 3.74Å; P357-R361 HydrophobicContact CB-CG 4.49Å; P357-Y362 HydrophobicContact CB-CD2 4.05Å; P357-Y362 HydrophobicContact CB-CE2 3.8Å; P357-Y362 VanDerWaalsContact CD-OH 3.24Å; P357-Y362 WeakPolarHBondContact CD-OH 3.34Å; P357-Y362 HydrophobicContact CG-CD2 4.39Å; P357-Y362 HydrophobicContact CG-CE1 3.95Å; P357-Y362 HydrophobicContact CG-CE2 3.78Å; P357-Y362 WeakPolarHBondContact O-CE2 3.28Å
358	T	87.9	Confident	86.9	Confident	56 Å²	56	52.1 Å²	52.1	34%	0.344	31%	0.306	S	S	.	.			trans	-76.4	162.3	170	41.7	0	0	0	0	110.9	D360 R361 Y362	T358-D360 WeakPolarHBondContact CB-OD1 3.36Å; T358-D360 PolarHBondContact O-N 3.15Å; T358-D360 PolarHBondContact OG1-OD1 3.1Å; T358-R361 WeakPolarHBondContact O-CB 3.44Å; T358-R361 PolarHBondContact O-N 2.79Å; T358-R361 WeakPolarHBondContact OG1-CG 3.14Å; T358-Y362 PolarHBondContact O-N 2.74Å
359	A	89.3	Confident	87.1	Confident	2 Å²	2	53.2 Å²	53.2	2%	0.017	31%	0.308	C	S	.	.	H	α-helix	trans	-58.3	-34.7	-174.5	0	0	0	0	0	113.5	L347 N351 L354 R361 Y362 V363 L397	L347-A359 HydrophobicContact CD2-CB 4.38Å; N351-A359 HydrophobicContact CB-CB 4.46Å; L354-A359 HydrophobicContact CD1-CB 4.34Å; A359-R361 PolarHBondContact O-N 2.81Å; A359-Y362 PolarHBondContact O-N 2.92Å; A359-V363 WeakPolarHBondContact O-CG2 3.43Å; A359-V363 PolarHBondContact O-N 3.06Å; A359-L397 HydrophobicContact CB-CD2 4.5Å
360	D	90.8	Very high	87.4	Confident	62 Å²	62	48 Å²	48	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-60.5	-40.2	173.4	61.8	-35.3	0	0	0	113	T358 V363 D364 V401	T358-D360 WeakPolarHBondContact CB-OD1 3.36Å; T358-D360 PolarHBondContact O-N 3.15Å; T358-D360 PolarHBondContact OG1-OD1 3.1Å; D360-V363 WeakPolarHBondContact O-CB 3.38Å; D360-V363 PolarHBondContact O-N 2.88Å; D360-D364 PolarHBondContact O-N 2.81Å; D360-V401 HydrophobicContact CB-CB 4.38Å; D360-V401 HydrophobicContact CB-CG1 3.6Å; D360-V401 HydrophobicContact CB-CG2 3.8Å
361	R	91.7	Very high	87.7	Confident	137 Å²	137	51.7 Å²	51.7	52%	0.517	30%	0.301	S	S	.	.	H	α-helix	trans	-68.8	-35.3	177.5	-58.1	-60.1	-73.8	163	-8.9	111.8	P357 T358 A359 D364 I365	P357-R361 HydrophobicContact CB-CB 3.74Å; P357-R361 HydrophobicContact CB-CG 4.49Å; T358-R361 WeakPolarHBondContact O-CB 3.44Å; T358-R361 PolarHBondContact O-N 2.79Å; T358-R361 WeakPolarHBondContact OG1-CG 3.14Å; A359-R361 PolarHBondContact O-N 2.81Å; R361-D364 IonicContact NH1-OD2 3.22Å; R361-D364 PolarHBondContact NH1-OD2 3.03Å; R361-D364 WeakPolarHBondContact O-CB 3.34Å; R361-D364 PolarHBondContact O-N 2.89Å; R361-I365 VanDerWaalsContact O-CG1 3.3Å; R361-I365 WeakPolarHBondContact O-CG1 3.41Å; R361-I365 PolarHBondContact O-N 3.2Å
362	Y	94.6	Very high	88.1	Confident	30 Å²	30	53.5 Å²	53.5	12%	0.118	31%	0.311	C	S	.	.	H	α-helix	trans	-69.8	-36.3	172.9	-77.2	-65.2	0	0	0	112.8	F280 L284 L347 L354 P357 T358 A359 D364 I365 F366	F280-Y362 AromaticContact CE1-CD1 3.85Å; F280-Y362 HydrophobicContact CE1-CD1 3.85Å; F280-Y362 HydrophobicContact CE1-CD2 4.21Å; F280-Y362 AromaticContact CE1-CE1 3.86Å; F280-Y362 HydrophobicContact CE1-CE1 3.86Å; F280-Y362 HydrophobicContact CE1-CE2 4.19Å; F280-Y362 HydrophobicContact CE1-CG 4.01Å; F280-Y362 AromaticContact CE1-CZ 4Å; F280-Y362 AromaticContact CZ-CD1 3.8Å; F280-Y362 HydrophobicContact CZ-CD1 3.8Å; F280-Y362 HydrophobicContact CZ-CD2 4.37Å; F280-Y362 HydrophobicContact CZ-CE1 4.28Å; F280-Y362 AromaticContact CZ-CG 3.83Å; F280-Y362 HydrophobicContact CZ-CG 3.83Å; L284-Y362 HydrophobicContact CD2-CE1 4.02Å; L347-Y362 HydrophobicContact CD2-CD2 4.06Å; L347-Y362 HydrophobicContact CD2-CG 4.12Å; L354-Y362 HydrophobicContact CD1-CD2 4.08Å; L354-Y362 HydrophobicContact CD1-CE2 4.23Å; P357-Y362 HydrophobicContact CB-CD2 4.05Å; P357-Y362 HydrophobicContact CB-CE2 3.8Å; P357-Y362 VanDerWaalsContact CD-OH 3.24Å; P357-Y362 WeakPolarHBondContact CD-OH 3.34Å; P357-Y362 HydrophobicContact CG-CD2 4.39Å; P357-Y362 HydrophobicContact CG-CE1 3.95Å; P357-Y362 HydrophobicContact CG-CE2 3.78Å; P357-Y362 WeakPolarHBondContact O-CE2 3.28Å; T358-Y362 PolarHBondContact O-N 2.74Å; A359-Y362 PolarHBondContact O-N 2.92Å; Y362-D364 VanDerWaalsContact C-N 3.3Å; Y362-D364 PolarHBondContact O-N 3.47Å; Y362-I365 HydrophobicContact CD1-CD1 4.03Å; Y362-I365 HydrophobicContact CE1-CD1 4.46Å; Y362-I365 PolarHBondContact O-N 2.92Å; Y362-F366 PolarHBondContact O-N 3.19Å
363	V	95.6	Very high	88.9	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.5	-46.3	169.8	170.4	0	0	0	0	109.9	F344 L347 A359 D360 I365 F366 F367 L397 L398 V401 L402	F344-V363 HydrophobicContact CD1-CG2 4.24Å; F344-V363 HydrophobicContact CE1-CB 4.48Å; F344-V363 HydrophobicContact CE1-CG1 4.26Å; F344-V363 HydrophobicContact CE1-CG2 4.21Å; L347-V363 HydrophobicContact CD1-CG2 4.12Å; A359-V363 WeakPolarHBondContact O-CG2 3.43Å; A359-V363 PolarHBondContact O-N 3.06Å; D360-V363 WeakPolarHBondContact O-CB 3.38Å; D360-V363 PolarHBondContact O-N 2.88Å; V363-I365 VanDerWaalsContact C-N 3.32Å; V363-I365 PolarHBondContact O-N 3.44Å; V363-F366 PolarHBondContact O-N 3.15Å; V363-F367 HydrophobicContact CG1-CD2 3.92Å; V363-F367 HydrophobicContact CG1-CE2 4.1Å; V363-F367 WeakPolarHBondContact O-CD2 2.99Å; V363-F367 PolarHBondContact O-N 3.05Å; V363-L397 HydrophobicContact CG2-CD2 4.27Å; V363-L398 HydrophobicContact CG1-CD2 3.65Å; V363-L398 HydrophobicContact CG2-CD2 4.08Å; V363-V401 HydrophobicContact CB-CG1 4.24Å; V363-V401 HydrophobicContact CG1-CG1 4.12Å; V363-L402 HydrophobicContact CG1-CD2 3.56Å; V363-L402 HydrophobicContact CG1-CG 4.42Å
364	D	93.8	Very high	89.7	Confident	38 Å²	38	49 Å²	49	20%	0.203	26%	0.262	C	S	.	.	H	α-helix	trans	-56.7	-44.8	175.6	-83.8	-30.5	0	0	0	112.6	D360 R361 Y362 F367 S368 K406	D360-D364 PolarHBondContact O-N 2.81Å; R361-D364 IonicContact NH1-OD2 3.22Å; R361-D364 PolarHBondContact NH1-OD2 3.03Å; R361-D364 WeakPolarHBondContact O-CB 3.34Å; R361-D364 PolarHBondContact O-N 2.89Å; Y362-D364 VanDerWaalsContact C-N 3.3Å; Y362-D364 PolarHBondContact O-N 3.47Å; D364-F367 PolarHBondContact O-N 3.26Å; D364-S368 PolarHBondContact O-N 3.18Å; D364-S368 PolarHBondContact O-OG 3.18Å; D364-K406 IonicContact OD1-NZ 2.65Å; D364-K406 PolarHBondContact OD1-NZ 3.3Å
365	I	94.6	Very high	90.4	Very high	56 Å²	56	52.3 Å²	52.3	29%	0.287	29%	0.285	S	S	.	.	H	α-helix	trans	-60.1	-49.6	178	-70	164.5	0	0	0	110.9	L284 R361 Y362 V363 F367 S368 F369	L284-I365 HydrophobicContact CD1-CG2 4.37Å; R361-I365 VanDerWaalsContact O-CG1 3.3Å; R361-I365 WeakPolarHBondContact O-CG1 3.41Å; R361-I365 PolarHBondContact O-N 3.2Å; Y362-I365 HydrophobicContact CD1-CD1 4.03Å; Y362-I365 HydrophobicContact CE1-CD1 4.46Å; Y362-I365 PolarHBondContact O-N 2.92Å; V363-I365 VanDerWaalsContact C-N 3.32Å; V363-I365 PolarHBondContact O-N 3.44Å; I365-F367 VanDerWaalsContact C-N 3.3Å; I365-F367 PolarHBondContact O-N 3.28Å; I365-S368 WeakPolarHBondContact O-CB 3.49Å; I365-S368 PolarHBondContact O-N 2.97Å; I365-S368 VanDerWaalsContact O-N 3.12Å; I365-F369 HydrophobicContact CG2-CD2 3.97Å; I365-F369 HydrophobicContact CG2-CE2 3.65Å; I365-F369 VanDerWaalsContact O-CD2 3.24Å; I365-F369 WeakPolarHBondContact O-CD2 3.26Å; I365-F369 PolarHBondContact O-N 3.2Å; I365-F369 VanDerWaalsContact O-N 3.11Å
366	F	97	Very high	91.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-40.1	177.2	-75.4	-11.3	0	0	0	112.4	F280 I283 L284 V287 I340 F344 L347 Y362 V363 S368 F369 L370	F280-F366 HydrophobicContact CD2-CZ 4.47Å; F280-F366 AromaticContact CE2-CE2 3.75Å; F280-F366 HydrophobicContact CE2-CE2 3.75Å; F280-F366 AromaticContact CE2-CZ 3.51Å; F280-F366 HydrophobicContact CE2-CZ 3.51Å; F280-F366 HydrophobicContact CZ-CE2 4.34Å; F280-F366 AromaticContact CZ-CZ 3.92Å; F280-F366 HydrophobicContact CZ-CZ 3.92Å; I283-F366 HydrophobicContact CG2-CZ 4.05Å; L284-F366 HydrophobicContact CD1-CE1 4.04Å; V287-F366 HydrophobicContact CG1-CD1 4.37Å; V287-F366 HydrophobicContact CG1-CE1 4.41Å; I340-F366 HydrophobicContact CD1-CB 3.92Å; I340-F366 HydrophobicContact CD1-CD1 3.61Å; I340-F366 HydrophobicContact CD1-CD2 4.24Å; I340-F366 HydrophobicContact CD1-CE1 4.13Å; I340-F366 HydrophobicContact CD1-CG 3.67Å; I340-F366 HydrophobicContact CG2-CB 4.49Å; F344-F366 AromaticContact CD1-CD2 3.9Å; F344-F366 HydrophobicContact CD1-CD2 3.9Å; F344-F366 HydrophobicContact CE1-CB 3.89Å; F344-F366 AromaticContact CE1-CD2 3.63Å; F344-F366 HydrophobicContact CE1-CD2 3.63Å; F344-F366 HydrophobicContact CE1-CG 4.29Å; F344-F366 HydrophobicContact CZ-CB 3.93Å; F344-F366 HydrophobicContact CZ-CD2 4.16Å; L347-F366 HydrophobicContact CD1-CD2 4.13Å; L347-F366 HydrophobicContact CD1-CE2 3.88Å; Y362-F366 PolarHBondContact O-N 3.19Å; V363-F366 PolarHBondContact O-N 3.15Å; F366-S368 VanDerWaalsContact C-N 3.34Å; F366-S368 PolarHBondContact O-N 2.99Å; F366-F369 PolarHBondContact O-N 3Å; F366-L370 WeakPolarHBondContact O-CG 3.44Å; F366-L370 PolarHBondContact O-N 3.11Å
367	F	96.4	Very high	92.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.9	-35.5	175.1	-89.8	-93.5	0	0	0	112.8	F344 V363 D364 I365 F369 L370 E371 L398 L402 K406 L409 W410	F344-F367 HydrophobicContact CE1-CD2 4.36Å; F344-F367 HydrophobicContact CE1-CE2 4.07Å; F344-F367 HydrophobicContact CE2-CE2 4.31Å; F344-F367 AromaticContact CZ-CD2 3.93Å; F344-F367 HydrophobicContact CZ-CD2 3.93Å; F344-F367 AromaticContact CZ-CE2 3.51Å; F344-F367 HydrophobicContact CZ-CE2 3.51Å; F344-F367 HydrophobicContact CZ-CZ 4.43Å; V363-F367 HydrophobicContact CG1-CD2 3.92Å; V363-F367 HydrophobicContact CG1-CE2 4.1Å; V363-F367 WeakPolarHBondContact O-CD2 2.99Å; V363-F367 PolarHBondContact O-N 3.05Å; D364-F367 PolarHBondContact O-N 3.26Å; I365-F367 VanDerWaalsContact C-N 3.3Å; I365-F367 PolarHBondContact O-N 3.28Å; F367-F369 VanDerWaalsContact C-N 3.31Å; F367-F369 PolarHBondContact O-N 3.31Å; F367-L370 HydrophobicContact CD1-CD1 4.45Å; F367-L370 HydrophobicContact CE1-CD1 4.46Å; F367-L370 PolarHBondContact O-N 3Å; F367-E371 WeakPolarHBondContact O-CB 3.28Å; F367-E371 VanDerWaalsContact O-CG 3.27Å; F367-E371 WeakPolarHBondContact O-CG 3.27Å; F367-E371 PolarHBondContact O-N 2.87Å; F367-L398 HydrophobicContact CE2-CD2 4.04Å; F367-L402 HydrophobicContact CD1-CD2 4.26Å; F367-L402 HydrophobicContact CD2-CD2 3.49Å; F367-L402 VanDerWaalsContact CD2-CD2 3.49Å; F367-L402 HydrophobicContact CE1-CD1 4.11Å; F367-L402 HydrophobicContact CE1-CD2 4.11Å; F367-L402 HydrophobicContact CE2-CD1 3.79Å; F367-L402 HydrophobicContact CE2-CD2 3.32Å; F367-L402 HydrophobicContact CE2-CG 4.16Å; F367-L402 HydrophobicContact CG-CD2 3.97Å; F367-L402 HydrophobicContact CZ-CD1 3.42Å; F367-L402 VanDerWaalsContact CZ-CD1 3.42Å; F367-L402 HydrophobicContact CZ-CD2 3.66Å; F367-L402 HydrophobicContact CZ-CG 4.19Å; F367-K406 HydrophobicContact CB-CD 3.8Å; F367-K406 HydrophobicContact CB-CG 4.35Å; F367-K406 HydrophobicContact CD1-CB 3.74Å; F367-K406 HydrophobicContact CD1-CD 4.17Å; F367-K406 HydrophobicContact CD1-CG 3.97Å; F367-K406 HydrophobicContact CE1-CB 4.04Å; F367-K406 WeakPolarHBondContact CE1-O 3.27Å; F367-K406 HydrophobicContact CG-CB 4.37Å; F367-K406 HydrophobicContact CG-CD 4.03Å; F367-K406 HydrophobicContact CG-CG 4.34Å; F367-L409 HydrophobicContact CD1-CD2 4.28Å; F367-W410 HydrophobicContact CE1-CB 4.03Å; F367-W410 HydrophobicContact CZ-CB 3.92Å; F367-W410 HydrophobicContact CZ-CG 4.32Å
368	S	94.5	Very high	93.1	Very high	54 Å²	54	43.5 Å²	43.5	38%	0.378	23%	0.23	S	C	.	.	H	α-helix	trans	-61.3	-38.5	171.6	-63.6	0	0	0	0	112.2	D364 I365 F366 N372	D364-S368 PolarHBondContact O-N 3.18Å; D364-S368 PolarHBondContact O-OG 3.18Å; I365-S368 WeakPolarHBondContact O-CB 3.49Å; I365-S368 PolarHBondContact O-N 2.97Å; I365-S368 VanDerWaalsContact O-N 3.12Å; F366-S368 VanDerWaalsContact C-N 3.34Å; F366-S368 PolarHBondContact O-N 2.99Å; S368-N372 PolarHBondContact O-N 3.29Å; S368-N372 PolarHBondContact O-ND2 3.47Å
369	F	95.6	Very high	93.2	Very high	38 Å²	38	49.5 Å²	49.5	17%	0.167	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-42.3	172.6	-75.4	-73.9	0	0	0	112.3	V287 E288 F336 I365 F366 F367 N372 T373	V287-F369 HydrophobicContact CG1-CB 4.24Å; V287-F369 HydrophobicContact CG1-CD1 4.2Å; V287-F369 HydrophobicContact CG1-CD2 3.55Å; V287-F369 HydrophobicContact CG1-CE1 4.48Å; V287-F369 HydrophobicContact CG1-CE2 3.87Å; V287-F369 HydrophobicContact CG1-CG 3.74Å; V287-F369 HydrophobicContact CG1-CZ 4.34Å; E288-F369 HydrophobicContact CG-CE2 4.37Å; E288-F369 HydrophobicContact CG-CZ 3.81Å; F336-F369 HydrophobicContact CE2-CB 4.2Å; F336-F369 HydrophobicContact CZ-CB 3.96Å; I365-F369 HydrophobicContact CG2-CD2 3.97Å; I365-F369 HydrophobicContact CG2-CE2 3.65Å; I365-F369 VanDerWaalsContact O-CD2 3.24Å; I365-F369 WeakPolarHBondContact O-CD2 3.26Å; I365-F369 PolarHBondContact O-N 3.2Å; I365-F369 VanDerWaalsContact O-N 3.11Å; F366-F369 PolarHBondContact O-N 3Å; F367-F369 VanDerWaalsContact C-N 3.31Å; F367-F369 PolarHBondContact O-N 3.31Å; F369-N372 PolarHBondContact O-N 3.23Å; F369-T373 WeakPolarHBondContact O-CB 3.16Å; F369-T373 VanDerWaalsContact O-CG2 3.26Å; F369-T373 WeakPolarHBondContact O-CG2 3.39Å; F369-T373 PolarHBondContact O-N 3.1Å; F369-T373 VanDerWaalsContact O-N 3.1Å; F369-T373 PolarHBondContact O-OG1 2.81Å
370	L	95.6	Very high	93.3	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.6	-46.1	177.8	-71.1	174.7	0	0	0	112.2	F336 L337 I340 F344 F366 F367 N372 T373 I374 M413	F336-L370 HydrophobicContact CE1-CD2 4.02Å; F336-L370 HydrophobicContact CZ-CD2 4.42Å; L337-L370 HydrophobicContact CD2-CD2 3.74Å; I340-L370 HydrophobicContact CG1-CD2 4.45Å; I340-L370 HydrophobicContact CG2-CD1 4.05Å; I340-L370 HydrophobicContact CG2-CD2 4.24Å; I340-L370 HydrophobicContact CG2-CG 4.32Å; F344-L370 HydrophobicContact CZ-CD1 4.49Å; F366-L370 WeakPolarHBondContact O-CG 3.44Å; F366-L370 PolarHBondContact O-N 3.11Å; F367-L370 HydrophobicContact CD1-CD1 4.45Å; F367-L370 HydrophobicContact CE1-CD1 4.46Å; F367-L370 PolarHBondContact O-N 3Å; L370-N372 VanDerWaalsContact C-N 3.27Å; L370-N372 PolarHBondContact O-N 3.43Å; L370-T373 WeakPolarHBondContact CA-OG1 3.22Å; L370-T373 PolarHBondContact O-N 3.45Å; L370-T373 VanDerWaalsContact O-N 3.17Å; L370-T373 PolarHBondContact O-OG1 3.31Å; L370-I374 HydrophobicContact CB-CD1 3.96Å; L370-I374 HydrophobicContact CD2-CD1 4.35Å; L370-I374 WeakPolarHBondContact O-CB 3.47Å; L370-I374 VanDerWaalsContact O-CG1 3.26Å; L370-I374 WeakPolarHBondContact O-CG1 3.43Å; L370-I374 PolarHBondContact O-N 2.83Å; L370-M413 HydrophobicContact CD1-CE 4.46Å; L370-M413 HydrophobicContact CD1-SD 4.26Å; L370-M413 HydrophobicContact CD2-CE 3.96Å
371	E	94.2	Very high	93.4	Very high	80 Å²	80	52.8 Å²	52.8	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-59.2	-38.2	178.8	-76.3	170.1	177.4	0	0	112.3	F367 P375 K406 L409	F367-E371 WeakPolarHBondContact O-CB 3.28Å; F367-E371 VanDerWaalsContact O-CG 3.27Å; F367-E371 WeakPolarHBondContact O-CG 3.27Å; F367-E371 PolarHBondContact O-N 2.87Å; E371-P375 WeakPolarHBondContact O-CD 3.11Å; E371-P375 WeakPolarHBondContact O-CG 3.16Å; E371-K406 WeakPolarHBondContact OE1-CG 3.33Å; E371-L409 HydrophobicContact CG-CD2 3.66Å
372	N	91.2	Very high	93.5	Very high	113 Å²	113	46.6 Å²	46.6	60%	0.604	25%	0.248	S	C	*	.	H	α-helix	trans	-77.6	-25.6	178.8	-72.9	-46.2	0	0	0	113.3	S368 F369 L370 L376	S368-N372 PolarHBondContact O-N 3.29Å; S368-N372 PolarHBondContact O-ND2 3.47Å; F369-N372 PolarHBondContact O-N 3.23Å; L370-N372 VanDerWaalsContact C-N 3.27Å; L370-N372 PolarHBondContact O-N 3.43Å; N372-L376 WeakPolarHBondContact O-CD1 3.5Å
373	T	93	Very high	93.5	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-98.9	-43.3	-173.4	53	0	0	0	0	113.1	F290 V294 F336 F369 L370 P375 L376 Y377	F290-T373 HydrophobicContact CD1-CG2 4.36Å; F290-T373 HydrophobicContact CE1-CG2 3.93Å; V294-T373 HydrophobicContact CG1-CG2 4.39Å; V294-T373 HydrophobicContact CG2-CG2 4.46Å; F336-T373 HydrophobicContact CE1-CG2 4.31Å; F336-T373 WeakPolarHBondContact CE1-OG1 3.41Å; F336-T373 HydrophobicContact CZ-CG2 4.14Å; F369-T373 WeakPolarHBondContact O-CB 3.16Å; F369-T373 VanDerWaalsContact O-CG2 3.26Å; F369-T373 WeakPolarHBondContact O-CG2 3.39Å; F369-T373 PolarHBondContact O-N 3.1Å; F369-T373 VanDerWaalsContact O-N 3.1Å; F369-T373 PolarHBondContact O-OG1 2.81Å; L370-T373 WeakPolarHBondContact CA-OG1 3.22Å; L370-T373 PolarHBondContact O-N 3.45Å; L370-T373 VanDerWaalsContact O-N 3.17Å; L370-T373 PolarHBondContact O-OG1 3.31Å; T373-P375 VanDerWaalsContact C-CD 3.46Å; T373-L376 WeakPolarHBondContact O-CB 3.47Å; T373-L376 PolarHBondContact O-N 3.49Å; T373-Y377 WeakPolarHBondContact O-CD2 3.15Å
374	I	92.5	Very high	93.3	Very high	31 Å²	31	51.5 Å²	51.5	16%	0.159	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-51.2	-45.7	-175.9	-72.8	167.6	0	0	0	113.2	L370 L376 Y377 L409 M413	L370-I374 HydrophobicContact CB-CD1 3.96Å; L370-I374 HydrophobicContact CD2-CD1 4.35Å; L370-I374 WeakPolarHBondContact O-CB 3.47Å; L370-I374 VanDerWaalsContact O-CG1 3.26Å; L370-I374 WeakPolarHBondContact O-CG1 3.43Å; L370-I374 PolarHBondContact O-N 2.83Å; I374-L376 PolarHBondContact O-N 3.03Å; I374-L376 VanDerWaalsContact O-N 3.07Å; I374-Y377 PolarHBondContact O-N 3.28Å; I374-L409 HydrophobicContact CD1-CD1 3.8Å; I374-L409 HydrophobicContact CD1-CD2 4.12Å; I374-L409 HydrophobicContact CD1-CG 4.06Å; I374-L409 HydrophobicContact CG2-CD1 4.43Å; I374-M413 HydrophobicContact CD1-CE 3.93Å; I374-M413 HydrophobicContact CD1-CG 4.32Å; I374-M413 HydrophobicContact CD1-SD 4.08Å
375	P	92.1	Very high	93.4	Very high	99 Å²	99	49.9 Å²	49.9	64%	0.643	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-65.7	-13.2	-178.6	-22	34.5	0	0	0	114.9	E371 T373	E371-P375 WeakPolarHBondContact O-CD 3.11Å; E371-P375 WeakPolarHBondContact O-CG 3.16Å; T373-P375 VanDerWaalsContact C-CD 3.46Å
376	L	91.2	Very high	93.2	Very high	27 Å²	27	50 Å²	50	14%	0.141	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-93.5	-16.5	-175.3	-55.5	178.8	0	0	0	113	V294 M298 L327 N372 T373 I374	V294-L376 HydrophobicContact CG1-CD1 3.32Å; M298-L376 HydrophobicContact CE-CD2 3.8Å; M298-L376 HydrophobicContact CG-CD1 3.88Å; M298-L376 HydrophobicContact SD-CD1 3.86Å; M298-L376 HydrophobicContact SD-CD2 3.59Å; M298-L376 VanDerWaalsContact SD-CD2 3.59Å; M298-L376 HydrophobicContact SD-CG 4.39Å; L327-L376 HydrophobicContact CD1-CB 4.02Å; L327-L376 HydrophobicContact CD2-CD1 4.24Å; N372-L376 WeakPolarHBondContact O-CD1 3.5Å; T373-L376 WeakPolarHBondContact O-CB 3.47Å; T373-L376 PolarHBondContact O-N 3.49Å; I374-L376 PolarHBondContact O-N 3.03Å; I374-L376 VanDerWaalsContact O-N 3.07Å
377	Y	92.6	Very high	93	Very high	19 Å²	19	50.9 Å²	50.9	8%	0.075	29%	0.287	C	S	.	.	S	Bend	trans	-115	160.2	-177	-68.9	-85.1	0	0	0	111.7	F290 P328 Y333 T373 I374 E379	F290-Y377 HydrophobicContact CE1-CE2 4.42Å; F290-Y377 HydrophobicContact CZ-CE2 4.02Å; F290-Y377 AromaticContact CZ-CZ 3.86Å; F290-Y377 WeakPolarHBondContact CZ-OH 3.12Å; P328-Y377 WeakPolarHBondContact CD-OH 3.44Å; P328-Y377 WeakPolarHBondContact O-CE1 3.41Å; P328-Y377 PolarHBondContact O-OH 2.85Å; Y333-Y377 AromaticContact CD1-CD1 3.72Å; Y333-Y377 HydrophobicContact CD1-CD1 3.72Å; Y333-Y377 AromaticContact CD1-CD2 3.98Å; Y333-Y377 HydrophobicContact CD1-CD2 3.98Å; Y333-Y377 HydrophobicContact CD1-CE1 4.4Å; Y333-Y377 AromaticContact CD1-CG 3.48Å; Y333-Y377 HydrophobicContact CD1-CG 3.48Å; Y333-Y377 VanDerWaalsContact CD1-CG 3.48Å; Y333-Y377 HydrophobicContact CD2-CD1 4.41Å; Y333-Y377 AromaticContact CD2-CD2 3.56Å; Y333-Y377 HydrophobicContact CD2-CD2 3.56Å; Y333-Y377 AromaticContact CD2-CE2 3.68Å; Y333-Y377 HydrophobicContact CD2-CE2 3.68Å; Y333-Y377 AromaticContact CD2-CG 3.96Å; Y333-Y377 HydrophobicContact CD2-CG 3.96Å; Y333-Y377 HydrophobicContact CE1-CD1 4.37Å; Y333-Y377 HydrophobicContact CE1-CD2 4.06Å; Y333-Y377 AromaticContact CE1-CG 3.69Å; Y333-Y377 HydrophobicContact CE1-CG 3.69Å; Y333-Y377 AromaticContact CE2-CD2 3.65Å; Y333-Y377 HydrophobicContact CE2-CD2 3.65Å; Y333-Y377 HydrophobicContact CE2-CE2 4.13Å; Y333-Y377 HydrophobicContact CE2-CG 4.14Å; Y333-Y377 AromaticContact CG-CD1 3.74Å; Y333-Y377 HydrophobicContact CG-CD1 3.74Å; Y333-Y377 AromaticContact CG-CD2 3.73Å; Y333-Y377 HydrophobicContact CG-CD2 3.73Å; Y333-Y377 AromaticContact CG-CE1 3.96Å; Y333-Y377 HydrophobicContact CG-CE1 3.96Å; Y333-Y377 AromaticContact CG-CE2 3.96Å; Y333-Y377 HydrophobicContact CG-CE2 3.96Å; Y333-Y377 AromaticContact CG-CG 3.62Å; Y333-Y377 HydrophobicContact CG-CG 3.62Å; Y333-Y377 AromaticContact CZ-CD2 3.9Å; T373-Y377 WeakPolarHBondContact O-CD2 3.15Å; I374-Y377 PolarHBondContact O-N 3.28Å; Y377-E379 PolarHBondContact O-N 2.91Å
378	P	90.8	Very high	92.9	Very high	70 Å²	70	51 Å²	51	46%	0.455	29%	0.288	S	S	.	.			trans	-56.8	135.1	175.6	-25.5	33.6	0	0	0	113.6	D380 I381	P378-D380 WeakPolarHBondContact CB-OD1 3.43Å; P378-D380 PolarHBondContact O-N 3.11Å; P378-I381 HydrophobicContact CB-CD1 4.12Å; P378-I381 HydrophobicContact CB-CG1 4.19Å; P378-I381 HydrophobicContact CG-CD1 4.01Å; P378-I381 PolarHBondContact O-N 3.31Å
379	E	89.8	Confident	93	Very high	181 Å²	181	48.5 Å²	48.5	85%	0.846	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.2	-176.2	-65.6	-179.8	178.5	0	0	113.7	Y377 P383	Y377-E379 PolarHBondContact O-N 2.91Å; E379-P383 WeakPolarHBondContact O-CD 3.38Å
380	D	91.4	Very high	93	Very high	119 Å²	119	46.7 Å²	46.7	64%	0.636	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-15.7	178.2	59.6	-48.6	0	0	0	113.6	P378	P378-D380 WeakPolarHBondContact CB-OD1 3.43Å; P378-D380 PolarHBondContact O-N 3.11Å
381	I	93.6	Very high	93	Very high	14 Å²	14	48.1 Å²	48.1	7%	0.072	27%	0.271	C	S	.	.	H	α-helix	trans	-72.4	-52.5	-177.8	-60.6	174.6	0	0	0	112.3	W330 Y333 V334 L337 P378 S384 V385	W330-I381 HydrophobicContact CB-CD1 4.01Å; Y333-I381 HydrophobicContact CD1-CB 4.34Å; Y333-I381 HydrophobicContact CD1-CD1 4.13Å; Y333-I381 HydrophobicContact CD1-CG2 3.84Å; Y333-I381 HydrophobicContact CE1-CB 4.16Å; Y333-I381 HydrophobicContact CE1-CG2 3.96Å; V334-I381 HydrophobicContact CG2-CG2 3.68Å; L337-I381 HydrophobicContact CD1-CG2 4.36Å; P378-I381 HydrophobicContact CB-CD1 4.12Å; P378-I381 HydrophobicContact CB-CG1 4.19Å; P378-I381 HydrophobicContact CG-CD1 4.01Å; P378-I381 PolarHBondContact O-N 3.31Å; I381-S384 WeakPolarHBondContact O-CA 3.49Å; I381-S384 WeakPolarHBondContact O-CB 3.32Å; I381-S384 PolarHBondContact O-N 3.17Å; I381-S384 PolarHBondContact O-OG 2.64Å; I381-V385 HydrophobicContact CG2-CG2 4.4Å
382	P	94.5	Very high	92.9	Very high	7 Å²	7	50.1 Å²	50.1	5%	0.045	28%	0.28	C	S	.	.	H	α-helix	trans	-54.6	-41.9	-176.1	-22	31.2	0	0	0	114.6	L337 S384 V385 M413 W417	L337-P382 HydrophobicContact CD1-CB 4.2Å; L337-P382 HydrophobicContact CD1-CG 4.22Å; P382-S384 PolarHBondContact O-N 2.82Å; P382-V385 PolarHBondContact O-N 2.89Å; P382-M413 CarbonylContact C-O 3.18Å; P382-M413 VanDerWaalsContact C-O 3.31Å; P382-M413 HydrophobicContact CB-CB 4.23Å; P382-M413 HydrophobicContact CB-CE 4.15Å; P382-W417 PolarHBondContact O-NE1 2.89Å
383	P	93.5	Very high	93	Very high	58 Å²	58	49.7 Å²	49.7	38%	0.377	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-23.1	175	-22.6	33.7	0	0	0	114.4	E379 M413 C416	E379-P383 WeakPolarHBondContact O-CD 3.38Å; P383-M413 VanDerWaalsContact CA-O 3.26Å; P383-M413 WeakPolarHBondContact CA-O 3.29Å; P383-M413 WeakPolarHBondContact CD-O 3.29Å; P383-M413 WeakPolarHBondContact CG-O 3.3Å; P383-M413 VanDerWaalsContact N-O 3.1Å; P383-C416 PolarHBondContact O-SG 3.45Å
384	S	92.5	Very high	93.1	Very high	75 Å²	75	49.6 Å²	49.6	52%	0.524	27%	0.274	S	S	.	.	H	α-helix	trans	-79.1	-16.3	179.3	78.2	0	0	0	0	113.7	I381 P382 T386	I381-S384 WeakPolarHBondContact O-CA 3.49Å; I381-S384 WeakPolarHBondContact O-CB 3.32Å; I381-S384 PolarHBondContact O-N 3.17Å; I381-S384 PolarHBondContact O-OG 2.64Å; P382-S384 PolarHBondContact O-N 2.82Å; S384-T386 PolarHBondContact O-N 3.07Å
385	V	94.2	Very high	93.3	Very high	5 Å²	5	49 Å²	49	3%	0.03	27%	0.271	C	S	.	.			trans	-84.6	81.5	-176.4	-172.7	0	0	0	0	110.8	V334 L337 Q338 K341 I381 P382 C416	V334-V385 HydrophobicContact CB-CG2 4.48Å; V334-V385 HydrophobicContact CG1-CG1 4.5Å; V334-V385 HydrophobicContact CG1-CG2 4.07Å; V334-V385 HydrophobicContact CG2-CG2 4.18Å; L337-V385 HydrophobicContact CB-CG1 4.29Å; L337-V385 HydrophobicContact CB-CG2 4.29Å; L337-V385 HydrophobicContact CD1-CG2 3.91Å; Q338-V385 HydrophobicContact CB-CG1 4.46Å; Q338-V385 HydrophobicContact CG-CG1 3.37Å; K341-V385 HydrophobicContact CD-CG1 4.36Å; K341-V385 PolarHBondContact NZ-O 3.1Å; I381-V385 HydrophobicContact CG2-CG2 4.4Å; P382-V385 PolarHBondContact O-N 2.89Å; V385-C416 PolarHBondContact O-SG 3.42Å
386	T	91.6	Very high	93.4	Very high	59 Å²	59	50.4 Å²	50.4	36%	0.362	26%	0.264	S	S	.	.			trans	-76.1	-48	-177	54	0	0	0	0	113.2	K341 S384 P388 L389 C416 W424	K341-T386 PolarHBondContact NZ-O 3.16Å; S384-T386 PolarHBondContact O-N 3.07Å; T386-P388 CarbonylContact O-C 3.5Å; T386-L389 WeakPolarHBondContact O-CD2 3.36Å; T386-L389 PolarHBondContact O-N 3.35Å; T386-C416 HydrophobicContact CG2-CB 4.28Å; T386-W424 HydrophobicContact CG2-CZ2 4.41Å
387	S	92.1	Very high	93.6	Very high	17 Å²	17	49.4 Å²	49.4	12%	0.119	26%	0.259	C	S	.	.	S	Bend	trans	-94.4	132	-178.2	-168.1	0	0	0	0	112.5	Q338 D429	Q338-S387 VanDerWaalsContact CG-O 3.27Å; Q338-S387 WeakPolarHBondContact CG-O 3.4Å; Q338-S387 PolarHBondContact NE2-O 3.33Å; S387-D429 PolarHBondContact OG-O 2.95Å
388	P	95.3	Very high	93.7	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.019	26%	0.256	C	S	.	.	S	Bend	cis	-78.6	147.4	-5.2	28	-27.2	0	0	0	111.9	K341 Y342 T386 Y431	K341-P388 HydrophobicContact CB-CG 3.93Å; K341-P388 VanDerWaalsContact CD-O 3.31Å; K341-P388 WeakPolarHBondContact CD-O 3.5Å; K341-P388 WeakPolarHBondContact CE-O 3.37Å; K341-P388 PolarHBondContact NZ-O 3.47Å; Y342-P388 HydrophobicContact CD2-CG 4.33Å; Y342-P388 HydrophobicContact CG-CG 4.46Å; T386-P388 CarbonylContact O-C 3.5Å; P388-Y431 HydrophobicContact CB-CD1 4.24Å; P388-Y431 HydrophobicContact CB-CG 4.11Å; P388-Y431 HydrophobicContact CG-CD1 3.65Å; P388-Y431 HydrophobicContact CG-CE1 4.29Å; P388-Y431 HydrophobicContact CG-CG 3.82Å
389	L	95.4	Very high	93.9	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-74.1	150.2	165.2	-68.8	171.4	0	0	0	110.8	N345 T386 C416 R421 W424 V428	N345-L389 PolarHBondContact ND2-O 3.46Å; T386-L389 WeakPolarHBondContact O-CD2 3.36Å; T386-L389 PolarHBondContact O-N 3.35Å; L389-C416 HydrophobicContact CD2-CB 4.27Å; L389-R421 HydrophobicContact CB-CB 3.87Å; L389-R421 HydrophobicContact CB-CG 4.4Å; L389-R421 HydrophobicContact CD1-CB 4.37Å; L389-R421 HydrophobicContact CD1-CG 4.38Å; L389-W424 HydrophobicContact CD1-CB 3.53Å; L389-W424 HydrophobicContact CD1-CD2 4.03Å; L389-W424 HydrophobicContact CD1-CG 3.42Å; L389-W424 VanDerWaalsContact CD1-CG 3.42Å; L389-W424 HydrophobicContact CD2-CD2 3.87Å; L389-W424 HydrophobicContact CD2-CE3 4.02Å; L389-W424 HydrophobicContact CD2-CG 4.18Å; L389-W424 HydrophobicContact CG-CG 4.45Å; L389-V428 HydrophobicContact CD1-CB 4.17Å; L389-V428 HydrophobicContact CD1-CG2 3.68Å; L389-V428 HydrophobicContact CG-CG2 4.26Å
390	L	95.9	Very high	94	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-71.7	145.5	176.4	-61.6	-171.2	0	0	0	111.3	K341 F344 N345 A394 V395 L398 W417 P420 R421	K341-L390 HydrophobicContact CB-CD2 3.98Å; K341-L390 HydrophobicContact CG-CD2 4.37Å; K341-L390 WeakPolarHBondContact O-CD2 3.23Å; F344-L390 HydrophobicContact CB-CD2 4.02Å; F344-L390 HydrophobicContact CD2-CD2 4.31Å; N345-L390 WeakPolarHBondContact OD1-CA 3.28Å; L390-A394 HydrophobicContact CB-CB 4.39Å; L390-V395 HydrophobicContact CB-CG2 3.8Å; L390-V395 HydrophobicContact CD1-CG2 4.25Å; L390-L398 HydrophobicContact CD1-CD1 3.76Å; L390-W417 WeakPolarHBondContact CD1-O 3.49Å; L390-P420 CarbonylContact O-C 3.55Å; L390-P420 VanDerWaalsContact O-CA 3.28Å; L390-P420 WeakPolarHBondContact O-CA 3.49Å; L390-R421 PolarHBondContact O-N 3Å
391	T	94.9	Very high	94.1	Very high	30 Å²	30	42 Å²	42	18%	0.184	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-77.2	163.8	171.4	77.2	0	0	0	0	111.1	N345 E393 A394 V395	N345-T391 HydrophobicContact CB-CG2 4.22Å; N345-T391 PolarHBondContact OD1-N 3.46Å; T391-E393 WeakPolarHBondContact CB-OE2 3.3Å; T391-E393 PolarHBondContact O-N 2.93Å; T391-E393 PolarHBondContact OG1-OE2 3.3Å; T391-A394 PolarHBondContact O-N 3.35Å; T391-A394 PolarHBondContact OG1-N 3.47Å; T391-V395 WeakPolarHBondContact O-CG2 3.32Å; T391-V395 PolarHBondContact O-N 3.32Å
392	E	93.8	Very high	94.2	Very high	122 Å²	122	42.1 Å²	42.1	57%	0.57	22%	0.221	S	C	*	.	H	α-helix	trans	-61.9	-36.8	178.1	-170.3	167	167.8	0	0	111.5	V395 R396 P420 S422	E392-V395 PolarHBondContact O-N 3.26Å; E392-R396 WeakPolarHBondContact O-CB 2.97Å; E392-R396 PolarHBondContact O-N 2.94Å; E392-P420 HydrophobicContact CB-CB 4.34Å; E392-S422 PolarHBondContact OE2-OG 3.23Å
393	E	92.9	Very high	94.1	Very high	103 Å²	103	44.7 Å²	44.7	48%	0.481	23%	0.234	S	C	.	.	H	α-helix	trans	-65.2	-40.3	175.4	-56.8	75.7	-166.9	0	0	111.7	A348 T391 R396 L397	A348-E393 HydrophobicContact CB-CB 3.85Å; T391-E393 WeakPolarHBondContact CB-OE2 3.3Å; T391-E393 PolarHBondContact O-N 2.93Å; T391-E393 PolarHBondContact OG1-OE2 3.3Å; E393-R396 PolarHBondContact O-N 3.48Å; E393-L397 WeakPolarHBondContact O-CB 3.48Å; E393-L397 PolarHBondContact O-N 2.93Å
394	A	95.7	Very high	94.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.2	-46.4	177.1	0	0	0	0	0	111.5	F344 N345 A348 L390 T391 R396 L397 L398	F344-A394 HydrophobicContact CB-CB 4.5Å; N345-A394 WeakPolarHBondContact OD1-CB 3.38Å; A348-A394 HydrophobicContact CB-CB 3.86Å; L390-A394 HydrophobicContact CB-CB 4.39Å; T391-A394 PolarHBondContact O-N 3.35Å; T391-A394 PolarHBondContact OG1-N 3.47Å; A394-R396 VanDerWaalsContact C-N 3.26Å; A394-R396 PolarHBondContact O-N 2.91Å; A394-L397 PolarHBondContact O-N 2.96Å; A394-L398 WeakPolarHBondContact O-CG 3.49Å; A394-L398 PolarHBondContact O-N 3.43Å
395	V	95.8	Very high	94.2	Very high	18 Å²	18	51.4 Å²	51.4	11%	0.109	26%	0.262	C	S	.	.	H	α-helix	trans	-60.3	-38.8	175	174	0	0	0	0	110.9	L390 T391 E392 N399 W410 P420	L390-V395 HydrophobicContact CB-CG2 3.8Å; L390-V395 HydrophobicContact CD1-CG2 4.25Å; T391-V395 WeakPolarHBondContact O-CG2 3.32Å; T391-V395 PolarHBondContact O-N 3.32Å; E392-V395 PolarHBondContact O-N 3.26Å; V395-N399 WeakPolarHBondContact O-CB 3.27Å; V395-N399 PolarHBondContact O-N 2.95Å; V395-N399 PolarHBondContact O-ND2 3.46Å; V395-W410 HydrophobicContact CG1-CH2 4.01Å; V395-W410 HydrophobicContact CG1-CZ2 4.26Å; V395-P420 HydrophobicContact CG2-CB 4.07Å
396	R	94.6	Very high	94.1	Very high	129 Å²	129	52.2 Å²	52.2	49%	0.487	27%	0.265	S	S	.	.	H	α-helix	trans	-65.1	-45.5	174.9	-171.7	-178.8	67.5	84.1	-4.2	111.9	E392 E393 A394 N399 Q400	E392-R396 WeakPolarHBondContact O-CB 2.97Å; E392-R396 PolarHBondContact O-N 2.94Å; E393-R396 PolarHBondContact O-N 3.48Å; A394-R396 VanDerWaalsContact C-N 3.26Å; A394-R396 PolarHBondContact O-N 2.91Å; R396-N399 PolarHBondContact O-N 3.37Å; R396-Q400 VanDerWaalsContact NH1-NE2 3.12Å; R396-Q400 WeakPolarHBondContact O-CG 3.4Å; R396-Q400 PolarHBondContact O-N 2.95Å
397	L	94	Very high	94.3	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-49.4	177	176.9	65	0	0	0	111.2	L347 A359 V363 E393 A394 N399 Q400 V401	L347-L397 HydrophobicContact CB-CD2 4.25Å; A359-L397 HydrophobicContact CB-CD2 4.5Å; V363-L397 HydrophobicContact CG2-CD2 4.27Å; E393-L397 WeakPolarHBondContact O-CB 3.48Å; E393-L397 PolarHBondContact O-N 2.93Å; A394-L397 PolarHBondContact O-N 2.96Å; L397-N399 VanDerWaalsContact C-N 3.33Å; L397-N399 PolarHBondContact O-N 3.31Å; L397-Q400 PolarHBondContact O-N 3.04Å; L397-V401 HydrophobicContact CD1-CG2 3.8Å; L397-V401 HydrophobicContact CG-CG2 4.43Å; L397-V401 WeakPolarHBondContact O-CG2 3.38Å; L397-V401 PolarHBondContact O-N 2.91Å
398	L	95.7	Very high	94.3	Very high	2 Å²	2	58.1 Å²	58.1	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-60.4	-41.7	178.5	-67.9	-179.3	0	0	0	112	F344 V363 F367 L390 A394 Q400 V401 L402 W410	F344-L398 HydrophobicContact CD1-CD2 3.82Å; F344-L398 HydrophobicContact CD2-CD1 4.22Å; F344-L398 HydrophobicContact CE1-CD2 3.79Å; F344-L398 HydrophobicContact CE2-CD1 4.48Å; F344-L398 HydrophobicContact CG-CD1 4.32Å; F344-L398 HydrophobicContact CG-CD2 4.3Å; F344-L398 HydrophobicContact CZ-CD2 4.22Å; V363-L398 HydrophobicContact CG1-CD2 3.65Å; V363-L398 HydrophobicContact CG2-CD2 4.08Å; F367-L398 HydrophobicContact CE2-CD2 4.04Å; L390-L398 HydrophobicContact CD1-CD1 3.76Å; A394-L398 WeakPolarHBondContact O-CG 3.49Å; A394-L398 PolarHBondContact O-N 3.43Å; L398-Q400 PolarHBondContact O-N 3.3Å; L398-V401 PolarHBondContact O-N 3.06Å; L398-L402 HydrophobicContact CB-CD1 3.95Å; L398-L402 HydrophobicContact CB-CG 4.4Å; L398-L402 HydrophobicContact CD2-CD1 4.23Å; L398-L402 HydrophobicContact CD2-CG 4.41Å; L398-L402 WeakPolarHBondContact O-CB 3.38Å; L398-L402 WeakPolarHBondContact O-CG 3.43Å; L398-L402 PolarHBondContact O-N 3.39Å; L398-W410 HydrophobicContact CB-CE3 4.41Å; L398-W410 HydrophobicContact CB-CH2 3.9Å; L398-W410 HydrophobicContact CB-CZ2 4.13Å; L398-W410 HydrophobicContact CB-CZ3 4.05Å; L398-W410 HydrophobicContact CD1-CD2 4.42Å; L398-W410 HydrophobicContact CD1-CH2 4.48Å; L398-W410 HydrophobicContact CD1-CZ2 3.87Å
399	N	94.5	Very high	94.3	Very high	66 Å²	66	59.8 Å²	59.8	35%	0.353	29%	0.294	S	S	.	.	H	α-helix	trans	-63.5	-26.7	176	-87.5	-63.9	0	0	0	114.1	V395 R396 L397 K407 W410	V395-N399 WeakPolarHBondContact O-CB 3.27Å; V395-N399 PolarHBondContact O-N 2.95Å; V395-N399 PolarHBondContact O-ND2 3.46Å; R396-N399 PolarHBondContact O-N 3.37Å; L397-N399 VanDerWaalsContact C-N 3.33Å; L397-N399 PolarHBondContact O-N 3.31Å; N399-K407 WeakPolarHBondContact OD1-CE 3.35Å; N399-K407 PolarHBondContact OD1-NZ 3.45Å; N399-W410 WeakPolarHBondContact ND2-CH2 3.4Å
400	Q	93.2	Very high	94.3	Very high	126 Å²	126	59.8 Å²	59.8	59%	0.589	29%	0.294	S	S	*	.	H	α-helix	trans	-85.5	-34.9	-180	-71.9	178.8	-9.6	0	0	112.7	R396 L397 L398	R396-Q400 VanDerWaalsContact NH1-NE2 3.12Å; R396-Q400 WeakPolarHBondContact O-CG 3.4Å; R396-Q400 PolarHBondContact O-N 2.95Å; L397-Q400 PolarHBondContact O-N 3.04Å; L398-Q400 PolarHBondContact O-N 3.3Å
401	V	93.8	Very high	94.1	Very high	40 Å²	40	63.8 Å²	63.8	24%	0.242	31%	0.314	C	S	.	.	H	α-helix	trans	-95.6	-34.5	-170.5	174.6	0	0	0	0	113.1	D360 V363 L397 L398	D360-V401 HydrophobicContact CB-CB 4.38Å; D360-V401 HydrophobicContact CB-CG1 3.6Å; D360-V401 HydrophobicContact CB-CG2 3.8Å; V363-V401 HydrophobicContact CB-CG1 4.24Å; V363-V401 HydrophobicContact CG1-CG1 4.12Å; L397-V401 HydrophobicContact CD1-CG2 3.8Å; L397-V401 HydrophobicContact CG-CG2 4.43Å; L397-V401 WeakPolarHBondContact O-CG2 3.38Å; L397-V401 PolarHBondContact O-N 2.91Å; L398-V401 PolarHBondContact O-N 3.06Å
402	L	94.7	Very high	94	Very high	16 Å²	16	67.9 Å²	67.9	8%	0.084	33%	0.334	C	S	.	.			trans	-73.2	133.9	-171.2	-63	176.7	0	0	0	112.8	V363 F367 L398 K406 K407 W410	V363-L402 HydrophobicContact CG1-CD2 3.56Å; V363-L402 HydrophobicContact CG1-CG 4.42Å; F367-L402 HydrophobicContact CD1-CD2 4.26Å; F367-L402 HydrophobicContact CD2-CD2 3.49Å; F367-L402 VanDerWaalsContact CD2-CD2 3.49Å; F367-L402 HydrophobicContact CE1-CD1 4.11Å; F367-L402 HydrophobicContact CE1-CD2 4.11Å; F367-L402 HydrophobicContact CE2-CD1 3.79Å; F367-L402 HydrophobicContact CE2-CD2 3.32Å; F367-L402 HydrophobicContact CE2-CG 4.16Å; F367-L402 HydrophobicContact CG-CD2 3.97Å; F367-L402 HydrophobicContact CZ-CD1 3.42Å; F367-L402 VanDerWaalsContact CZ-CD1 3.42Å; F367-L402 HydrophobicContact CZ-CD2 3.66Å; F367-L402 HydrophobicContact CZ-CG 4.19Å; L398-L402 HydrophobicContact CB-CD1 3.95Å; L398-L402 HydrophobicContact CB-CG 4.4Å; L398-L402 HydrophobicContact CD2-CD1 4.23Å; L398-L402 HydrophobicContact CD2-CG 4.41Å; L398-L402 WeakPolarHBondContact O-CB 3.38Å; L398-L402 WeakPolarHBondContact O-CG 3.43Å; L398-L402 PolarHBondContact O-N 3.39Å; L402-K406 HydrophobicContact CB-CB 4.3Å; L402-K406 HydrophobicContact CD2-CB 4.01Å; L402-K406 HydrophobicContact CD2-CD 4.25Å; L402-K407 HydrophobicContact CB-CB 4.35Å; L402-W410 HydrophobicContact CD1-CB 4.23Å; L402-W410 HydrophobicContact CD1-CD2 4.11Å; L402-W410 HydrophobicContact CD1-CE3 3.75Å; L402-W410 HydrophobicContact CD1-CG 4.32Å; L402-W410 HydrophobicContact CD1-CZ3 4.46Å
403	D	92.9	Very high	93.9	Very high	61 Å²	61	62.3 Å²	62.3	33%	0.326	31%	0.308	S	S	.	.			trans	-67.3	165.1	167.3	70.5	59.9	0	0	0	111.8	Q405 K406 K407	D403-Q405 VanDerWaalsContact C-N 3.28Å; D403-Q405 PolarHBondContact O-N 3Å; D403-Q405 WeakPolarHBondContact OD1-CA 3.48Å; D403-Q405 WeakPolarHBondContact OD1-CB 3.46Å; D403-Q405 PolarHBondContact OD1-N 3.23Å; D403-K406 PolarHBondContact O-N 3.12Å; D403-K406 PolarHBondContact OD1-N 3.28Å; D403-K406 VanDerWaalsContact OD2-CD 3.26Å; D403-K406 WeakPolarHBondContact OD2-CD 3.45Å; D403-K406 WeakPolarHBondContact OD2-CE 3.33Å; D403-K406 WeakPolarHBondContact OD2-CG 3.31Å; D403-K407 VanDerWaalsContact O-CB 3.24Å; D403-K407 WeakPolarHBondContact O-CB 3.27Å; D403-K407 PolarHBondContact O-N 2.93Å
404	P	94.4	Very high	93.8	Very high	111 Å²	111	58.2 Å²	58.2	72%	0.721	29%	0.294	S	S	*	.	H	α-helix	trans	-59	-31.8	-177.2	-26.7	36.1	0	0	0	115.1	Q408	P404-Q408 PolarHBondContact O-N 2.91Å; P404-Q408 VanDerWaalsContact O-N 3.12Å
405	Q	92.1	Very high	93.6	Very high	163 Å²	163	64.7 Å²	64.7	76%	0.762	32%	0.324	S	S	*	.	H	α-helix	trans	-73.4	-48.4	-179.6	-64.3	-171.5	-50.1	0	0	110.5	D403 K407 Q408 L409	D403-Q405 VanDerWaalsContact C-N 3.28Å; D403-Q405 PolarHBondContact O-N 3Å; D403-Q405 WeakPolarHBondContact OD1-CA 3.48Å; D403-Q405 WeakPolarHBondContact OD1-CB 3.46Å; D403-Q405 PolarHBondContact OD1-N 3.23Å; Q405-K407 VanDerWaalsContact C-N 3.3Å; Q405-K407 PolarHBondContact O-N 3.48Å; Q405-Q408 WeakPolarHBondContact O-CB 3.38Å; Q405-Q408 PolarHBondContact O-N 3.33Å; Q405-L409 PolarHBondContact O-N 3.41Å
406	K	93.7	Very high	93.4	Very high	21 Å²	21	63.9 Å²	63.9	9%	0.091	32%	0.319	C	S	.	.	H	α-helix	trans	-63.2	-36.5	175.2	-68.5	-178	-173	-171.4	0	112.2	D364 F367 E371 L402 D403 Q408 L409 W410	D364-K406 IonicContact OD1-NZ 2.65Å; D364-K406 PolarHBondContact OD1-NZ 3.3Å; F367-K406 HydrophobicContact CB-CD 3.8Å; F367-K406 HydrophobicContact CB-CG 4.35Å; F367-K406 HydrophobicContact CD1-CB 3.74Å; F367-K406 HydrophobicContact CD1-CD 4.17Å; F367-K406 HydrophobicContact CD1-CG 3.97Å; F367-K406 HydrophobicContact CE1-CB 4.04Å; F367-K406 WeakPolarHBondContact CE1-O 3.27Å; F367-K406 HydrophobicContact CG-CB 4.37Å; F367-K406 HydrophobicContact CG-CD 4.03Å; F367-K406 HydrophobicContact CG-CG 4.34Å; E371-K406 WeakPolarHBondContact OE1-CG 3.33Å; L402-K406 HydrophobicContact CB-CB 4.3Å; L402-K406 HydrophobicContact CD2-CB 4.01Å; L402-K406 HydrophobicContact CD2-CD 4.25Å; D403-K406 PolarHBondContact O-N 3.12Å; D403-K406 PolarHBondContact OD1-N 3.28Å; D403-K406 VanDerWaalsContact OD2-CD 3.26Å; D403-K406 WeakPolarHBondContact OD2-CD 3.45Å; D403-K406 WeakPolarHBondContact OD2-CE 3.33Å; D403-K406 WeakPolarHBondContact OD2-CG 3.31Å; K406-Q408 VanDerWaalsContact C-N 3.33Å; K406-Q408 PolarHBondContact O-N 3.05Å; K406-L409 WeakPolarHBondContact O-CB 3.45Å; K406-L409 PolarHBondContact O-N 3.21Å; K406-W410 WeakPolarHBondContact O-CB 3.26Å; K406-W410 PolarHBondContact O-N 2.77Å
407	K	94.3	Very high	93.4	Very high	72 Å²	72	57.8 Å²	57.8	31%	0.313	30%	0.296	S	S	.	.	H	α-helix	trans	-63.9	-38.8	175.2	-169.9	167.7	-169.5	162.1	0	112	N399 L402 D403 Q405 W410 M411	N399-K407 WeakPolarHBondContact OD1-CE 3.35Å; N399-K407 PolarHBondContact OD1-NZ 3.45Å; L402-K407 HydrophobicContact CB-CB 4.35Å; D403-K407 VanDerWaalsContact O-CB 3.24Å; D403-K407 WeakPolarHBondContact O-CB 3.27Å; D403-K407 PolarHBondContact O-N 2.93Å; Q405-K407 VanDerWaalsContact C-N 3.3Å; Q405-K407 PolarHBondContact O-N 3.48Å; K407-W410 HydrophobicContact CG-CE3 4.31Å; K407-W410 PolarHBondContact O-N 3.13Å; K407-M411 VanDerWaalsContact O-CG 3.25Å; K407-M411 WeakPolarHBondContact O-CG 3.39Å; K407-M411 PolarHBondContact O-N 3.36Å
408	Q	93.8	Very high	93.3	Very high	128 Å²	128	59 Å²	59	60%	0.598	31%	0.305	S	S	*	.	H	α-helix	trans	-65.9	-43.3	173.7	-173.4	-179.8	-17.8	0	0	111.4	P404 Q405 K406 W410 M411 N412	P404-Q408 PolarHBondContact O-N 2.91Å; P404-Q408 VanDerWaalsContact O-N 3.12Å; Q405-Q408 WeakPolarHBondContact O-CB 3.38Å; Q405-Q408 PolarHBondContact O-N 3.33Å; K406-Q408 VanDerWaalsContact C-N 3.33Å; K406-Q408 PolarHBondContact O-N 3.05Å; Q408-W410 VanDerWaalsContact C-N 3.34Å; Q408-W410 PolarHBondContact O-N 3.31Å; Q408-M411 PolarHBondContact O-N 3.36Å; Q408-N412 WeakPolarHBondContact O-CB 3.36Å; Q408-N412 PolarHBondContact O-N 3.4Å; Q408-N412 PolarHBondContact O-ND2 3.33Å; Q408-N412 PolarHBondContact O-OD1 3.07Å
409	L	93.8	Very high	93.2	Very high	39 Å²	39	61.1 Å²	61.1	20%	0.204	32%	0.316	C	S	.	.	H	α-helix	trans	-56.4	-50.1	174.3	-178.8	67	0	0	0	110.9	F367 E371 I374 Q405 K406 M411 N412 M413	F367-L409 HydrophobicContact CD1-CD2 4.28Å; E371-L409 HydrophobicContact CG-CD2 3.66Å; I374-L409 HydrophobicContact CD1-CD1 3.8Å; I374-L409 HydrophobicContact CD1-CD2 4.12Å; I374-L409 HydrophobicContact CD1-CG 4.06Å; I374-L409 HydrophobicContact CG2-CD1 4.43Å; Q405-L409 PolarHBondContact O-N 3.41Å; K406-L409 WeakPolarHBondContact O-CB 3.45Å; K406-L409 PolarHBondContact O-N 3.21Å; L409-M411 PolarHBondContact O-N 3Å; L409-N412 WeakPolarHBondContact O-CB 3.36Å; L409-N412 PolarHBondContact O-N 3.21Å; L409-N412 VanDerWaalsContact O-N 3.12Å; L409-M413 WeakPolarHBondContact O-CG 3.27Å; L409-M413 PolarHBondContact O-N 3.02Å
410	W	95.3	Very high	93.1	Very high	1 Å²	1	59 Å²	59	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-56.7	-46.6	178.5	176.2	36.8	0	0	0	112.8	F367 V395 L398 N399 L402 K406 K407 Q408 N412 M413 W417	F367-W410 HydrophobicContact CE1-CB 4.03Å; F367-W410 HydrophobicContact CZ-CB 3.92Å; F367-W410 HydrophobicContact CZ-CG 4.32Å; V395-W410 HydrophobicContact CG1-CH2 4.01Å; V395-W410 HydrophobicContact CG1-CZ2 4.26Å; L398-W410 HydrophobicContact CB-CE3 4.41Å; L398-W410 HydrophobicContact CB-CH2 3.9Å; L398-W410 HydrophobicContact CB-CZ2 4.13Å; L398-W410 HydrophobicContact CB-CZ3 4.05Å; L398-W410 HydrophobicContact CD1-CD2 4.42Å; L398-W410 HydrophobicContact CD1-CH2 4.48Å; L398-W410 HydrophobicContact CD1-CZ2 3.87Å; N399-W410 WeakPolarHBondContact ND2-CH2 3.4Å; L402-W410 HydrophobicContact CD1-CB 4.23Å; L402-W410 HydrophobicContact CD1-CD2 4.11Å; L402-W410 HydrophobicContact CD1-CE3 3.75Å; L402-W410 HydrophobicContact CD1-CG 4.32Å; L402-W410 HydrophobicContact CD1-CZ3 4.46Å; K406-W410 WeakPolarHBondContact O-CB 3.26Å; K406-W410 PolarHBondContact O-N 2.77Å; K407-W410 HydrophobicContact CG-CE3 4.31Å; K407-W410 PolarHBondContact O-N 3.13Å; Q408-W410 VanDerWaalsContact C-N 3.34Å; Q408-W410 PolarHBondContact O-N 3.31Å; W410-N412 VanDerWaalsContact C-N 3.27Å; W410-N412 PolarHBondContact O-N 3.16Å; W410-M413 WeakPolarHBondContact O-CB 3.37Å; W410-M413 PolarHBondContact O-N 2.98Å; W410-W417 PolarHBondContact NE1-O 3.28Å
411	M	92.8	Very high	92.9	Very high	85 Å²	85	58.1 Å²	58.1	42%	0.419	30%	0.297	S	S	.	.	H	α-helix	trans	-65.6	-31.1	178.3	-67.4	-65	169.7	0	0	112.6	K407 Q408 L409 M413	K407-M411 VanDerWaalsContact O-CG 3.25Å; K407-M411 WeakPolarHBondContact O-CG 3.39Å; K407-M411 PolarHBondContact O-N 3.36Å; Q408-M411 PolarHBondContact O-N 3.36Å; L409-M411 PolarHBondContact O-N 3Å; M411-M413 VanDerWaalsContact C-N 3.26Å; M411-M413 PolarHBondContact O-N 3.21Å
412	N	92.6	Very high	92.6	Very high	116 Å²	116	60 Å²	60	62%	0.62	31%	0.312	S	S	*	.	H	α-helix	trans	-73.9	-14.2	177.2	-69.2	-12.1	0	0	0	113.5	Q408 L409 W410 G414	Q408-N412 WeakPolarHBondContact O-CB 3.36Å; Q408-N412 PolarHBondContact O-N 3.4Å; Q408-N412 PolarHBondContact O-ND2 3.33Å; Q408-N412 PolarHBondContact O-OD1 3.07Å; L409-N412 WeakPolarHBondContact O-CB 3.36Å; L409-N412 PolarHBondContact O-N 3.21Å; L409-N412 VanDerWaalsContact O-N 3.12Å; W410-N412 VanDerWaalsContact C-N 3.27Å; W410-N412 PolarHBondContact O-N 3.16Å; N412-G414 PolarHBondContact O-N 3.49Å
413	M	91.4	Very high	92.4	Very high	5 Å²	5	63.1 Å²	63.1	3%	0.025	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-9.7	178.1	-60.3	-177.3	76.9	0	0	113.4	L337 L370 I374 P382 P383 L409 W410 M411 W417	L337-M413 HydrophobicContact CD2-CE 3.92Å; L370-M413 HydrophobicContact CD1-CE 4.46Å; L370-M413 HydrophobicContact CD1-SD 4.26Å; L370-M413 HydrophobicContact CD2-CE 3.96Å; I374-M413 HydrophobicContact CD1-CE 3.93Å; I374-M413 HydrophobicContact CD1-CG 4.32Å; I374-M413 HydrophobicContact CD1-SD 4.08Å; P382-M413 CarbonylContact C-O 3.18Å; P382-M413 VanDerWaalsContact C-O 3.31Å; P382-M413 HydrophobicContact CB-CB 4.23Å; P382-M413 HydrophobicContact CB-CE 4.15Å; P383-M413 VanDerWaalsContact CA-O 3.26Å; P383-M413 WeakPolarHBondContact CA-O 3.29Å; P383-M413 WeakPolarHBondContact CD-O 3.29Å; P383-M413 WeakPolarHBondContact CG-O 3.3Å; P383-M413 VanDerWaalsContact N-O 3.1Å; L409-M413 WeakPolarHBondContact O-CG 3.27Å; L409-M413 PolarHBondContact O-N 3.02Å; W410-M413 WeakPolarHBondContact O-CB 3.37Å; W410-M413 PolarHBondContact O-N 2.98Å; M411-M413 VanDerWaalsContact C-N 3.26Å; M411-M413 PolarHBondContact O-N 3.21Å; M413-W417 HydrophobicContact CB-CB 4.1Å; M413-W417 HydrophobicContact CB-CD2 3.95Å; M413-W417 HydrophobicContact CB-CG 3.63Å; M413-W417 HydrophobicContact CE-CD2 3.82Å; M413-W417 HydrophobicContact CE-CE3 3.83Å; M413-W417 HydrophobicContact CE-CH2 3.38Å; M413-W417 HydrophobicContact CE-CZ2 3.36Å; M413-W417 HydrophobicContact CE-CZ3 3.62Å; M413-W417 VanDerWaalsContact O-CD1 3.24Å; M413-W417 HydrophobicContact SD-CD2 4Å; M413-W417 HydrophobicContact SD-CE3 3.83Å; M413-W417 HydrophobicContact SD-CH2 4.41Å; M413-W417 HydrophobicContact SD-CZ3 4.04Å
414	G	91.5	Very high	92.2	Very high	17 Å²	17	62.9 Å²	62.9	18%	0.175	33%	0.33	C	S	.	.			trans	107.1	168.3	175.8	0	0	0	0	0	114.1	N412 C416 W417	N412-G414 PolarHBondContact O-N 3.49Å; G414-C416 PolarHBondContact O-N 3.2Å; G414-W417 WeakPolarHBondContact O-CB 3.43Å; G414-W417 PolarHBondContact O-N 2.87Å
415	E	91.1	Very high	91.6	Very high	135 Å²	135	62.9 Å²	62.9	63%	0.631	33%	0.33	S	S	*	.	H	α-helix	trans	-60.3	-32.8	-173.4	-65.3	-176.2	168.3	0	0	113.2	W417 S418 I419 W424	E415-W417 PolarHBondContact O-N 3.26Å; E415-W417 VanDerWaalsContact O-N 3.07Å; E415-S418 PolarHBondContact O-N 2.74Å; E415-S418 PolarHBondContact O-OG 3.17Å; E415-I419 HydrophobicContact CB-CD1 3.89Å; E415-I419 HydrophobicContact CB-CG1 4.36Å; E415-I419 HydrophobicContact CG-CD1 4.39Å; E415-I419 WeakPolarHBondContact O-CB 3.41Å; E415-I419 PolarHBondContact O-N 3.1Å; E415-W424 HydrophobicContact CB-CH2 4.26Å; E415-W424 HydrophobicContact CB-CZ3 4Å
416	C	91.9	Very high	91.1	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.014	32%	0.319	C	S	.	.	H	α-helix	trans	-67.9	-6.7	179.4	67.2	0	0	0	0	113.9	K341 P383 V385 T386 L389 G414 W424	K341-C416 VanDerWaalsContact CE-O 3.31Å; K341-C416 WeakPolarHBondContact CE-O 3.39Å; K341-C416 PolarHBondContact NZ-O 3.06Å; P383-C416 PolarHBondContact O-SG 3.45Å; V385-C416 PolarHBondContact O-SG 3.42Å; T386-C416 HydrophobicContact CG2-CB 4.28Å; L389-C416 HydrophobicContact CD2-CB 4.27Å; G414-C416 PolarHBondContact O-N 3.2Å; C416-W424 VanDerWaalsContact CA-CZ3 3.47Å; C416-W424 HydrophobicContact CB-CH2 3.65Å; C416-W424 HydrophobicContact CB-CZ2 4.25Å; C416-W424 HydrophobicContact CB-CZ3 4.01Å
417	W	94.7	Very high	90.5	Very high	1 Å²	1	64.3 Å²	64.3	0%	0.004	36%	0.356	C	S	.	.	H	α-helix	trans	-101	-19.7	172.8	-69.6	79.9	0	0	0	113.3	L337 I340 K341 F344 P382 L390 W410 M413 G414 E415	L337-W417 HydrophobicContact CB-CH2 4.18Å; L337-W417 HydrophobicContact CB-CZ2 3.97Å; L337-W417 HydrophobicContact CD1-CZ2 4.45Å; L337-W417 HydrophobicContact CD2-CH2 3.91Å; L337-W417 HydrophobicContact CD2-CZ2 3.94Å; L337-W417 HydrophobicContact CG-CZ2 4.34Å; I340-W417 HydrophobicContact CG2-CH2 4.42Å; I340-W417 HydrophobicContact CG2-CZ3 4.2Å; K341-W417 HydrophobicContact CD-CD2 4.19Å; K341-W417 HydrophobicContact CD-CE3 4.38Å; K341-W417 HydrophobicContact CD-CH2 4Å; K341-W417 HydrophobicContact CD-CZ2 3.77Å; K341-W417 HydrophobicContact CD-CZ3 4.3Å; K341-W417 HydrophobicContact CG-CD2 4.18Å; K341-W417 HydrophobicContact CG-CE3 3.86Å; K341-W417 HydrophobicContact CG-CH2 3.41Å; K341-W417 VanDerWaalsContact CG-CH2 3.41Å; K341-W417 HydrophobicContact CG-CZ2 3.75Å; K341-W417 HydrophobicContact CG-CZ3 3.48Å; K341-W417 VanDerWaalsContact CG-CZ3 3.48Å; F344-W417 HydrophobicContact CE2-CZ3 4.35Å; P382-W417 PolarHBondContact O-NE1 2.89Å; L390-W417 WeakPolarHBondContact CD1-O 3.49Å; W410-W417 PolarHBondContact NE1-O 3.28Å; M413-W417 HydrophobicContact CB-CB 4.1Å; M413-W417 HydrophobicContact CB-CD2 3.95Å; M413-W417 HydrophobicContact CB-CG 3.63Å; M413-W417 HydrophobicContact CE-CD2 3.82Å; M413-W417 HydrophobicContact CE-CE3 3.83Å; M413-W417 HydrophobicContact CE-CH2 3.38Å; M413-W417 HydrophobicContact CE-CZ2 3.36Å; M413-W417 HydrophobicContact CE-CZ3 3.62Å; M413-W417 VanDerWaalsContact O-CD1 3.24Å; M413-W417 HydrophobicContact SD-CD2 4Å; M413-W417 HydrophobicContact SD-CE3 3.83Å; M413-W417 HydrophobicContact SD-CH2 4.41Å; M413-W417 HydrophobicContact SD-CZ3 4.04Å; G414-W417 WeakPolarHBondContact O-CB 3.43Å; G414-W417 PolarHBondContact O-N 2.87Å; E415-W417 PolarHBondContact O-N 3.26Å; E415-W417 VanDerWaalsContact O-N 3.07Å
418	S	92.3	Very high	90	Very high	33 Å²	33	61.6 Å²	61.6	23%	0.231	35%	0.346	C	S	.	.	H	α-helix	trans	-112.7	-29.1	-173.7	59	0	0	0	0	113.7	E415	E415-S418 PolarHBondContact O-N 2.74Å; E415-S418 PolarHBondContact O-OG 3.17Å
419	I	92.2	Very high	89.3	Confident	46 Å²	46	61.8 Å²	61.8	24%	0.236	35%	0.35	C	S	.	.	S	Bend	trans	-85.1	120.4	176	-58.6	-180	0	0	0	108.7	E415 W424	E415-I419 HydrophobicContact CB-CD1 3.89Å; E415-I419 HydrophobicContact CB-CG1 4.36Å; E415-I419 HydrophobicContact CG-CD1 4.39Å; E415-I419 WeakPolarHBondContact O-CB 3.41Å; E415-I419 PolarHBondContact O-N 3.1Å; I419-W424 HydrophobicContact CB-CE3 3.78Å; I419-W424 HydrophobicContact CB-CZ3 4.07Å; I419-W424 HydrophobicContact CD1-CE3 4.34Å; I419-W424 HydrophobicContact CD1-CZ3 4.12Å; I419-W424 HydrophobicContact CG2-CE3 3.85Å
420	P	93.1	Very high	88.8	Confident	20 Å²	20	64.9 Å²	64.9	13%	0.13	37%	0.373	C	S	.	.			trans	-69.4	157.9	179.7	29.4	-34.6	0	0	0	111.4	L390 E392 V395 S422 S423 W424	L390-P420 CarbonylContact O-C 3.55Å; L390-P420 VanDerWaalsContact O-CA 3.28Å; L390-P420 WeakPolarHBondContact O-CA 3.49Å; E392-P420 HydrophobicContact CB-CB 4.34Å; V395-P420 HydrophobicContact CG2-CB 4.07Å; P420-S422 PolarHBondContact O-N 3.28Å; P420-S422 VanDerWaalsContact O-N 3.1Å; P420-S423 PolarHBondContact O-N 2.92Å; P420-W424 PolarHBondContact O-N 3.27Å
421	R	89.1	Confident	88.5	Confident	108 Å²	108	66.5 Å²	66.5	41%	0.408	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-50.4	-37.4	178.8	-178.5	-179.1	-84.3	-104.8	-0.6	113.1	L389 L390 S423	L389-R421 HydrophobicContact CB-CB 3.87Å; L389-R421 HydrophobicContact CB-CG 4.4Å; L389-R421 HydrophobicContact CD1-CB 4.37Å; L389-R421 HydrophobicContact CD1-CG 4.38Å; L390-R421 PolarHBondContact O-N 3Å; R421-S423 PolarHBondContact O-N 3.45Å
422	S	88.1	Confident	88.3	Confident	81 Å²	81	68.6 Å²	68.6	57%	0.566	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-65.8	-22.1	179.7	54.6	0	0	0	0	114.2	E392 P420	E392-S422 PolarHBondContact OE2-OG 3.23Å; P420-S422 PolarHBondContact O-N 3.28Å; P420-S422 VanDerWaalsContact O-N 3.1Å
423	S	88.9	Confident	88.1	Confident	81 Å²	81	63.3 Å²	63.3	57%	0.566	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-116.8	6.8	-174.7	-57.8	0	0	0	0	113.2	P420 R421	P420-S423 PolarHBondContact O-N 2.92Å; R421-S423 PolarHBondContact O-N 3.45Å
424	W	89.3	Confident	88	Confident	56 Å²	56	70.6 Å²	70.6	21%	0.212	40%	0.397	C	S	.	.			trans	-79.1	130.2	-177.4	-172.9	-99.8	0	0	0	111.7	T386 L389 E415 C416 I419 P420 G426	T386-W424 HydrophobicContact CG2-CZ2 4.41Å; L389-W424 HydrophobicContact CD1-CB 3.53Å; L389-W424 HydrophobicContact CD1-CD2 4.03Å; L389-W424 HydrophobicContact CD1-CG 3.42Å; L389-W424 VanDerWaalsContact CD1-CG 3.42Å; L389-W424 HydrophobicContact CD2-CD2 3.87Å; L389-W424 HydrophobicContact CD2-CE3 4.02Å; L389-W424 HydrophobicContact CD2-CG 4.18Å; L389-W424 HydrophobicContact CG-CG 4.45Å; E415-W424 HydrophobicContact CB-CH2 4.26Å; E415-W424 HydrophobicContact CB-CZ3 4Å; C416-W424 VanDerWaalsContact CA-CZ3 3.47Å; C416-W424 HydrophobicContact CB-CH2 3.65Å; C416-W424 HydrophobicContact CB-CZ2 4.25Å; C416-W424 HydrophobicContact CB-CZ3 4.01Å; I419-W424 HydrophobicContact CB-CE3 3.78Å; I419-W424 HydrophobicContact CB-CZ3 4.07Å; I419-W424 HydrophobicContact CD1-CE3 4.34Å; I419-W424 HydrophobicContact CD1-CZ3 4.12Å; I419-W424 HydrophobicContact CG2-CE3 3.85Å; P420-W424 PolarHBondContact O-N 3.27Å; W424-G426 PolarHBondContact O-N 2.79Å
425	P	82.4	Confident	88	Confident	111 Å²	111	70.4 Å²	70.4	72%	0.721	39%	0.391	S	S	*	.	S	Bend	trans	-79.6	83.7	177.3	32.3	-33.3	0	0	0	110.3
426	G	80.4	Confident	87.7	Confident	52 Å²	52	67.9 Å²	67.9	54%	0.536	38%	0.377	S	S	.	.	S	Bend	trans	149.2	159.8	173.5	0	0	0	0	0	113.3	W424	W424-G426 PolarHBondContact O-N 2.79Å
427	D	80.9	Confident	87.2	Confident	162 Å²	162	72.2 Å²	72.2	87%	0.866	40%	0.4	S	S	*	.			trans	-82.3	140.5	172.4	-163.6	14.1	0	0	0	110.2
428	V	85.6	Confident	86.6	Confident	15 Å²	15	74.9 Å²	74.9	9%	0.091	43%	0.427	C	S	.	.			trans	-134.3	121.2	-177.6	179.5	0	0	0	0	109	L389	L389-V428 HydrophobicContact CD1-CB 4.17Å; L389-V428 HydrophobicContact CD1-CG2 3.68Å; L389-V428 HydrophobicContact CG-CG2 4.26Å
429	D	77.9	Confident	86.5	Confident	131 Å²	131	76.6 Å²	76.6	70%	0.701	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-52.5	140.1	-179.6	-70.7	-42.4	0	0	0	111.9	S387 Y431	S387-D429 PolarHBondContact OG-O 2.95Å; D429-Y431 PolarHBondContact O-N 2.83Å
430	P	82.5	Confident	85.9	Confident	105 Å²	105	82 Å²	82	68%	0.682	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-54.4	128.5	173.3	-24.7	33.8	0	0	0	111.1
431	Y	90.4	Very high	85.5	Confident	34 Å²	34	82.1 Å²	82.1	13%	0.133	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-77.4	128.2	174.9	178.4	-115.7	0	0	0	109.9	Q338 Y342 P388 D429 P433	Q338-Y431 HydrophobicContact CB-CD2 4.41Å; Q338-Y431 HydrophobicContact CB-CE2 3.62Å; Q338-Y431 HydrophobicContact CG-CE2 4.25Å; Y342-Y431 HydrophobicContact CD1-CD1 4.05Å; Y342-Y431 AromaticContact CD1-CE1 3.87Å; Y342-Y431 HydrophobicContact CD1-CE1 3.87Å; Y342-Y431 HydrophobicContact CD2-CD1 4.05Å; Y342-Y431 AromaticContact CG-CD1 3.74Å; Y342-Y431 HydrophobicContact CG-CD1 3.74Å; Y342-Y431 AromaticContact CG-CE1 3.82Å; Y342-Y431 HydrophobicContact CG-CE1 3.82Å; P388-Y431 HydrophobicContact CB-CD1 4.24Å; P388-Y431 HydrophobicContact CB-CG 4.11Å; P388-Y431 HydrophobicContact CG-CD1 3.65Å; P388-Y431 HydrophobicContact CG-CE1 4.29Å; P388-Y431 HydrophobicContact CG-CG 3.82Å; D429-Y431 PolarHBondContact O-N 2.83Å; Y431-P433 HydrophobicContact CE1-CB 3.81Å
432	I	87	Confident	84.8	Confident	129 Å²	129	80.5 Å²	80.5	66%	0.662	46%	0.458	S	S	*	.			trans	-116.3	113.9	172	-57.8	174.3	0	0	0	106.2
433	P	89.4	Confident	84	Confident	5 Å²	5	80.6 Å²	80.6	3%	0.032	46%	0.463	C	S	.	.			trans	-70.9	137.5	-179	30.5	-36.4	0	0	0	111.2	Y342 Y431 F435 P441	Y342-P433 HydrophobicContact CD1-CB 4.37Å; Y342-P433 HydrophobicContact CD1-CG 4.21Å; Y342-P433 HydrophobicContact CE1-CB 4.49Å; Y342-P433 HydrophobicContact CE1-CG 3.84Å; Y431-P433 HydrophobicContact CE1-CB 3.81Å; P433-F435 HydrophobicContact CB-CD2 4.4Å; P433-F435 HydrophobicContact CB-CE1 4.38Å; P433-F435 HydrophobicContact CB-CE2 3.66Å; P433-F435 HydrophobicContact CB-CZ 3.66Å; P433-F435 HydrophobicContact CG-CE2 3.63Å; P433-F435 HydrophobicContact CG-CZ 3.85Å; P433-P441 HydrophobicContact CG-CG 3.85Å
434	E	88.8	Confident	83	Confident	158 Å²	158	80.5 Å²	80.5	74%	0.738	46%	0.461	S	S	*	.			trans	-110.4	122.7	169.3	-65.1	-179.2	173.2	0	0	108.6	K339	K339-E434 WeakPolarHBondContact CE-O 3.46Å; K339-E434 PolarHBondContact NZ-O 2.93Å
435	F	92	Very high	81.7	Confident	14 Å²	14	82.4 Å²	82.4	6%	0.061	48%	0.475	C	S	.	.			trans	-102.7	152.8	-174.5	-63.6	-80.5	0	0	0	112.3	I279 H282 I283 D286 P433 D437 G438 W439	I279-F435 HydrophobicContact CG2-CZ 4.33Å; H282-F435 VanDerWaalsContact C-CE1 3.49Å; H282-F435 HydrophobicContact CB-CD1 3.73Å; H282-F435 HydrophobicContact CB-CD2 4.49Å; H282-F435 HydrophobicContact CB-CE1 3.57Å; H282-F435 HydrophobicContact CB-CE2 4.33Å; H282-F435 HydrophobicContact CB-CG 4.19Å; H282-F435 HydrophobicContact CB-CZ 3.86Å; I283-F435 HydrophobicContact CB-CE1 4.42Å; I283-F435 HydrophobicContact CG1-CE1 3.72Å; I283-F435 HydrophobicContact CG1-CZ 3.97Å; D286-F435 HydrophobicContact CB-CD1 4.41Å; D286-F435 WeakPolarHBondContact OD2-CA 3.17Å; P433-F435 HydrophobicContact CB-CD2 4.4Å; P433-F435 HydrophobicContact CB-CE1 4.38Å; P433-F435 HydrophobicContact CB-CE2 3.66Å; P433-F435 HydrophobicContact CB-CZ 3.66Å; P433-F435 HydrophobicContact CG-CE2 3.63Å; P433-F435 HydrophobicContact CG-CZ 3.85Å; F435-D437 WeakPolarHBondContact CB-OD1 3.26Å; F435-D437 PolarHBondContact O-N 2.94Å; F435-G438 PolarHBondContact O-N 2.91Å; F435-W439 AromaticContact CD2-CE3 3.61Å; F435-W439 HydrophobicContact CD2-CE3 3.61Å; F435-W439 HydrophobicContact CD2-CZ3 4.19Å; F435-W439 WeakPolarHBondContact CD2-O 3.32Å; F435-W439 AromaticContact CE2-CE3 3.53Å; F435-W439 HydrophobicContact CE2-CE3 3.53Å; F435-W439 AromaticContact CE2-CZ3 3.62Å; F435-W439 HydrophobicContact CE2-CZ3 3.62Å; F435-W439 HydrophobicContact CG-CE3 4.44Å; F435-W439 HydrophobicContact CZ-CE3 4.35Å; F435-W439 HydrophobicContact CZ-CZ3 4.2Å
436	Y	84.4	Confident	80.4	Confident	82 Å²	82	82.5 Å²	82.5	32%	0.322	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-28	-178	-73.2	-57.6	0	0	0	113.6	D286 I289 E332 G438	D286-Y436 HydrophobicContact CB-CD2 4.04Å; D286-Y436 HydrophobicContact CB-CE2 4.29Å; D286-Y436 VanDerWaalsContact OD1-CD2 3.28Å; D286-Y436 WeakPolarHBondContact OD1-CD2 3.4Å; D286-Y436 PolarHBondContact OD1-N 3.35Å; D286-Y436 VanDerWaalsContact OD1-N 3.17Å; D286-Y436 WeakPolarHBondContact OD2-CD2 3.26Å; D286-Y436 PolarHBondContact OD2-N 2.97Å; D286-Y436 VanDerWaalsContact OD2-N 3.12Å; I289-Y436 HydrophobicContact CB-CD2 4.11Å; I289-Y436 HydrophobicContact CB-CE2 4.23Å; I289-Y436 HydrophobicContact CD1-CD2 4.15Å; I289-Y436 HydrophobicContact CG2-CD2 3.81Å; I289-Y436 HydrophobicContact CG2-CE2 3.88Å; E332-Y436 PolarHBondContact OE2-OH 3.34Å; Y436-G438 VanDerWaalsContact C-N 3.25Å
437	D	82.3	Confident	78.2	Confident	92 Å²	92	85.1 Å²	85.1	49%	0.492	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-4	176.9	61.3	3.3	0	0	0	113.4	H282 F435 W439	H282-D437 IonicContact CE1-OD2 3.23Å; H282-D437 PolarHBondContact CE1-OD2 2.98Å; H282-D437 VanDerWaalsContact CE1-OD2 3.28Å; H282-D437 IonicContact ND1-OD2 2.74Å; H282-D437 PolarHBondContact ND1-OD2 3.29Å; F435-D437 WeakPolarHBondContact CB-OD1 3.26Å; F435-D437 PolarHBondContact O-N 2.94Å; D437-W439 PolarHBondContact O-N 3.22Å; D437-W439 WeakPolarHBondContact OD1-CB 3.24Å; D437-W439 PolarHBondContact OD1-N 3.4Å
438	G	81.5	Confident	76	Confident	57 Å²	57	82.8 Å²	82.8	59%	0.588	47%	0.469	S	S	*	.			trans	73.9	7.4	-175.5	0	0	0	0	0	114	F435 Y436	F435-G438 PolarHBondContact O-N 2.91Å; Y436-G438 VanDerWaalsContact C-N 3.25Å
439	W	89.5	Confident	73.7	Confident	70 Å²	70	87.8 Å²	87.8	27%	0.265	50%	0.502	S	S	.	.			trans	-63.3	144	173.5	-174.7	86.1	0	0	0	110.1	I279 H282 F435 D437 P441	I279-W439 HydrophobicContact CB-CH2 4.42Å; I279-W439 HydrophobicContact CG1-CH2 3.69Å; I279-W439 HydrophobicContact CG1-CZ3 4.04Å; H282-W439 HydrophobicContact CB-CE3 4.07Å; H282-W439 HydrophobicContact CB-CZ3 4.21Å; H282-W439 AromaticContact CD2-CD2 3.58Å; H282-W439 AromaticContact CD2-CE2 3.75Å; H282-W439 AromaticContact CD2-CE3 3.53Å; H282-W439 AromaticContact CD2-CH2 3.83Å; H282-W439 AromaticContact CD2-CZ2 3.89Å; H282-W439 AromaticContact CD2-CZ3 3.67Å; H282-W439 AromaticContact CE1-CD1 3.86Å; H282-W439 AromaticContact CE1-CD2 3.76Å; H282-W439 AromaticContact CE1-CG 3.57Å; H282-W439 AromaticContact CG-CD2 3.94Å; H282-W439 AromaticContact CG-CE3 3.66Å; H282-W439 AromaticContact NE2-CD1 3.81Å; H282-W439 AromaticContact NE2-CD2 3.48Å; H282-W439 AromaticContact NE2-CE2 3.5Å; H282-W439 AromaticContact NE2-CE3 3.96Å; H282-W439 AromaticContact NE2-CG 3.71Å; H282-W439 AromaticContact NE2-CZ2 3.99Å; H282-W439 AromaticContact NE2-NE1 3.69Å; F435-W439 AromaticContact CD2-CE3 3.61Å; F435-W439 HydrophobicContact CD2-CE3 3.61Å; F435-W439 HydrophobicContact CD2-CZ3 4.19Å; F435-W439 WeakPolarHBondContact CD2-O 3.32Å; F435-W439 AromaticContact CE2-CE3 3.53Å; F435-W439 HydrophobicContact CE2-CE3 3.53Å; F435-W439 AromaticContact CE2-CZ3 3.62Å; F435-W439 HydrophobicContact CE2-CZ3 3.62Å; F435-W439 HydrophobicContact CG-CE3 4.44Å; F435-W439 HydrophobicContact CZ-CE3 4.35Å; F435-W439 HydrophobicContact CZ-CZ3 4.2Å; D437-W439 PolarHBondContact O-N 3.22Å; D437-W439 WeakPolarHBondContact OD1-CB 3.24Å; D437-W439 PolarHBondContact OD1-N 3.4Å; W439-P441 HydrophobicContact CH2-CB 4.19Å; W439-P441 HydrophobicContact CZ3-CB 4.05Å
440	Q	81.3	Confident	71.6	Confident	158 Å²	158	88.8 Å²	88.8	74%	0.738	51%	0.507	S	S	*	.			trans	-123.2	135.3	176.6	-67	-170.6	5.4	0	0	109.6
441	P	83.3	Confident	69.6	Low	24 Å²	24	89.5 Å²	89.5	16%	0.156	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-62.2	142.5	177	29.1	-35.4	0	0	0	109.4	I279 P433 W439	I279-P441 HydrophobicContact CD1-CB 3.79Å; I279-P441 HydrophobicContact CG1-CB 3.88Å; P433-P441 HydrophobicContact CG-CG 3.85Å; W439-P441 HydrophobicContact CH2-CB 4.19Å; W439-P441 HydrophobicContact CZ3-CB 4.05Å
442	P	75.1	Confident	67.3	Low	74 Å²	74	96.3 Å²	96.3	48%	0.481	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-54.8	168.2	172.3	-22	28.7	0	0	0	111.8	R275	R275-P442 VanDerWaalsContact NH1-CA 3.34Å; R275-P442 VanDerWaalsContact NH1-CB 3.31Å; R275-P442 VanDerWaalsContact NH1-CD 3.3Å; R275-P442 PolarHBondContact NH1-O 2.78Å; R275-P442 PolarHBondContact NH2-O 3.36Å
443	A	71.9	Confident	64.7	Low	83 Å²	83	101.7 Å²	101.7	69%	0.686	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-67.1	139.3	169.9	0	0	0	0	0	109.6	L445	A443-L445 PolarHBondContact O-N 3Å
444	P	67.3	Low	62	Low	79 Å²	79	109.8 Å²	109.8	51%	0.513	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-54.2	138.6	170.4	-22.1	31.6	0	0	0	110.5	H446	P444-H446 WeakPolarHBondContact CB-O 3.31Å; P444-H446 PolarHBondContact O-N 2.92Å
445	L	60.8	Low	59.2	Low	96 Å²	96	108.2 Å²	108.2	50%	0.503	60%	0.597	S	S	.	*	S	Bend	trans	-71	-10.2	179.2	-65.1	168.6	0	0	0	112.1	A271 A443	A271-L445 HydrophobicContact CB-CD1 3.89Å; A443-L445 PolarHBondContact O-N 3Å
446	H	56.9	Low	56.6	Low	112 Å²	112	113.2 Å²	113.2	52%	0.519	63%	0.63	S	S	.	*	S	Bend	trans	-133.5	143.3	171.2	-66.5	-52.8	0	0	0	113.3	M268 P444	M268-H446 WeakPolarHBondContact CE-NE2 2.91Å; M268-H446 PolarHBondContact SD-CE1 3.29Å; M268-H446 PolarHBondContact SD-NE2 3.25Å; P444-H446 WeakPolarHBondContact CB-O 3.31Å; P444-H446 PolarHBondContact O-N 2.92Å
447	S	33.9	Very low	54	Low	107 Å²	107	116.1 Å²	116.1	75%	0.748	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-70.6	136	153	43.1	0	0	0	0	109.4
448	P	34.3	Very low	51.3	Low	114 Å²	114	119 Å²	119	74%	0.74	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-58.6	140	-179.2	22.7	-31.4	0	0	0	110.9	D450	P448-D450 PolarHBondContact O-N 3.38Å
449	P	36.9	Very low	48.9	Very low	120 Å²	120	127.5 Å²	127.5	78%	0.779	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-62.6	130.1	169.4	25.1	-30.2	0	0	0	109.1
450	D	33.9	Very low	45.9	Very low	152 Å²	152	131.1 Å²	131.1	81%	0.813	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-50.5	124.2	175.1	-147.9	-12.4	0	0	0	109.7	P448 Q452	P448-D450 PolarHBondContact O-N 3.38Å; D450-Q452 PolarHBondContact O-N 3.12Å
451	P	40.3	Very low	43.2	Very low	120 Å²	120	130.6 Å²	130.6	78%	0.779	71%	0.713	S	S	*	*	S	Bend	trans	-81	73.5	-175.3	32.8	-32.9	0	0	0	109.7
452	Q	41.4	Very low	40.7	Very low	177 Å²	177	134.7 Å²	134.7	83%	0.827	74%	0.742	S	S	*	*			trans	-162.9	91.8	161.1	-110.5	177	12.2	0	0	111.6	D450	D450-Q452 PolarHBondContact O-N 3.12Å
453	R	33.6	Very low	38.4	Very low	241 Å²	241	138.9 Å²	138.9	91%	0.909	76%	0.755	S	S	*	*			trans	173.4	82.6	132.6	-96.2	172.9	-177.3	-128.9	2.7	111.6
454	N	31.7	Very low	36.3	Very low	175 Å²	175	145.2 Å²	145.2	94%	0.936	76%	0.761	S	S	*	*			trans	-89.5	98.5	142.6	-92.5	-17.9	0	0	0	107.5
455	N	29.9	Very low	34.4	Very low	126 Å²	126	151.3 Å²	151.3	67%	0.674	78%	0.78	S	S	*	*			trans	-154.8	126.5	145	-141.1	31.7	0	0	0	109.9	L457	N455-L457 HydrophobicContact CB-CD1 4.46Å; N455-L457 PolarHBondContact O-N 3.43Å
456	P	39.2	Very low	33.1	Very low	119 Å²	119	152.1 Å²	152.1	77%	0.773	79%	0.791	S	S	*	*			trans	-80.9	114.9	177.9	32	-28.2	0	0	0	108.5
457	L	28	Very low	32.1	Very low	143 Å²	143	153.1 Å²	153.1	75%	0.749	81%	0.808	S	S	*	*			trans	-126.7	97.1	164.7	-89.8	106.7	0	0	0	110.7	N455	N455-L457 HydrophobicContact CB-CD1 4.46Å; N455-L457 PolarHBondContact O-N 3.43Å
458	N	26.3	Very low	31.8	Very low	153 Å²	153	151.4 Å²	151.4	82%	0.818	81%	0.807	S	S	*	*				43.2	104.9	126	-122.1	4.4	0	0	0	116.7	N460	N458-N460 PolarHBondContact O-N 3.02Å; N458-N460 VanDerWaalsContact O-N 3.12Å
459	R	31.4	Very low	31.8	Very low	234 Å²	234	152.4 Å²	152.4	88%	0.883	81%	0.813	S	S	*	*			trans	-47.1	114.9	145	-89.6	179.3	178.3	168.4	0.1	108.4
460	N	25.8	Very low	31.4	Very low	147 Å²	147	155 Å²	155	79%	0.786	82%	0.817	S	S	*	*			trans	164.8	98.6	136	-86.2	-4.3	0	0	0	109.5	N458	N458-N460 PolarHBondContact O-N 3.02Å; N458-N460 VanDerWaalsContact O-N 3.12Å
461	T	25.4	Very low	31.1	Very low	146 Å²	146	155.7 Å²	155.7	90%	0.896	82%	0.821	S	S	*	*			trans	-163.2	95.2	131.1	-11.1	0	0	0	0	110.4
462	S	29.7	Very low	30.6	Very low	110 Å²	110	156.2 Å²	156.2	77%	0.769	82%	0.817	S	S	*	*			trans	-63.7	133.4	143.8	-40.6	0	0	0	0	107.2
463	Q	28.7	Very low	29.9	Very low	162 Å²	162	153.5 Å²	153.5	76%	0.757	81%	0.808	S	S	*	*			trans	156.1	112.8	137.9	-74.6	-112.1	10.2	0	0	111.8
464	R	26.9	Very low	29.7	Very low	217 Å²	217	152 Å²	152	82%	0.819	80%	0.802	S	S	*	*				77.5	101.6	123.9	-152.1	173.3	-150.8	-178.1	4.4	118.9
465	F	28.4	Very low	29.5	Very low	206 Å²	206	150.4 Å²	150.4	90%	0.904	79%	0.794	S	S	*	*			trans	-76.7	140.7	154.9	-71	-87.8	0	0	0	111.1
466	P	32	Very low	29.4	Very low	114 Å²	114	155 Å²	155	74%	0.74	80%	0.804	S	S	*	*			trans	-105.5	154	152.4	32.2	-21.8	0	0	0	112.2
467	P	35.4	Very low	29	Very low	133 Å²	133	154.4 Å²	154.4	86%	0.864	80%	0.802	S	S	*	*			trans	-92.5	152.2	-165.4	36.7	-33.3	0	0	0	113.1
468	G	28.6	Very low	29.9	Very low	71 Å²	71	153.2 Å²	153.2	73%	0.732	80%	0.803	S	S	*	*			trans	-111.2	143.1	170.1	0	0	0	0	0	111.4
469	P	34.5	Very low	29.8	Very low	134 Å²	134	157.1 Å²	157.1	87%	0.87	81%	0.806	S	S	*	*			trans	-86.6	148.3	-154.4	33.7	-34.8	0	0	0	114.7
470	M	27.3	Very low	29.6	Very low	175 Å²	175	149.8 Å²	149.8	86%	0.862	80%	0.796	S	S	*	*			trans	-76	133.9	170.1	-147.2	173.3	169.9	0	0	109.3
471	N	28.9	Very low	29.6	Very low	167 Å²	167	149.2 Å²	149.2	89%	0.893	80%	0.798	S	S	*	*			trans	-143.7	129.7	151.6	-123.1	-2.9	0	0	0	111.5
472	N	29.2	Very low	29.9	Very low	130 Å²	130	149.5 Å²	149.5	70%	0.695	79%	0.792	S	S	*	*			trans	-58.1	145.2	-178.9	-106	-12.8	0	0	0	113.1
473	D	27.5	Very low	29.7	Very low	121 Å²	121	153.5 Å²	153.5	65%	0.647	80%	0.798	S	S	*	*				177.8	130.4	106.2	-99.5	-38.7	0	0	0	114.1
474	R	29.1	Very low	29.6	Very low	208 Å²	208	157 Å²	157	79%	0.785	81%	0.805	S	S	*	*			trans	74.4	107.8	134.4	-67.6	168.6	-172.1	-158.2	-5	122.7
475	N	27.8	Very low	29.5	Very low	142 Å²	142	152.4 Å²	152.4	76%	0.759	81%	0.806	S	S	*	*				62	142.5	117.7	-73.4	-1.4	0	0	0	123.7
476	Y	28.4	Very low	29.3	Very low	224 Å²	224	151.3 Å²	151.3	88%	0.878	80%	0.804	S	S	*	*			trans	89.8	111.9	157.6	-82.4	-85.1	0	0	0	119.7
477	S	28.8	Very low	30.1	Very low	105 Å²	105	150.8 Å²	150.8	73%	0.734	80%	0.801	S	S	*	*			trans	-85.3	172.4	138.4	-65.9	0	0	0	0	108.8
478	P	47.7	Very low	29.7	Very low	118 Å²	118	156.1 Å²	156.1	77%	0.766	80%	0.804	S	S	*	*			cis	-143.7	-178.3	7.5	39.7	-18.5	0	0	0	116.4
479	R	24.6	Very low	29.6	Very low	236 Å²	236	157.1 Å²	157.1	89%	0.891	80%	0.799	S	S	*	*			trans	85.1	121.5	140	-156.6	172.2	-173.9	166.2	2	121.8
480	A	27.1	Very low	29.3	Very low	80 Å²	80	158.1 Å²	158.1	66%	0.661	80%	0.797	S	S	*	*			trans	55.6	134.2	144.6	0	0	0	0	0	121.3
481	T	26.2	Very low	29.3	Very low	135 Å²	135	153.4 Å²	153.4	83%	0.828	79%	0.793	S	S	*	*				166.6	140.2	103.5	-57.3	0	0	0	0	110.8
482	I	32	Very low	29.7	Very low	151 Å²	151	151.5 Å²	151.5	77%	0.774	79%	0.79	S	S	*	*			trans	-65.9	135.3	171.4	-67.2	158.1	0	0	0	110.6
483	Q	23.9	Very low	29.5	Very low	194 Å²	194	153 Å²	153	91%	0.907	80%	0.795	S	S	*	*			trans	-167	141.6	138	-111.8	167.3	38.2	0	0	114.5
484	R	27.5	Very low	29.4	Very low	235 Å²	235	158 Å²	158	89%	0.887	81%	0.805	S	S	*	*			trans	-78	152.9	177.7	-61.9	173.7	178	-153	-1.9	111.7
485	S	24.8	Very low	29.4	Very low	122 Å²	122	153.6 Å²	153.6	85%	0.853	81%	0.805	S	S	*	*			trans	-170.4	120.4	137	50.1	0	0	0	0	112
486	E	23.5	Very low	29.4	Very low	182 Å²	182	152.8 Å²	152.8	85%	0.85	81%	0.808	S	S	*	*			trans	-77	-162.7	163.3	-67	-164.3	141.8	0	0	111.9
487	P	50.3	Low	29.3	Very low	104 Å²	104	146.9 Å²	146.9	68%	0.675	80%	0.8	S	S	*	*				-132.3	179.1	-54.1	30.1	-11.8	0	0	0	112.6
488	R	26.3	Very low	29.3	Very low	245 Å²	245	146.6 Å²	146.6	93%	0.925	80%	0.797	S	S	*	*			trans	152.7	146.2	144.8	-87.1	166	172.9	-171.1	-1.4	110.2
489	S	27.4	Very low	28.3	Very low	91 Å²	91	149.2 Å²	149.2	64%	0.636	80%	0.8	S	S	*	*			cis	-179.6	143.7	-14.7	-167.4	0	0	0	0	107
490	N	28.1	Very low	28.4	Very low	156 Å²	156	147.2 Å²	147.2	83%	0.834	79%	0.793	S	S	*	*			trans	74.2	114.4	162.2	-51.7	-11.7	0	0	0	116.6
491	G	27.3	Very low	28.7	Very low	75 Å²	75	148.8 Å²	148.8	77%	0.773	80%	0.797	S	S	*	*			cis	124.2	167.1	22.8	0	0	0	0	0	108.2
492	P	35.9	Very low	29.3	Very low	128 Å²	128	149 Å²	149	83%	0.831	80%	0.798	S	S	*	*			cis	-122.3	167.9	-38.3	38.2	-23	0	0	0	112
493	M	24.8	Very low	29.8	Very low	161 Å²	161	149 Å²	149	79%	0.793	80%	0.795	S	S	*	*			trans	158.4	113.3	134.1	-157.5	82.6	159.3	0	0	111.3
494	R	27	Very low	31.4	Very low	226 Å²	226	144.9 Å²	144.9	85%	0.853	79%	0.785	S	S	*	*			trans	61.3	91.8	152.3	-76	174.5	167.5	-110.1	-1.8	119.5
495	S	27.8	Very low	33.2	Very low	115 Å²	115	136.9 Å²	136.9	80%	0.804	76%	0.764	S	S	*	*			trans	-99.1	147.4	144.8	-44.1	0	0	0	0	109.1
496	P	29.1	Very low	35.8	Very low	125 Å²	125	133.1 Å²	133.1	81%	0.812	73%	0.734	S	S	*	*			trans	-68	136.8	-177.8	-9.2	25	0	0	0	110.5	S498	P496-S498 PolarHBondContact O-N 2.98Å
497	S	24.7	Very low	38.7	Very low	101 Å²	101	129.9 Å²	129.9	71%	0.706	71%	0.714	S	S	*	*			trans	-39.7	128	168.5	33.3	0	0	0	0	113.4	Q499	S497-Q499 PolarHBondContact O-N 3.01Å; S497-Q499 VanDerWaalsContact O-N 3.09Å
498	S	29.1	Very low	40.3	Very low	98 Å²	98	125.3 Å²	125.3	69%	0.685	68%	0.684	S	S	*	*			trans	-53.9	107.9	155.3	-172.5	0	0	0	0	108.3	P496 Y500	P496-S498 PolarHBondContact O-N 2.98Å; S498-Y500 PolarHBondContact O-N 3.14Å
499	Q	26.2	Very low	43.1	Very low	174 Å²	174	119.1 Å²	119.1	81%	0.813	66%	0.661	S	S	*	*			trans	-85.4	103.1	163.3	-76	-176	-11	0	0	106.9	S497 P501	S497-Q499 PolarHBondContact O-N 3.01Å; S497-Q499 VanDerWaalsContact O-N 3.09Å; Q499-P501 WeakPolarHBondContact O-CD 3.31Å
500	Y	27.6	Very low	45.8	Very low	194 Å²	194	114.8 Å²	114.8	76%	0.761	63%	0.631	S	S	*	*			trans	-62.4	125.6	151.2	-66.9	-93.3	0	0	0	107.7	S498 T502	S498-Y500 PolarHBondContact O-N 3.14Å; Y500-T502 PolarHBondContact O-N 3.26Å
501	P	33.7	Very low	48.3	Very low	113 Å²	113	110.2 Å²	110.2	73%	0.734	61%	0.605	S	S	*	*			trans	-79.4	105.9	148.4	3.7	15.6	0	0	0	106	Q499 E503	Q499-P501 WeakPolarHBondContact O-CD 3.31Å; P501-E503 PolarHBondContact O-N 3.27Å
502	T	37.4	Very low	50.6	Low	139 Å²	139	113.4 Å²	113.4	85%	0.853	60%	0.595	S	S	*	*			trans	-70.6	65.6	168.2	-32.7	0	0	0	0	108.6	Y500	Y500-T502 PolarHBondContact O-N 3.26Å
503	E	44.3	Very low	52.7	Low	151 Å²	151	112.8 Å²	112.8	71%	0.706	58%	0.584	S	S	*	*			trans	-81.6	131.9	161.4	-75	-167.2	169.5	0	0	107.8	P501	P501-E503 PolarHBondContact O-N 3.27Å
504	P	55.6	Low	55.5	Low	107 Å²	107	106.5 Å²	106.5	70%	0.695	55%	0.552	S	S	*	*			trans	-56.3	145.7	173.7	23.9	-31.6	0	0	0	109.3	L506	P504-L506 PolarHBondContact O-N 3.03Å
505	P	67	Low	58.3	Low	68 Å²	68	99.7 Å²	99.7	44%	0.442	54%	0.54	S	S	.	.			trans	-53.9	114.9	178.8	-17.6	26.4	0	0	0	109.7	Y507 Q531	P505-Y507 HydrophobicContact CB-CD2 4.29Å; P505-Y507 HydrophobicContact CB-CE2 3.6Å; P505-Y507 HydrophobicContact CG-CE2 4.29Å; P505-Y507 WeakPolarHBondContact O-CD2 3.42Å; P505-Y507 PolarHBondContact O-N 3.35Å; P505-Y507 VanDerWaalsContact O-N 3.16Å; P505-Q531 HydrophobicContact CB-CG 4.16Å
506	L	79.6	Confident	61	Low	43 Å²	43	96 Å²	96	23%	0.225	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	106.6	179.7	179.6	67.2	0	0	0	108.4	P504 M508 V532 Q559	P504-L506 PolarHBondContact O-N 3.03Å; L506-M508 HydrophobicContact CD2-CG 4.36Å; L506-M508 HydrophobicContact CD2-SD 4.08Å; L506-M508 HydrophobicContact CG-CG 4.08Å; L506-M508 HydrophobicContact CG-SD 4.44Å; L506-V532 HydrophobicContact CB-CB 4.32Å; L506-V532 HydrophobicContact CD2-CB 4.26Å; L506-V532 HydrophobicContact CD2-CG2 4.15Å; L506-V532 HydrophobicContact CG-CB 4.49Å; L506-V532 HydrophobicContact CG-CG2 4.35Å; L506-V532 PolarHBondContact O-N 2.95Å; L506-Q559 HydrophobicContact CD1-CG 4.41Å
507	Y	83.9	Confident	63.1	Low	113 Å²	113	100.5 Å²	100.5	44%	0.443	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.1	172.4	-64.7	-80.2	0	0	0	109.7	P505 V529 V530 Q531	P505-Y507 HydrophobicContact CB-CD2 4.29Å; P505-Y507 HydrophobicContact CB-CE2 3.6Å; P505-Y507 HydrophobicContact CG-CE2 4.29Å; P505-Y507 WeakPolarHBondContact O-CD2 3.42Å; P505-Y507 PolarHBondContact O-N 3.35Å; P505-Y507 VanDerWaalsContact O-N 3.16Å; Y507-V529 HydrophobicContact CD1-CG1 4.14Å; Y507-V529 HydrophobicContact CG-CG1 4.37Å; Y507-V530 WeakPolarHBondContact CA-O 3.42Å; Y507-Q531 HydrophobicContact CD1-CB 4Å; Y507-Q531 HydrophobicContact CE1-CB 3.81Å; Y507-Q531 HydrophobicContact CE1-CG 4.16Å
508	M	83	Confident	65.6	Low	9 Å²	9	99.3 Å²	99.3	4%	0.044	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	148	178.9	-64.1	-175.9	93	0	0	109.9	L506 V529 V530 V532 W540 L557 E558 Q559	L506-M508 HydrophobicContact CD2-CG 4.36Å; L506-M508 HydrophobicContact CD2-SD 4.08Å; L506-M508 HydrophobicContact CG-CG 4.08Å; L506-M508 HydrophobicContact CG-SD 4.44Å; M508-V529 CarbonylContact O-C 3.51Å; M508-V529 WeakPolarHBondContact O-CA 3.35Å; M508-V530 PolarHBondContact N-O 2.9Å; M508-V530 PolarHBondContact O-N 3.03Å; M508-V532 HydrophobicContact CB-CG2 4.41Å; M508-V532 HydrophobicContact CG-CG2 3.83Å; M508-V532 HydrophobicContact SD-CG2 3.4Å; M508-V532 WeakPolarHBondContact SD-CG2 3.43Å; M508-W540 HydrophobicContact CE-CZ3 3.92Å; M508-W540 HydrophobicContact SD-CE3 4.15Å; M508-W540 HydrophobicContact SD-CZ3 3.57Å; M508-W540 VanDerWaalsContact SD-CZ3 3.57Å; M508-L557 HydrophobicContact CB-CB 4.14Å; M508-L557 HydrophobicContact CE-CB 4.01Å; M508-L557 HydrophobicContact SD-CB 3.98Å; M508-L557 HydrophobicContact SD-CD1 4.28Å; M508-E558 CarbonylContact C-O 3.58Å; M508-E558 WeakPolarHBondContact CA-O 3.36Å; M508-E558 VanDerWaalsContact CB-O 3.25Å; M508-E558 WeakPolarHBondContact CB-O 3.42Å; M508-Q559 HydrophobicContact CE-CB 4.23Å; M508-Q559 HydrophobicContact CE-CG 3.26Å; M508-Q559 HydrophobicContact CG-CG 4.29Å; M508-Q559 HydrophobicContact SD-CG 4.28Å
509	R	86.3	Confident	67.7	Low	114 Å²	114	104 Å²	104	43%	0.43	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	135.2	176.7	-178.7	169.6	62.3	-173.1	-0.1	110.1	L557 E558 V560	R509-L557 CarbonylContact O-C 3.48Å; R509-L557 WeakPolarHBondContact O-CA 3.35Å; R509-E558 IonicContact CZ-OE2 3.38Å; R509-E558 PolarHBondContact N-O 3.24Å; R509-E558 IonicContact NE-OE2 3.24Å; R509-E558 PolarHBondContact NE-OE2 2.89Å; R509-E558 IonicContact NH2-OE2 2.69Å; R509-E558 PolarHBondContact NH2-OE2 3.33Å; R509-E558 PolarHBondContact O-N 2.92Å; R509-V560 HydrophobicContact CB-CG2 3.87Å
510	V	83.8	Confident	70.1	Confident	1 Å²	1	102.4 Å²	102.4	1%	0.006	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	123.8	176.8	174.6	0	0	0	0	109.5	Y512 V524 T525 G527 E528 V530 I556 L557	V510-Y512 WeakPolarHBondContact CG1-O 3.39Å; V510-V524 HydrophobicContact CG1-CB 4.28Å; V510-V524 HydrophobicContact CG1-CG2 3.8Å; V510-V524 HydrophobicContact CG2-CB 3.98Å; V510-V524 HydrophobicContact CG2-CG2 3.97Å; V510-T525 VanDerWaalsContact CB-O 3.32Å; V510-T525 WeakPolarHBondContact CB-O 3.49Å; V510-T525 VanDerWaalsContact CG1-O 3.27Å; V510-T525 WeakPolarHBondContact CG1-O 3.48Å; V510-G527 PolarHBondContact O-N 3.38Å; V510-E528 HydrophobicContact CB-CB 4.42Å; V510-E528 WeakPolarHBondContact CB-O 3.15Å; V510-E528 HydrophobicContact CG2-CB 4.34Å; V510-E528 VanDerWaalsContact CG2-O 3.32Å; V510-E528 WeakPolarHBondContact CG2-O 3.43Å; V510-E528 PolarHBondContact N-O 3.2Å; V510-V530 HydrophobicContact CG2-CG1 3.94Å; V510-V530 HydrophobicContact CG2-CG2 4.13Å; V510-I556 CarbonylContact C-O 3.48Å; V510-I556 VanDerWaalsContact CA-O 3.28Å; V510-I556 WeakPolarHBondContact CA-O 3.3Å; V510-I556 HydrophobicContact CG1-CD1 4.24Å; V510-L557 HydrophobicContact CG2-CD2 3.87Å
511	M	81.1	Confident	73	Confident	60 Å²	60	94.4 Å²	94.4	30%	0.296	48%	0.478	S	S	.	.			trans	-87.3	-24	-175.5	-67.5	-60.5	-76.4	0	0	113.7	Q526 I556 E558	M511-Q526 VanDerWaalsContact O-CD 3.27Å; M511-Q526 VanDerWaalsContact O-CG 3.26Å; M511-Q526 WeakPolarHBondContact O-CG 3.49Å; M511-Q526 PolarHBondContact O-NE2 3.4Å; M511-I556 PolarHBondContact N-O 3.48Å; M511-E558 HydrophobicContact CG-CB 3.76Å; M511-E558 HydrophobicContact SD-CB 3.73Å; M511-E558 HydrophobicContact SD-CG 4.33Å
512	Y	74.1	Confident	75.4	Confident	142 Å²	142	89.4 Å²	89.4	56%	0.557	45%	0.445	S	S	*	.	S	Bend	trans	-144.8	150.9	-178.4	-54	-75.2	0	0	0	110.9	V510 F514 I556	V510-Y512 WeakPolarHBondContact CG1-O 3.39Å; Y512-F514 PolarHBondContact O-N 2.76Å; Y512-I556 HydrophobicContact CD2-CG2 4.25Å
513	N	79.6	Confident	77.7	Confident	115 Å²	115	85.9 Å²	85.9	62%	0.615	42%	0.423	S	S	*	.			trans	-61.9	134.1	174.5	-65.7	-27.9	0	0	0	110.7	T525 Q526	N513-T525 WeakPolarHBondContact OD1-CA 3.39Å; N513-Q526 WeakPolarHBondContact OD1-CB 3.31Å; N513-Q526 PolarHBondContact OD1-N 3.42Å
514	F	85.3	Confident	79.7	Confident	28 Å²	28	78.8 Å²	78.8	12%	0.123	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-134.9	126.8	176.2	175	-93.9	0	0	0	110.6	Y512 E521 L522 T523 V524 W539 V552 P553 I556	Y512-F514 PolarHBondContact O-N 2.76Å; F514-E521 HydrophobicContact CE1-CB 4.26Å; F514-E521 HydrophobicContact CZ-CB 4.45Å; F514-E521 HydrophobicContact CZ-CG 4.42Å; F514-L522 WeakPolarHBondContact CD1-O 3.45Å; F514-L522 WeakPolarHBondContact CE1-O 3.17Å; F514-T523 CarbonylContact O-C 3.55Å; F514-T523 VanDerWaalsContact O-CA 3.27Å; F514-T523 WeakPolarHBondContact O-CA 3.44Å; F514-V524 HydrophobicContact CB-CG2 3.78Å; F514-V524 HydrophobicContact CD1-CG2 4.29Å; F514-V524 PolarHBondContact N-O 2.94Å; F514-V524 PolarHBondContact O-N 3.33Å; F514-V524 VanDerWaalsContact O-O 3.05Å; F514-W539 HydrophobicContact CE1-CZ3 4.15Å; F514-W539 HydrophobicContact CE2-CH2 4.06Å; F514-W539 HydrophobicContact CE2-CZ3 4.03Å; F514-W539 AromaticContact CZ-CH2 3.74Å; F514-W539 HydrophobicContact CZ-CH2 3.74Å; F514-W539 AromaticContact CZ-CZ3 3.42Å; F514-W539 HydrophobicContact CZ-CZ3 3.42Å; F514-W539 VanDerWaalsContact CZ-CZ3 3.42Å; F514-V552 HydrophobicContact CD1-CG1 3.95Å; F514-V552 HydrophobicContact CE1-CG1 4.17Å; F514-P553 HydrophobicContact CD2-CG 4.32Å; F514-P553 HydrophobicContact CE2-CG 4.28Å; F514-I556 HydrophobicContact CB-CD1 3.55Å; F514-I556 HydrophobicContact CG-CD1 4.01Å
515	S	85.5	Confident	81	Confident	84 Å²	84	77.4 Å²	77.4	59%	0.587	38%	0.38	S	S	*	.			trans	-107.6	122.6	-178.7	-59.9	0	0	0	0	110	R517	S515-R517 PolarHBondContact O-N 2.95Å
516	A	84.6	Confident	81.7	Confident	36 Å²	36	80.1 Å²	80.1	30%	0.298	39%	0.387	S	S	.	.			trans	-59.7	131.3	178	0	0	0	0	0	111.7	E521 T523	A516-E521 VanDerWaalsContact CB-C 3.49Å; A516-E521 HydrophobicContact CB-CB 3.7Å; A516-E521 WeakPolarHBondContact CB-O 3.32Å; A516-T523 WeakPolarHBondContact CB-OG1 3.33Å; A516-T523 PolarHBondContact N-OG1 3.22Å
517	R	72.6	Confident	81.5	Confident	221 Å²	221	80.3 Å²	80.3	83%	0.834	40%	0.399	S	S	*	.	S	Bend	trans	-99.7	-13.7	179	-58.8	178.1	178.8	-179.7	-0.8	112.7	S515 E521	S515-R517 PolarHBondContact O-N 2.95Å; R517-E521 WeakPolarHBondContact CB-OE2 3.42Å; R517-E521 PolarHBondContact N-OE2 3.46Å
518	N	76.9	Confident	81.7	Confident	76 Å²	76	76.3 Å²	76.3	41%	0.406	38%	0.384	S	S	.	.	S	Bend	trans	-147.5	174.4	177.8	62.1	54.4	0	0	0	110.9	Q520 E521	N518-Q520 PolarHBondContact O-N 2.87Å; N518-Q520 VanDerWaalsContact OD1-CA 3.32Å; N518-Q520 WeakPolarHBondContact OD1-CA 3.26Å; N518-Q520 WeakPolarHBondContact OD1-CB 3.46Å; N518-Q520 PolarHBondContact OD1-N 3.47Å; N518-E521 PolarHBondContact ND2-OE1 2.93Å; N518-E521 PolarHBondContact O-N 3.02Å; N518-E521 WeakPolarHBondContact OD1-CG 3.44Å; N518-E521 PolarHBondContact OD1-N 3.15Å
519	M	73.3	Confident	81.9	Confident	195 Å²	195	79.3 Å²	79.3	96%	0.961	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-9.4	-178.8	-61.3	-170.9	-63.9	0	0	114.3
520	Q	77.8	Confident	81.9	Confident	141 Å²	141	73.9 Å²	73.9	66%	0.659	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-10.5	176.8	-61.3	-177.9	-12.1	0	0	112.1	N518 G550 N551	N518-Q520 PolarHBondContact O-N 2.87Å; N518-Q520 VanDerWaalsContact OD1-CA 3.32Å; N518-Q520 WeakPolarHBondContact OD1-CA 3.26Å; N518-Q520 WeakPolarHBondContact OD1-CB 3.46Å; N518-Q520 PolarHBondContact OD1-N 3.47Å; Q520-G550 CarbonylContact O-C 3.52Å; Q520-G550 WeakPolarHBondContact O-CA 3.24Å; Q520-N551 VanDerWaalsContact O-CB 3.32Å; Q520-N551 WeakPolarHBondContact O-CB 3.31Å; Q520-N551 PolarHBondContact O-N 3.36Å; Q520-N551 PolarHBondContact O-ND2 3.39Å
521	E	86.8	Confident	82.1	Confident	27 Å²	27	76 Å²	76	13%	0.126	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-100.1	151.1	179.7	-72.4	172.3	-156.5	0	0	111.1	F514 A516 R517 N518 W539 N551	F514-E521 HydrophobicContact CE1-CB 4.26Å; F514-E521 HydrophobicContact CZ-CB 4.45Å; F514-E521 HydrophobicContact CZ-CG 4.42Å; A516-E521 VanDerWaalsContact CB-C 3.49Å; A516-E521 HydrophobicContact CB-CB 3.7Å; A516-E521 WeakPolarHBondContact CB-O 3.32Å; R517-E521 WeakPolarHBondContact CB-OE2 3.42Å; R517-E521 PolarHBondContact N-OE2 3.46Å; N518-E521 PolarHBondContact ND2-OE1 2.93Å; N518-E521 PolarHBondContact O-N 3.02Å; N518-E521 WeakPolarHBondContact OD1-CG 3.44Å; N518-E521 PolarHBondContact OD1-N 3.15Å; E521-W539 HydrophobicContact CG-CE3 4.26Å; E521-W539 HydrophobicContact CG-CH2 4.07Å; E521-W539 HydrophobicContact CG-CZ3 3.62Å; E521-W539 WeakPolarHBondContact OE1-CH2 3.41Å; E521-N551 WeakPolarHBondContact CA-O 3.42Å
522	L	85.8	Confident	82.4	Confident	8 Å²	8	73.9 Å²	73.9	4%	0.042	38%	0.382	C	S	.	.			trans	-109.4	128.2	178.6	-169.2	64.3	0	0	0	111.4	F514 V524 V542 N544 E548 N551 V552	F514-L522 WeakPolarHBondContact CD1-O 3.45Å; F514-L522 WeakPolarHBondContact CE1-O 3.17Å; L522-V524 HydrophobicContact CB-CG1 4.43Å; L522-V524 HydrophobicContact CD2-CG1 3.95Å; L522-V524 HydrophobicContact CG-CG1 3.98Å; L522-V524 PolarHBondContact O-N 3.4Å; L522-V542 HydrophobicContact CD2-CG2 3.86Å; L522-N544 HydrophobicContact CD2-CB 3.87Å; L522-E548 HydrophobicContact CD1-CB 3.61Å; L522-N551 PolarHBondContact N-O 2.97Å; L522-V552 HydrophobicContact CB-CG1 4.14Å
523	T	84.9	Confident	82.9	Confident	65 Å²	65	70 Å²	70	40%	0.399	37%	0.373	S	S	.	.			trans	-75	122	171	-62.4	0	0	0	0	109.6	F514 A516	F514-T523 CarbonylContact O-C 3.55Å; F514-T523 VanDerWaalsContact O-CA 3.27Å; F514-T523 WeakPolarHBondContact O-CA 3.44Å; A516-T523 WeakPolarHBondContact CB-OG1 3.33Å; A516-T523 PolarHBondContact N-OG1 3.22Å
524	V	86.7	Confident	82.8	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.012	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-133.2	150	-178.3	-62.5	0	0	0	0	111.2	V510 F514 L522 E528 V530 V552 I556	V510-V524 HydrophobicContact CG1-CB 4.28Å; V510-V524 HydrophobicContact CG1-CG2 3.8Å; V510-V524 HydrophobicContact CG2-CB 3.98Å; V510-V524 HydrophobicContact CG2-CG2 3.97Å; F514-V524 HydrophobicContact CB-CG2 3.78Å; F514-V524 HydrophobicContact CD1-CG2 4.29Å; F514-V524 PolarHBondContact N-O 2.94Å; F514-V524 PolarHBondContact O-N 3.33Å; F514-V524 VanDerWaalsContact O-O 3.05Å; L522-V524 HydrophobicContact CB-CG1 4.43Å; L522-V524 HydrophobicContact CD2-CG1 3.95Å; L522-V524 HydrophobicContact CG-CG1 3.98Å; L522-V524 PolarHBondContact O-N 3.4Å; V524-E528 WeakPolarHBondContact CA-OE2 3.26Å; V524-V530 HydrophobicContact CG1-CG1 4.01Å; V524-V552 HydrophobicContact CG1-CG1 4.28Å; V524-V552 HydrophobicContact CG2-CG1 4.15Å; V524-I556 HydrophobicContact CG2-CD1 3.73Å
525	T	82.9	Confident	82.6	Confident	77 Å²	77	74.2 Å²	74.2	47%	0.472	39%	0.388	S	S	.	.			trans	-110	149.1	-178	50.6	0	0	0	0	112.1	V510 N513 G527 E528	V510-T525 VanDerWaalsContact CB-O 3.32Å; V510-T525 WeakPolarHBondContact CB-O 3.49Å; V510-T525 VanDerWaalsContact CG1-O 3.27Å; V510-T525 WeakPolarHBondContact CG1-O 3.48Å; N513-T525 WeakPolarHBondContact OD1-CA 3.39Å; T525-G527 PolarHBondContact O-N 2.97Å; T525-E528 PolarHBondContact N-OE2 3.31Å; T525-E528 WeakPolarHBondContact O-CB 3.49Å; T525-E528 PolarHBondContact O-N 3.33Å; T525-E528 PolarHBondContact OG1-OE2 3.36Å; T525-E528 VanDerWaalsContact OG1-OE2 3.05Å
526	Q	82.2	Confident	82.1	Confident	126 Å²	126	72.3 Å²	72.3	59%	0.589	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	128.3	176.2	177.9	175.1	26	0	0	110.1	M511 N513	M511-Q526 VanDerWaalsContact O-CD 3.27Å; M511-Q526 VanDerWaalsContact O-CG 3.26Å; M511-Q526 WeakPolarHBondContact O-CG 3.49Å; M511-Q526 PolarHBondContact O-NE2 3.4Å; N513-Q526 WeakPolarHBondContact OD1-CB 3.31Å; N513-Q526 PolarHBondContact OD1-N 3.42Å
527	G	75.3	Confident	80.8	Confident	46 Å²	46	82.4 Å²	82.4	47%	0.474	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	-9.9	-174.7	0	0	0	0	0	114.6	V510 T525	V510-G527 PolarHBondContact O-N 3.38Å; T525-G527 PolarHBondContact O-N 2.97Å
528	E	86.8	Confident	80.4	Confident	30 Å²	30	76.7 Å²	76.7	14%	0.14	40%	0.397	C	S	.	.			trans	-69.1	137.9	177.4	-169.9	171.9	174.3	0	0	111.2	V510 V524 T525 V530 N544	V510-E528 HydrophobicContact CB-CB 4.42Å; V510-E528 WeakPolarHBondContact CB-O 3.15Å; V510-E528 HydrophobicContact CG2-CB 4.34Å; V510-E528 VanDerWaalsContact CG2-O 3.32Å; V510-E528 WeakPolarHBondContact CG2-O 3.43Å; V510-E528 PolarHBondContact N-O 3.2Å; V524-E528 WeakPolarHBondContact CA-OE2 3.26Å; T525-E528 PolarHBondContact N-OE2 3.31Å; T525-E528 WeakPolarHBondContact O-CB 3.49Å; T525-E528 PolarHBondContact O-N 3.33Å; T525-E528 PolarHBondContact OG1-OE2 3.36Å; T525-E528 VanDerWaalsContact OG1-OE2 3.05Å; E528-V530 HydrophobicContact CG-CG1 4.42Å; E528-N544 WeakPolarHBondContact OE1-CB 3.48Å
529	V	86.9	Confident	80.8	Confident	71 Å²	71	76.9 Å²	76.9	43%	0.43	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.2	175.9	-179.4	0	0	0	0	109.1	Y507 M508	Y507-V529 HydrophobicContact CD1-CG1 4.14Å; Y507-V529 HydrophobicContact CG-CG1 4.37Å; M508-V529 CarbonylContact O-C 3.51Å; M508-V529 WeakPolarHBondContact O-CA 3.35Å
530	V	87.5	Confident	81.4	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.5	-179.9	-60	0	0	0	0	110.6	Y507 M508 V510 V524 E528 V542 R543 L557	Y507-V530 WeakPolarHBondContact CA-O 3.42Å; M508-V530 PolarHBondContact N-O 2.9Å; M508-V530 PolarHBondContact O-N 3.03Å; V510-V530 HydrophobicContact CG2-CG1 3.94Å; V510-V530 HydrophobicContact CG2-CG2 4.13Å; V524-V530 HydrophobicContact CG1-CG1 4.01Å; E528-V530 HydrophobicContact CG-CG1 4.42Å; V530-V542 HydrophobicContact CB-CB 4.08Å; V530-V542 HydrophobicContact CB-CG2 4.35Å; V530-V542 HydrophobicContact CG2-CB 3.97Å; V530-V542 HydrophobicContact CG2-CG1 4.03Å; V530-V542 HydrophobicContact CG2-CG2 4.3Å; V530-R543 WeakPolarHBondContact CA-O 3.39Å; V530-L557 HydrophobicContact CG2-CD2 3.56Å
531	Q	87.6	Confident	81.8	Confident	46 Å²	46	64.9 Å²	64.9	22%	0.215	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.6	174	-176.7	-172.1	-0.5	0	0	109.2	P505 Y507 V533 V542 R543	P505-Q531 HydrophobicContact CB-CG 4.16Å; Y507-Q531 HydrophobicContact CD1-CB 4Å; Y507-Q531 HydrophobicContact CE1-CB 3.81Å; Y507-Q531 HydrophobicContact CE1-CG 4.16Å; Q531-V533 PolarHBondContact O-N 2.83Å; Q531-V542 CarbonylContact O-C 3.44Å; Q531-V542 VanDerWaalsContact O-CA 3.26Å; Q531-V542 WeakPolarHBondContact O-CA 3.27Å; Q531-R543 HydrophobicContact CB-CB 4.36Å; Q531-R543 PolarHBondContact N-O 2.99Å; Q531-R543 PolarHBondContact O-N 3.3Å
532	V	87	Confident	81.9	Confident	15 Å²	15	63.6 Å²	63.6	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	116.5	172.5	-176.6	0	0	0	0	109	L506 M508 K535 W540 V542	L506-V532 HydrophobicContact CB-CB 4.32Å; L506-V532 HydrophobicContact CD2-CB 4.26Å; L506-V532 HydrophobicContact CD2-CG2 4.15Å; L506-V532 HydrophobicContact CG-CB 4.49Å; L506-V532 HydrophobicContact CG-CG2 4.35Å; L506-V532 PolarHBondContact O-N 2.95Å; M508-V532 HydrophobicContact CB-CG2 4.41Å; M508-V532 HydrophobicContact CG-CG2 3.83Å; M508-V532 HydrophobicContact SD-CG2 3.4Å; M508-V532 WeakPolarHBondContact SD-CG2 3.43Å; V532-K535 HydrophobicContact CG1-CG 3.78Å; V532-W540 HydrophobicContact CG1-CE3 3.98Å; V532-W540 HydrophobicContact CG2-CE3 4.12Å; V532-W540 HydrophobicContact CG2-CZ3 4.45Å; V532-V542 HydrophobicContact CG2-CG1 4.36Å
533	V	84.4	Confident	82	Confident	61 Å²	61	66.5 Å²	66.5	37%	0.37	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-40.8	179	-177.5	0	0	0	0	110.4	Q531 L541 R543	Q531-V533 PolarHBondContact O-N 2.83Å; V533-L541 HydrophobicContact CB-CD2 4.26Å; V533-L541 HydrophobicContact CB-CG 4.26Å; V533-L541 HydrophobicContact CG1-CD2 4.11Å; V533-L541 PolarHBondContact N-O 3.33Å; V533-R543 HydrophobicContact CG2-CB 3.77Å
534	Q	78.9	Confident	82	Confident	117 Å²	117	63.7 Å²	63.7	55%	0.547	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	128.6	179.7	-165.1	173.8	26.7	0	0	111.6	W540 L541	Q534-W540 WeakPolarHBondContact O-CA 3.46Å; Q534-L541 HydrophobicContact CB-CB 3.87Å; Q534-L541 HydrophobicContact CB-CD2 4.41Å; Q534-L541 PolarHBondContact N-O 2.81Å; Q534-L541 VanDerWaalsContact N-O 3.12Å; Q534-L541 PolarHBondContact O-N 3.34Å
535	K	79.5	Confident	81.8	Confident	115 Å²	115	68.4 Å²	68.4	50%	0.5	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	98	173.2	-64	178.1	-179.5	171.9	0	109.3	V532 W540	V532-K535 HydrophobicContact CG1-CG 3.78Å; K535-W540 HydrophobicContact CB-CD2 4.36Å; K535-W540 HydrophobicContact CB-CZ2 4.47Å; K535-W540 HydrophobicContact CD-CH2 4.14Å; K535-W540 HydrophobicContact CD-CZ2 4.24Å; K535-W540 HydrophobicContact CD-CZ3 4.37Å; K535-W540 HydrophobicContact CG-CD2 4Å; K535-W540 HydrophobicContact CG-CE3 4.09Å; K535-W540 HydrophobicContact CG-CH2 4.26Å; K535-W540 HydrophobicContact CG-CZ2 4.16Å; K535-W540 HydrophobicContact CG-CZ3 4.21Å
536	S	75.3	Confident	81.6	Confident	43 Å²	43	71.9 Å²	71.9	30%	0.301	36%	0.357	S	S	.	.			trans	-116.3	149.4	173.8	34.9	0	0	0	0	111	W539	S536-W539 CarbonylContact C-O 3.52Å; S536-W539 WeakPolarHBondContact CB-O 3.38Å; S536-W539 CarbonylContact O-C 3.59Å; S536-W539 PolarHBondContact O-N 3.43Å; S536-W539 PolarHBondContact OG-O 3.22Å
537	R	58.3	Low	81.5	Confident	248 Å²	248	71.7 Å²	71.7	94%	0.936	36%	0.359	S	S	*	.	S	Bend	trans	-95.5	131.8	169.4	-66.6	-173.3	178.2	-167.9	-1.1	107.9
538	P	64.9	Low	81.7	Confident	102 Å²	102	73.7 Å²	73.7	66%	0.662	36%	0.356	S	S	*	.	S	Bend	cis	-91	-5.3	8.8	12.9	2.5	0	0	0	115.8	P554	P538-P554 WeakPolarHBondContact O-CD 3.44Å
539	W	83.3	Confident	81.7	Confident	79 Å²	79	76.7 Å²	76.7	30%	0.299	37%	0.371	S	S	.	.			trans	-129.9	140.4	-170	-64.2	66.8	0	0	0	112.4	F514 E521 S536 N551	F514-W539 HydrophobicContact CE1-CZ3 4.15Å; F514-W539 HydrophobicContact CE2-CH2 4.06Å; F514-W539 HydrophobicContact CE2-CZ3 4.03Å; F514-W539 AromaticContact CZ-CH2 3.74Å; F514-W539 HydrophobicContact CZ-CH2 3.74Å; F514-W539 AromaticContact CZ-CZ3 3.42Å; F514-W539 HydrophobicContact CZ-CZ3 3.42Å; F514-W539 VanDerWaalsContact CZ-CZ3 3.42Å; E521-W539 HydrophobicContact CG-CE3 4.26Å; E521-W539 HydrophobicContact CG-CH2 4.07Å; E521-W539 HydrophobicContact CG-CZ3 3.62Å; E521-W539 WeakPolarHBondContact OE1-CH2 3.41Å; S536-W539 CarbonylContact C-O 3.52Å; S536-W539 WeakPolarHBondContact CB-O 3.38Å; S536-W539 CarbonylContact O-C 3.59Å; S536-W539 PolarHBondContact O-N 3.43Å; S536-W539 PolarHBondContact OG-O 3.22Å; W539-N551 HydrophobicContact CB-CB 3.89Å; W539-N551 HydrophobicContact CD2-CB 4.39Å; W539-N551 HydrophobicContact CE3-CB 3.86Å; W539-N551 HydrophobicContact CG-CB 4.45Å
540	W	86.6	Confident	81.5	Confident	49 Å²	49	73.4 Å²	73.4	19%	0.186	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.7	178.9	-70.5	16.5	0	0	0	109.9	M508 V532 Q534 K535 V542 N551 V552 P554 L557	M508-W540 HydrophobicContact CE-CZ3 3.92Å; M508-W540 HydrophobicContact SD-CE3 4.15Å; M508-W540 HydrophobicContact SD-CZ3 3.57Å; M508-W540 VanDerWaalsContact SD-CZ3 3.57Å; V532-W540 HydrophobicContact CG1-CE3 3.98Å; V532-W540 HydrophobicContact CG2-CE3 4.12Å; V532-W540 HydrophobicContact CG2-CZ3 4.45Å; Q534-W540 WeakPolarHBondContact O-CA 3.46Å; K535-W540 HydrophobicContact CB-CD2 4.36Å; K535-W540 HydrophobicContact CB-CZ2 4.47Å; K535-W540 HydrophobicContact CD-CH2 4.14Å; K535-W540 HydrophobicContact CD-CZ2 4.24Å; K535-W540 HydrophobicContact CD-CZ3 4.37Å; K535-W540 HydrophobicContact CG-CD2 4Å; K535-W540 HydrophobicContact CG-CE3 4.09Å; K535-W540 HydrophobicContact CG-CH2 4.26Å; K535-W540 HydrophobicContact CG-CZ2 4.16Å; K535-W540 HydrophobicContact CG-CZ3 4.21Å; W540-V542 HydrophobicContact CB-CG1 4.45Å; W540-V542 PolarHBondContact O-N 3.07Å; W540-N551 CarbonylContact O-C 3.54Å; W540-N551 WeakPolarHBondContact O-CA 3.47Å; W540-V552 PolarHBondContact N-O 3.07Å; W540-V552 PolarHBondContact O-N 3.06Å; W540-P554 HydrophobicContact CD2-CB 3.78Å; W540-P554 HydrophobicContact CE3-CB 4.33Å; W540-P554 HydrophobicContact CG-CB 4.07Å; W540-P554 HydrophobicContact CH2-CB 4.41Å; W540-P554 HydrophobicContact CZ2-CB 3.88Å; W540-L557 HydrophobicContact CE3-CD1 3.95Å
541	L	85.8	Confident	81.5	Confident	35 Å²	35	75.2 Å²	75.2	18%	0.183	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	115.7	172	-173.7	66.4	0	0	0	108.1	V533 Q534 Q549	V533-L541 HydrophobicContact CB-CD2 4.26Å; V533-L541 HydrophobicContact CB-CG 4.26Å; V533-L541 HydrophobicContact CG1-CD2 4.11Å; V533-L541 PolarHBondContact N-O 3.33Å; Q534-L541 HydrophobicContact CB-CB 3.87Å; Q534-L541 HydrophobicContact CB-CD2 4.41Å; Q534-L541 PolarHBondContact N-O 2.81Å; Q534-L541 VanDerWaalsContact N-O 3.12Å; Q534-L541 PolarHBondContact O-N 3.34Å; L541-Q549 HydrophobicContact CD1-CB 4.29Å
542	V	89.6	Confident	81.3	Confident	0 Å²	0	73 Å²	73	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	156.5	178.1	-60.2	0	0	0	0	110.7	L522 V530 Q531 V532 W540 Q549 G550 V552 L557	L522-V542 HydrophobicContact CD2-CG2 3.86Å; V530-V542 HydrophobicContact CB-CB 4.08Å; V530-V542 HydrophobicContact CB-CG2 4.35Å; V530-V542 HydrophobicContact CG2-CB 3.97Å; V530-V542 HydrophobicContact CG2-CG1 4.03Å; V530-V542 HydrophobicContact CG2-CG2 4.3Å; Q531-V542 CarbonylContact O-C 3.44Å; Q531-V542 VanDerWaalsContact O-CA 3.26Å; Q531-V542 WeakPolarHBondContact O-CA 3.27Å; V532-V542 HydrophobicContact CG2-CG1 4.36Å; W540-V542 HydrophobicContact CB-CG1 4.45Å; W540-V542 PolarHBondContact O-N 3.07Å; V542-Q549 VanDerWaalsContact O-CA 3.3Å; V542-Q549 WeakPolarHBondContact O-CA 3.16Å; V542-G550 WeakPolarHBondContact CG2-O 3.3Å; V542-G550 PolarHBondContact N-O 2.9Å; V542-G550 PolarHBondContact O-N 3.22Å; V542-V552 HydrophobicContact CB-CG2 4.15Å; V542-V552 HydrophobicContact CG1-CG2 3.56Å; V542-V552 HydrophobicContact CG2-CB 4.19Å; V542-V552 HydrophobicContact CG2-CG1 3.69Å; V542-V552 HydrophobicContact CG2-CG2 3.45Å; V542-V552 VanDerWaalsContact CG2-CG2 3.45Å; V542-L557 HydrophobicContact CG1-CD1 3.76Å
543	R	87.1	Confident	81	Confident	70 Å²	70	73.6 Å²	73.6	26%	0.264	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126	174.3	-174.6	-177.2	-68.2	163.2	-0.1	109.4	V530 Q531 V533 E548 Q549	V530-R543 WeakPolarHBondContact CA-O 3.39Å; Q531-R543 HydrophobicContact CB-CB 4.36Å; Q531-R543 PolarHBondContact N-O 2.99Å; Q531-R543 PolarHBondContact O-N 3.3Å; V533-R543 HydrophobicContact CG2-CB 3.77Å; R543-E548 VanDerWaalsContact CA-O 3.29Å; R543-E548 WeakPolarHBondContact CA-O 3.28Å; R543-Q549 HydrophobicContact CB-CG 3.89Å; R543-Q549 HydrophobicContact CG-CG 3.96Å
544	N	86.6	Confident	80.8	Confident	6 Å²	6	72.9 Å²	72.9	3%	0.032	35%	0.351	C	S	.	.			trans	-81.3	175.8	174.9	68	12.1	0	0	0	112.1	L522 E528 R546 N547 E548	L522-N544 HydrophobicContact CD2-CB 3.87Å; E528-N544 WeakPolarHBondContact OE1-CB 3.48Å; N544-R546 PolarHBondContact ND2-NE 3.12Å; N544-R546 PolarHBondContact ND2-NH2 3.38Å; N544-R546 PolarHBondContact O-N 3.2Å; N544-R546 VanDerWaalsContact O-N 3.13Å; N544-R546 WeakPolarHBondContact OD1-CA 3.19Å; N544-R546 WeakPolarHBondContact OD1-CB 3.33Å; N544-R546 PolarHBondContact OD1-N 3.11Å; N544-N547 PolarHBondContact O-N 3.3Å; N544-N547 PolarHBondContact OD1-N 2.98Å; N544-E548 PolarHBondContact N-O 3.42Å; N544-E548 PolarHBondContact ND2-OE2 3.11Å; N544-E548 WeakPolarHBondContact OD1-CB 3.45Å; N544-E548 PolarHBondContact OD1-N 3.18Å; N544-E548 PolarHBondContact OD1-O 2.94Å
545	S	81.7	Confident	81	Confident	100 Å²	100	73.1 Å²	73.1	70%	0.699	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.6	175.5	59	0	0	0	0	114.2	N547	S545-N547 VanDerWaalsContact C-N 3.31Å
546	R	79.4	Confident	81.2	Confident	151 Å²	151	68.3 Å²	68.3	57%	0.57	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	7.6	176	-62.7	177.1	-76.4	169.5	-5.5	113.3	N544 E548	N544-R546 PolarHBondContact ND2-NE 3.12Å; N544-R546 PolarHBondContact ND2-NH2 3.38Å; N544-R546 PolarHBondContact O-N 3.2Å; N544-R546 VanDerWaalsContact O-N 3.13Å; N544-R546 WeakPolarHBondContact OD1-CA 3.19Å; N544-R546 WeakPolarHBondContact OD1-CB 3.33Å; N544-R546 PolarHBondContact OD1-N 3.11Å; R546-E548 HydrophobicContact CB-CG 4.22Å; R546-E548 IonicContact CZ-OE2 3.29Å; R546-E548 VanDerWaalsContact CZ-OE2 3.29Å; R546-E548 IonicContact NE-OE2 3.47Å; R546-E548 PolarHBondContact NE-OE2 2.95Å; R546-E548 IonicContact NH1-OE2 3.63Å; R546-E548 IonicContact NH2-OE2 3.28Å; R546-E548 PolarHBondContact O-N 3.49Å
547	N	80	Confident	81.6	Confident	121 Å²	121	67 Å²	67	65%	0.647	33%	0.325	S	S	*	.			trans	61.5	13.7	-174.3	-70.4	-50.4	0	0	0	115.1	N544 S545	N544-N547 PolarHBondContact O-N 3.3Å; N544-N547 PolarHBondContact OD1-N 2.98Å; S545-N547 VanDerWaalsContact C-N 3.31Å
548	E	78.1	Confident	82.8	Confident	88 Å²	88	58.7 Å²	58.7	41%	0.411	30%	0.297	S	S	.	.			trans	-77.8	135.9	172.7	-60.1	169.8	149.8	0	0	108.7	L522 R543 N544 R546	L522-E548 HydrophobicContact CD1-CB 3.61Å; R543-E548 VanDerWaalsContact CA-O 3.29Å; R543-E548 WeakPolarHBondContact CA-O 3.28Å; N544-E548 PolarHBondContact N-O 3.42Å; N544-E548 PolarHBondContact ND2-OE2 3.11Å; N544-E548 WeakPolarHBondContact OD1-CB 3.45Å; N544-E548 PolarHBondContact OD1-N 3.18Å; N544-E548 PolarHBondContact OD1-O 2.94Å; R546-E548 HydrophobicContact CB-CG 4.22Å; R546-E548 IonicContact CZ-OE2 3.29Å; R546-E548 VanDerWaalsContact CZ-OE2 3.29Å; R546-E548 IonicContact NE-OE2 3.47Å; R546-E548 PolarHBondContact NE-OE2 2.95Å; R546-E548 IonicContact NH1-OE2 3.63Å; R546-E548 IonicContact NH2-OE2 3.28Å; R546-E548 PolarHBondContact O-N 3.49Å
549	Q	86.9	Confident	83.2	Confident	94 Å²	94	58.9 Å²	58.9	44%	0.439	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	137.6	179.2	-75.2	172.4	60.6	0	0	110.1	L541 V542 R543	L541-Q549 HydrophobicContact CD1-CB 4.29Å; V542-Q549 VanDerWaalsContact O-CA 3.3Å; V542-Q549 WeakPolarHBondContact O-CA 3.16Å; R543-Q549 HydrophobicContact CB-CG 3.89Å; R543-Q549 HydrophobicContact CG-CG 3.96Å
550	G	84.1	Confident	82.4	Confident	2 Å²	2	58.5 Å²	58.5	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	168.5	171.7	0	0	0	0	0	111	Q520 V542	Q520-G550 CarbonylContact O-C 3.52Å; Q520-G550 WeakPolarHBondContact O-CA 3.24Å; V542-G550 WeakPolarHBondContact CG2-O 3.3Å; V542-G550 PolarHBondContact N-O 2.9Å; V542-G550 PolarHBondContact O-N 3.22Å
551	N	85.4	Confident	80.6	Confident	38 Å²	38	64.6 Å²	64.6	20%	0.203	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	134.4	-175.9	-69.1	-48.6	0	0	0	109.7	Q520 E521 L522 W539 W540	Q520-N551 VanDerWaalsContact O-CB 3.32Å; Q520-N551 WeakPolarHBondContact O-CB 3.31Å; Q520-N551 PolarHBondContact O-N 3.36Å; Q520-N551 PolarHBondContact O-ND2 3.39Å; E521-N551 WeakPolarHBondContact CA-O 3.42Å; L522-N551 PolarHBondContact N-O 2.97Å; W539-N551 HydrophobicContact CB-CB 3.89Å; W539-N551 HydrophobicContact CD2-CB 4.39Å; W539-N551 HydrophobicContact CE3-CB 3.86Å; W539-N551 HydrophobicContact CG-CB 4.45Å; W540-N551 CarbonylContact O-C 3.54Å; W540-N551 WeakPolarHBondContact O-CA 3.47Å
552	V	83.4	Confident	78.5	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	149.9	169.8	-60.6	0	0	0	0	109.4	F514 L522 V524 W540 V542 I556 L557	F514-V552 HydrophobicContact CD1-CG1 3.95Å; F514-V552 HydrophobicContact CE1-CG1 4.17Å; L522-V552 HydrophobicContact CB-CG1 4.14Å; V524-V552 HydrophobicContact CG1-CG1 4.28Å; V524-V552 HydrophobicContact CG2-CG1 4.15Å; W540-V552 PolarHBondContact N-O 3.07Å; W540-V552 PolarHBondContact O-N 3.06Å; V542-V552 HydrophobicContact CB-CG2 4.15Å; V542-V552 HydrophobicContact CG1-CG2 3.56Å; V542-V552 HydrophobicContact CG2-CB 4.19Å; V542-V552 HydrophobicContact CG2-CG1 3.69Å; V542-V552 HydrophobicContact CG2-CG2 3.45Å; V542-V552 VanDerWaalsContact CG2-CG2 3.45Å; V552-I556 HydrophobicContact CB-CD1 4.09Å; V552-I556 HydrophobicContact CB-CG1 4.47Å; V552-L557 HydrophobicContact CG2-CD1 3.81Å; V552-L557 HydrophobicContact CG2-CD2 4.2Å; V552-L557 HydrophobicContact CG2-CG 4.18Å
553	P	81.9	Confident	75.7	Confident	26 Å²	26	77.6 Å²	77.6	17%	0.169	40%	0.396	C	S	.	.			trans	-72.5	140.5	177.6	30.2	-32.8	0	0	0	110.3	F514 N555 I556	F514-P553 HydrophobicContact CD2-CG 4.32Å; F514-P553 HydrophobicContact CE2-CG 4.28Å; P553-N555 VanDerWaalsContact CB-OD1 3.27Å; P553-N555 WeakPolarHBondContact CB-OD1 3.2Å; P553-N555 PolarHBondContact O-N 2.78Å; P553-I556 HydrophobicContact CG-CG1 4.15Å; P553-I556 HydrophobicContact CG-CG2 4.29Å; P553-I556 WeakPolarHBondContact O-CG1 3.47Å; P553-I556 PolarHBondContact O-N 2.98Å
554	P	79.8	Confident	73.1	Confident	46 Å²	46	83.6 Å²	83.6	30%	0.299	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-67.8	-22.8	-171.7	25.3	-34.3	0	0	0	114.1	P538 W540 I556 L557	P538-P554 WeakPolarHBondContact O-CD 3.44Å; W540-P554 HydrophobicContact CD2-CB 3.78Å; W540-P554 HydrophobicContact CE3-CB 4.33Å; W540-P554 HydrophobicContact CG-CB 4.07Å; W540-P554 HydrophobicContact CH2-CB 4.41Å; W540-P554 HydrophobicContact CZ2-CB 3.88Å; P554-I556 PolarHBondContact O-N 3.3Å; P554-L557 PolarHBondContact O-N 2.9Å
555	N	82.9	Confident	70.4	Confident	123 Å²	123	88.7 Å²	88.7	66%	0.658	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-66.6	-12.4	178.3	65.3	-23.7	0	0	0	113.9	P553	P553-N555 VanDerWaalsContact CB-OD1 3.27Å; P553-N555 WeakPolarHBondContact CB-OD1 3.2Å; P553-N555 PolarHBondContact O-N 2.78Å
556	I	84.9	Confident	68.3	Low	13 Å²	13	89.3 Å²	89.3	7%	0.067	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-97	6.5	173.7	67.5	147.3	0	0	0	112.9	V510 M511 Y512 F514 V524 V552 P553 P554	V510-I556 CarbonylContact C-O 3.48Å; V510-I556 VanDerWaalsContact CA-O 3.28Å; V510-I556 WeakPolarHBondContact CA-O 3.3Å; V510-I556 HydrophobicContact CG1-CD1 4.24Å; M511-I556 PolarHBondContact N-O 3.48Å; Y512-I556 HydrophobicContact CD2-CG2 4.25Å; F514-I556 HydrophobicContact CB-CD1 3.55Å; F514-I556 HydrophobicContact CG-CD1 4.01Å; V524-I556 HydrophobicContact CG2-CD1 3.73Å; V552-I556 HydrophobicContact CB-CD1 4.09Å; V552-I556 HydrophobicContact CB-CG1 4.47Å; P553-I556 HydrophobicContact CG-CG1 4.15Å; P553-I556 HydrophobicContact CG-CG2 4.29Å; P553-I556 WeakPolarHBondContact O-CG1 3.47Å; P553-I556 PolarHBondContact O-N 2.98Å; P554-I556 PolarHBondContact O-N 3.3Å
557	L	83.1	Confident	66.1	Low	16 Å²	16	90.8 Å²	90.8	8%	0.084	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134.9	-177.5	-58.3	178	0	0	0	111.7	M508 R509 V510 V530 W540 V542 V552 P554	M508-L557 HydrophobicContact CB-CB 4.14Å; M508-L557 HydrophobicContact CE-CB 4.01Å; M508-L557 HydrophobicContact SD-CB 3.98Å; M508-L557 HydrophobicContact SD-CD1 4.28Å; R509-L557 CarbonylContact O-C 3.48Å; R509-L557 WeakPolarHBondContact O-CA 3.35Å; V510-L557 HydrophobicContact CG2-CD2 3.87Å; V530-L557 HydrophobicContact CG2-CD2 3.56Å; W540-L557 HydrophobicContact CE3-CD1 3.95Å; V542-L557 HydrophobicContact CG1-CD1 3.76Å; V552-L557 HydrophobicContact CG2-CD1 3.81Å; V552-L557 HydrophobicContact CG2-CD2 4.2Å; V552-L557 HydrophobicContact CG2-CG 4.18Å; P554-L557 PolarHBondContact O-N 2.9Å
558	E	83.4	Confident	63.8	Low	74 Å²	74	92.6 Å²	92.6	35%	0.346	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.4	176.4	-176.7	-175.6	-139.5	0	0	110.3	M508 R509 M511 V560	M508-E558 CarbonylContact C-O 3.58Å; M508-E558 WeakPolarHBondContact CA-O 3.36Å; M508-E558 VanDerWaalsContact CB-O 3.25Å; M508-E558 WeakPolarHBondContact CB-O 3.42Å; R509-E558 IonicContact CZ-OE2 3.38Å; R509-E558 PolarHBondContact N-O 3.24Å; R509-E558 IonicContact NE-OE2 3.24Å; R509-E558 PolarHBondContact NE-OE2 2.89Å; R509-E558 IonicContact NH2-OE2 2.69Å; R509-E558 PolarHBondContact NH2-OE2 3.33Å; R509-E558 PolarHBondContact O-N 2.92Å; M511-E558 HydrophobicContact CG-CB 3.76Å; M511-E558 HydrophobicContact SD-CB 3.73Å; M511-E558 HydrophobicContact SD-CG 4.33Å; E558-V560 PolarHBondContact O-N 2.92Å
559	Q	72.8	Confident	61.8	Low	106 Å²	106	97.8 Å²	97.8	50%	0.495	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129.4	179.3	-69.1	-172.2	-56.2	0	0	110.4	L506 M508 E561	L506-Q559 HydrophobicContact CD1-CG 4.41Å; M508-Q559 HydrophobicContact CE-CB 4.23Å; M508-Q559 HydrophobicContact CE-CG 3.26Å; M508-Q559 HydrophobicContact CG-CG 4.29Å; M508-Q559 HydrophobicContact SD-CG 4.28Å; Q559-E561 PolarHBondContact O-N 3.1Å
560	V	66.2	Low	59.3	Low	71 Å²	71	104.6 Å²	104.6	43%	0.43	54%	0.536	S	S	.	.			trans	-91.1	99.4	170.2	-173.4	0	0	0	0	106.6	R509 E558 N562	R509-V560 HydrophobicContact CB-CG2 3.87Å; E558-V560 PolarHBondContact O-N 2.92Å; V560-N562 PolarHBondContact O-N 2.8Å
561	E	48.9	Very low	56.7	Low	177 Å²	177	112.9 Å²	112.9	83%	0.827	57%	0.567	S	S	*	*			trans	-66.5	111.8	179.2	-71.8	-177.7	165.9	0	0	110.7	Q559	Q559-E561 PolarHBondContact O-N 3.1Å
562	N	41.8	Very low	54	Low	148 Å²	148	119.1 Å²	119.1	79%	0.791	60%	0.6	S	S	*	*			trans	-96.9	103.3	160.8	-87.2	-13.9	0	0	0	107.8	V560	V560-N562 PolarHBondContact O-N 2.8Å
563	N	31.4	Very low	51.6	Low	160 Å²	160	123.7 Å²	123.7	86%	0.856	63%	0.632	S	S	*	*			trans	-145.3	104.5	155.3	-108.4	-8	0	0	0	109.9	S565	N563-S565 PolarHBondContact O-N 2.84Å
564	E	32.2	Very low	49.3	Very low	196 Å²	196	132.1 Å²	132.1	92%	0.916	66%	0.661	S	S	*	*			trans	-70	112.1	159.5	-64.1	178.2	112.9	0	0	108.8
565	S	29.7	Very low	47.3	Very low	112 Å²	112	134.1 Å²	134.1	78%	0.783	68%	0.676	S	S	*	*			trans	-178.7	118.7	139.6	49.1	0	0	0	0	110.7	N563	N563-S565 PolarHBondContact O-N 2.84Å
566	S	37.8	Very low	45.6	Very low	114 Å²	114	135.4 Å²	135.4	80%	0.797	68%	0.678	S	S	*	*			trans	-43	126.4	-179.9	-44.8	0	0	0	0	116.3
567	E	34.2	Very low	44.6	Very low	182 Å²	182	137.9 Å²	137.9	85%	0.85	69%	0.693	S	S	*	*				162.2	75	126.3	-88.6	-174.4	164.7	0	0	109.3
568	D	31.3	Very low	44.2	Very low	159 Å²	159	141.4 Å²	141.4	85%	0.85	72%	0.715	S	S	*	*			trans	-167.8	66.9	152	-99.7	-23.8	0	0	0	109.8	R570	D568-R570 PolarHBondContact O-N 3.45Å
569	Q	36.3	Very low	44.4	Very low	197 Å²	197	138.1 Å²	138.1	92%	0.921	70%	0.7	S	S	*	*			trans	-78.7	48.2	173.5	-84	-179.6	13	0	0	112.8
570	R	33	Very low	45	Very low	236 Å²	236	135.9 Å²	135.9	89%	0.891	69%	0.692	S	S	*	*			trans	-146.8	59.3	172.3	-71.5	-166.1	179	-179.1	0.7	113.6	D568	D568-R570 PolarHBondContact O-N 3.45Å
571	W	29.6	Very low	46	Very low	176 Å²	176	137.9 Å²	137.9	67%	0.667	69%	0.692	S	S	*	*			trans	-151.9	3.3	155.9	-167.9	-106.5	0	0	0	116	S573 R574	W571-S573 PolarHBondContact O-N 3.05Å; W571-R574 HydrophobicContact CH2-CG 4.27Å; W571-R574 HydrophobicContact CZ2-CG 3.66Å
572	D	30	Very low	47.8	Very low	170 Å²	170	136.6 Å²	136.6	91%	0.909	69%	0.691	S	S	*	*	S	Bend	trans	-79.3	67.4	171.7	-153.6	7.8	0	0	0	110.7
573	S	31.7	Very low	50	Low	96 Å²	96	129.8 Å²	129.8	67%	0.671	66%	0.655	S	S	*	*			trans	-172.7	62.7	167.5	-74	0	0	0	0	109.4	W571 S575	W571-S573 PolarHBondContact O-N 3.05Å; S573-S575 PolarHBondContact O-N 3.42Å; S573-S575 PolarHBondContact O-OG 2.86Å
574	R	33.9	Very low	52.8	Low	203 Å²	203	124.5 Å²	124.5	77%	0.766	63%	0.631	S	S	*	*			trans	-76.9	68.4	146	-89.4	-171.2	169.4	155.9	7.9	107.7	W571 Q576	W571-R574 HydrophobicContact CH2-CG 4.27Å; W571-R574 HydrophobicContact CZ2-CG 3.66Å; R574-Q576 PolarHBondContact O-N 3.3Å
575	S	38.3	Very low	55.4	Low	88 Å²	88	117.7 Å²	117.7	62%	0.615	61%	0.605	S	S	*	*			trans	-39	123.4	150.3	45.8	0	0	0	0	108	S573 V577	S573-S575 PolarHBondContact O-N 3.42Å; S573-S575 PolarHBondContact O-OG 2.86Å; S575-V577 PolarHBondContact O-N 3.28Å
576	Q	47.5	Very low	58.2	Low	149 Å²	149	115.6 Å²	115.6	70%	0.696	60%	0.595	S	S	*	*			trans	-31.3	109.4	160.3	-170.9	176.5	-3.9	0	0	108.9	R574 T578	R574-Q576 PolarHBondContact O-N 3.3Å; Q576-T578 VanDerWaalsContact C-N 3.3Å; Q576-T578 HydrophobicContact CB-CG2 4.25Å; Q576-T578 HydrophobicContact CG-CG2 3.8Å; Q576-T578 PolarHBondContact O-N 3.24Å
577	V	62.7	Low	60.6	Low	66 Å²	66	114.9 Å²	114.9	40%	0.4	58%	0.579	S	S	.	*			trans	-66.5	100	174.3	-179.4	0	0	0	0	104.8	S575 W591	S575-V577 PolarHBondContact O-N 3.28Å; V577-W591 HydrophobicContact CG1-CB 3.99Å; V577-W591 VanDerWaalsContact O-CD1 3.23Å
578	T	74.7	Confident	63.3	Low	89 Å²	89	106.2 Å²	106.2	55%	0.546	54%	0.538	S	S	.	.			trans	-95.8	122.2	-179.2	49.3	0	0	0	0	108.6	Q576	Q576-T578 VanDerWaalsContact C-N 3.3Å; Q576-T578 HydrophobicContact CB-CG2 4.25Å; Q576-T578 HydrophobicContact CG-CG2 3.8Å; Q576-T578 PolarHBondContact O-N 3.24Å
579	L	87.9	Confident	66.1	Low	6 Å²	6	103.1 Å²	103.1	3%	0.031	52%	0.517	C	S	.	.			trans	-81.2	131.1	174.2	179.8	72.2	0	0	0	109.5	V588 W591 L613 L614 L636 V639	L579-V588 HydrophobicContact CD1-CB 4.46Å; L579-V588 HydrophobicContact CD1-CG2 3.68Å; L579-W591 HydrophobicContact CB-CD2 3.98Å; L579-W591 HydrophobicContact CB-CG 3.83Å; L579-W591 HydrophobicContact CD2-CD2 3.98Å; L579-W591 HydrophobicContact CD2-CE3 3.94Å; L579-W591 HydrophobicContact CD2-CH2 4.23Å; L579-W591 HydrophobicContact CD2-CZ2 4.27Å; L579-W591 HydrophobicContact CD2-CZ3 4.07Å; L579-W591 HydrophobicContact CG-CD2 4.47Å; L579-L613 HydrophobicContact CD2-CD2 4.27Å; L579-L614 HydrophobicContact CD2-CD2 4.05Å; L579-L614 HydrophobicContact CD2-CG 4.24Å; L579-L614 HydrophobicContact CG-CD1 4.43Å; L579-L636 HydrophobicContact CD2-CD2 3.45Å; L579-L636 VanDerWaalsContact CD2-CD2 3.45Å; L579-V639 HydrophobicContact CB-CG1 4.12Å; L579-V639 HydrophobicContact CB-CG2 4.48Å; L579-V639 HydrophobicContact CD2-CG1 4.39Å; L579-V639 HydrophobicContact CG-CG1 4.38Å; L579-V639 WeakPolarHBondContact O-CG1 3.5Å
580	D	86.3	Confident	68.5	Low	59 Å²	59	95.7 Å²	95.7	32%	0.316	49%	0.489	S	S	.	.			trans	-133.4	179.8	175.3	71.6	14.2	0	0	0	112.1	N582 S583 G610 L643	D580-N582 PolarHBondContact O-N 3.26Å; D580-N582 WeakPolarHBondContact OD1-CA 3.25Å; D580-N582 PolarHBondContact OD1-N 2.88Å; D580-S583 PolarHBondContact N-OG 3.08Å; D580-S583 PolarHBondContact O-N 3.47Å; D580-S583 PolarHBondContact O-OG 2.9Å; D580-S583 PolarHBondContact OD1-N 2.85Å; D580-S583 PolarHBondContact OD1-OG 3.41Å; D580-G610 WeakPolarHBondContact O-CA 3.44Å; D580-L643 HydrophobicContact CB-CD2 3.98Å
581	Y	87.6	Confident	71.3	Confident	112 Å²	112	84.6 Å²	84.6	44%	0.439	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-18.1	178.5	-75.3	-80.7	0	0	0	113.7	K611 L614 L643	Y581-K611 WeakPolarHBondContact O-CB 3.34Å; Y581-K611 PolarHBondContact O-N 3.02Å; Y581-L614 HydrophobicContact CD1-CB 4.31Å; Y581-L614 HydrophobicContact CD1-CD1 4.17Å; Y581-L614 HydrophobicContact CD2-CD1 4.4Å; Y581-L614 HydrophobicContact CE1-CB 3.9Å; Y581-L614 HydrophobicContact CE1-CD1 4.28Å; Y581-L614 HydrophobicContact CE2-CD1 4.5Å; Y581-L614 HydrophobicContact CG-CD1 4.23Å; Y581-L643 HydrophobicContact CD2-CD1 3.96Å; Y581-L643 HydrophobicContact CE2-CD1 3.93Å
582	N	85.1	Confident	74.2	Confident	150 Å²	150	76.2 Å²	76.2	80%	0.802	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-1.5	-177.4	-66.7	-16	0	0	0	113	D580 S584	D580-N582 PolarHBondContact O-N 3.26Å; D580-N582 WeakPolarHBondContact OD1-CA 3.25Å; D580-N582 PolarHBondContact OD1-N 2.88Å; N582-S584 PolarHBondContact O-N 2.86Å
583	S	90	Very high	77	Confident	5 Å²	5	73.3 Å²	73.3	4%	0.035	40%	0.397	C	S	.	.			trans	-61.5	133.1	-175.9	-59.6	0	0	0	0	111.7	D580 E587 G610	D580-S583 PolarHBondContact N-OG 3.08Å; D580-S583 PolarHBondContact O-N 3.47Å; D580-S583 PolarHBondContact O-OG 2.9Å; D580-S583 PolarHBondContact OD1-N 2.85Å; D580-S583 PolarHBondContact OD1-OG 3.41Å; S583-E587 WeakPolarHBondContact CA-OE2 3.47Å; S583-G610 PolarHBondContact O-N 2.87Å
584	S	88.7	Confident	79.5	Confident	50 Å²	50	72.2 Å²	72.2	35%	0.35	39%	0.389	S	S	.	.			trans	-69.9	162.9	173.1	65.7	0	0	0	0	111.6	N582 A586 E587 V588	N582-S584 PolarHBondContact O-N 2.86Å; S584-A586 PolarHBondContact O-N 2.83Å; S584-E587 WeakPolarHBondContact CB-OE2 3.36Å; S584-E587 PolarHBondContact N-OE2 3.35Å; S584-E587 PolarHBondContact O-N 2.87Å; S584-E587 VanDerWaalsContact O-N 3.1Å; S584-E587 WeakPolarHBondContact OG-CG 3.33Å; S584-E587 PolarHBondContact OG-N 3.33Å; S584-E587 PolarHBondContact OG-OE2 2.94Å; S584-V588 WeakPolarHBondContact O-CG2 3.2Å; S584-V588 PolarHBondContact O-N 2.69Å
585	S	88.1	Confident	82	Confident	53 Å²	53	67.2 Å²	67.2	37%	0.371	37%	0.373	S	S	.	.	H	α-helix	trans	-60.3	-32.7	176.2	53	0	0	0	0	112.9	V588 K589 G606 L608	S585-V588 PolarHBondContact O-N 3.09Å; S585-K589 VanDerWaalsContact O-CB 3.28Å; S585-K589 WeakPolarHBondContact O-CB 3.2Å; S585-K589 PolarHBondContact O-N 2.81Å; S585-G606 CarbonylContact C-O 3.57Å; S585-G606 WeakPolarHBondContact CB-O 3.33Å; S585-L608 WeakPolarHBondContact CA-O 3.34Å
586	A	87.3	Confident	84.2	Confident	68 Å²	68	66 Å²	66	56%	0.562	37%	0.374	S	S	*	.	H	α-helix	trans	-64.3	-41.1	173.7	0	0	0	0	0	112.3	S584 K589 A590	S584-A586 PolarHBondContact O-N 2.83Å; A586-K589 PolarHBondContact O-N 3.37Å; A586-A590 WeakPolarHBondContact O-CB 3.24Å; A586-A590 PolarHBondContact O-N 3.01Å
587	E	87.7	Confident	86.3	Confident	99 Å²	99	60 Å²	60	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-71	-38.1	176.6	-71.1	162.2	141.4	0	0	111.8	S583 S584 K589 A590 W591	S583-E587 WeakPolarHBondContact CA-OE2 3.47Å; S584-E587 WeakPolarHBondContact CB-OE2 3.36Å; S584-E587 PolarHBondContact N-OE2 3.35Å; S584-E587 PolarHBondContact O-N 2.87Å; S584-E587 VanDerWaalsContact O-N 3.1Å; S584-E587 WeakPolarHBondContact OG-CG 3.33Å; S584-E587 PolarHBondContact OG-N 3.33Å; S584-E587 PolarHBondContact OG-OE2 2.94Å; E587-K589 VanDerWaalsContact C-N 3.35Å; E587-A590 PolarHBondContact O-N 3.5Å; E587-W591 VanDerWaalsContact O-CB 3.26Å; E587-W591 WeakPolarHBondContact O-CB 3.28Å; E587-W591 PolarHBondContact O-N 3.02Å
588	V	91.1	Very high	87.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-61.1	-45.8	172.5	172.5	0	0	0	0	110.7	L579 S584 S585 W591 L592 L608 L613	L579-V588 HydrophobicContact CD1-CB 4.46Å; L579-V588 HydrophobicContact CD1-CG2 3.68Å; S584-V588 WeakPolarHBondContact O-CG2 3.2Å; S584-V588 PolarHBondContact O-N 2.69Å; S585-V588 PolarHBondContact O-N 3.09Å; V588-W591 PolarHBondContact O-N 3.5Å; V588-L592 HydrophobicContact CG1-CD1 4Å; V588-L592 HydrophobicContact CG1-CG 4.48Å; V588-L592 VanDerWaalsContact O-CG 3.31Å; V588-L592 WeakPolarHBondContact O-CG 3.5Å; V588-L592 PolarHBondContact O-N 3.25Å; V588-L608 WeakPolarHBondContact CB-O 3.5Å; V588-L608 WeakPolarHBondContact CG2-O 3.36Å; V588-L613 HydrophobicContact CG1-CD2 3.42Å; V588-L613 VanDerWaalsContact CG1-CD2 3.42Å
589	K	90.2	Very high	88	Confident	93 Å²	93	64.5 Å²	64.5	40%	0.404	35%	0.352	S	S	.	.	H	α-helix	trans	-61.7	-48.8	176.9	-172.3	-179.7	176.7	-178.9	0	111.3	S585 A586 E587 W591 L592 E593 V602	S585-K589 VanDerWaalsContact O-CB 3.28Å; S585-K589 WeakPolarHBondContact O-CB 3.2Å; S585-K589 PolarHBondContact O-N 2.81Å; A586-K589 PolarHBondContact O-N 3.37Å; E587-K589 VanDerWaalsContact C-N 3.35Å; K589-W591 VanDerWaalsContact C-N 3.28Å; K589-W591 PolarHBondContact O-N 2.99Å; K589-L592 PolarHBondContact O-N 2.91Å; K589-E593 WeakPolarHBondContact CE-OE1 3.39Å; K589-E593 WeakPolarHBondContact O-CG 3.42Å; K589-E593 PolarHBondContact O-N 3.37Å; K589-V602 HydrophobicContact CG-CG1 3.7Å
590	A	86.3	Confident	87.9	Confident	41 Å²	41	69.9 Å²	69.9	34%	0.339	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-36.7	176.9	0	0	0	0	0	112.1	A586 E587 S594	A586-A590 WeakPolarHBondContact O-CB 3.24Å; A586-A590 PolarHBondContact O-N 3.01Å; E587-A590 PolarHBondContact O-N 3.5Å; A590-S594 VanDerWaalsContact O-CB 3.28Å; A590-S594 WeakPolarHBondContact O-CB 3.5Å; A590-S594 PolarHBondContact O-N 3.33Å; A590-S594 PolarHBondContact O-OG 3.01Å
591	W	92.6	Very high	87.9	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.015	37%	0.365	C	S	.	.	H	α-helix	trans	-65.1	-48.6	174.4	-178.4	85.9	0	0	0	111.5	V577 L579 E587 V588 K589 E593 S594 K595 F597 Q635 L636 V639	V577-W591 HydrophobicContact CG1-CB 3.99Å; V577-W591 VanDerWaalsContact O-CD1 3.23Å; L579-W591 HydrophobicContact CB-CD2 3.98Å; L579-W591 HydrophobicContact CB-CG 3.83Å; L579-W591 HydrophobicContact CD2-CD2 3.98Å; L579-W591 HydrophobicContact CD2-CE3 3.94Å; L579-W591 HydrophobicContact CD2-CH2 4.23Å; L579-W591 HydrophobicContact CD2-CZ2 4.27Å; L579-W591 HydrophobicContact CD2-CZ3 4.07Å; L579-W591 HydrophobicContact CG-CD2 4.47Å; E587-W591 VanDerWaalsContact O-CB 3.26Å; E587-W591 WeakPolarHBondContact O-CB 3.28Å; E587-W591 PolarHBondContact O-N 3.02Å; V588-W591 PolarHBondContact O-N 3.5Å; K589-W591 VanDerWaalsContact C-N 3.28Å; K589-W591 PolarHBondContact O-N 2.99Å; W591-E593 VanDerWaalsContact C-N 3.32Å; W591-E593 PolarHBondContact O-N 3.45Å; W591-S594 PolarHBondContact O-N 3.18Å; W591-S594 PolarHBondContact O-OG 3.4Å; W591-K595 HydrophobicContact CD2-CG 4.13Å; W591-K595 HydrophobicContact CE3-CG 4.47Å; W591-K595 HydrophobicContact CH2-CG 4.4Å; W591-K595 HydrophobicContact CZ2-CD 4.42Å; W591-K595 HydrophobicContact CZ2-CG 4.03Å; W591-K595 VanDerWaalsContact O-CG 3.3Å; W591-K595 WeakPolarHBondContact O-CG 2.94Å; W591-K595 PolarHBondContact O-N 2.89Å; W591-F597 HydrophobicContact CH2-CE2 4.42Å; W591-F597 HydrophobicContact CZ3-CE2 4.11Å; W591-Q635 HydrophobicContact CH2-CB 3.66Å; W591-Q635 HydrophobicContact CZ2-CB 4.08Å; W591-L636 HydrophobicContact CH2-CD2 3.89Å; W591-L636 HydrophobicContact CH2-CG 4.4Å; W591-L636 HydrophobicContact CZ3-CD2 3.94Å; W591-V639 HydrophobicContact CZ2-CG2 3.68Å
592	L	90.3	Very high	88.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.8	-41	177.9	-70.1	167.8	0	0	0	111.7	V588 K589 K595 G596 F597 V602 L605	V588-L592 HydrophobicContact CG1-CD1 4Å; V588-L592 HydrophobicContact CG1-CG 4.48Å; V588-L592 VanDerWaalsContact O-CG 3.31Å; V588-L592 WeakPolarHBondContact O-CG 3.5Å; V588-L592 PolarHBondContact O-N 3.25Å; K589-L592 PolarHBondContact O-N 2.91Å; L592-K595 PolarHBondContact O-N 3.46Å; L592-G596 PolarHBondContact O-N 3.31Å; L592-F597 HydrophobicContact CB-CD2 4.2Å; L592-F597 HydrophobicContact CD2-CD2 3.55Å; L592-F597 HydrophobicContact CD2-CE2 3.83Å; L592-F597 HydrophobicContact CD2-CG 4.43Å; L592-F597 WeakPolarHBondContact O-CD2 3.47Å; L592-F597 PolarHBondContact O-N 3.27Å; L592-V602 HydrophobicContact CB-CG2 3.92Å; L592-L605 HydrophobicContact CD1-CB 3.67Å
593	E	88.9	Confident	88.1	Confident	109 Å²	109	58.6 Å²	58.6	51%	0.509	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-44	174.3	-71.7	173.6	176.5	0	0	111.5	K589 W591 K595 G596 V602	K589-E593 WeakPolarHBondContact CE-OE1 3.39Å; K589-E593 WeakPolarHBondContact O-CG 3.42Å; K589-E593 PolarHBondContact O-N 3.37Å; W591-E593 VanDerWaalsContact C-N 3.32Å; W591-E593 PolarHBondContact O-N 3.45Å; E593-K595 PolarHBondContact O-N 3.24Å; E593-G596 PolarHBondContact O-N 3.17Å; E593-V602 HydrophobicContact CG-CB 4.42Å; E593-V602 HydrophobicContact CG-CG1 3.52Å; E593-V602 HydrophobicContact CG-CG2 3.99Å
594	S	85.3	Confident	88	Confident	73 Å²	73	60.6 Å²	60.6	51%	0.51	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-25.2	178.3	77.9	0	0	0	0	113.4	A590 W591	A590-S594 VanDerWaalsContact O-CB 3.28Å; A590-S594 WeakPolarHBondContact O-CB 3.5Å; A590-S594 PolarHBondContact O-N 3.33Å; A590-S594 PolarHBondContact O-OG 3.01Å; W591-S594 PolarHBondContact O-N 3.18Å; W591-S594 PolarHBondContact O-OG 3.4Å
595	K	84.6	Confident	88.1	Confident	98 Å²	98	58.2 Å²	58.2	43%	0.426	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-6.7	177.1	-68.4	-68.9	-179.1	169.2	0	113.4	W591 L592 E593 F597	W591-K595 HydrophobicContact CD2-CG 4.13Å; W591-K595 HydrophobicContact CE3-CG 4.47Å; W591-K595 HydrophobicContact CH2-CG 4.4Å; W591-K595 HydrophobicContact CZ2-CD 4.42Å; W591-K595 HydrophobicContact CZ2-CG 4.03Å; W591-K595 VanDerWaalsContact O-CG 3.3Å; W591-K595 WeakPolarHBondContact O-CG 2.94Å; W591-K595 PolarHBondContact O-N 2.89Å; L592-K595 PolarHBondContact O-N 3.46Å; E593-K595 PolarHBondContact O-N 3.24Å; K595-F597 HydrophobicContact CB-CD2 3.77Å; K595-F597 HydrophobicContact CB-CE2 3.52Å; K595-F597 HydrophobicContact CB-CZ 4.36Å; K595-F597 HydrophobicContact CG-CE2 4.25Å
596	G	86.1	Confident	88.1	Confident	63 Å²	63	56 Å²	56	65%	0.649	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	27.1	175.8	0	0	0	0	0	114.7	L592 E593	L592-G596 PolarHBondContact O-N 3.31Å; E593-G596 PolarHBondContact O-N 3.17Å
597	F	91.2	Very high	88.2	Confident	22 Å²	22	57.8 Å²	57.8	10%	0.096	32%	0.32	C	S	.	.			trans	-71.3	155.3	173	-66	-66.3	0	0	0	111.8	W591 L592 K595 T601 V602 K631 V632 Q635	W591-F597 HydrophobicContact CH2-CE2 4.42Å; W591-F597 HydrophobicContact CZ3-CE2 4.11Å; L592-F597 HydrophobicContact CB-CD2 4.2Å; L592-F597 HydrophobicContact CD2-CD2 3.55Å; L592-F597 HydrophobicContact CD2-CE2 3.83Å; L592-F597 HydrophobicContact CD2-CG 4.43Å; L592-F597 WeakPolarHBondContact O-CD2 3.47Å; L592-F597 PolarHBondContact O-N 3.27Å; K595-F597 HydrophobicContact CB-CD2 3.77Å; K595-F597 HydrophobicContact CB-CE2 3.52Å; K595-F597 HydrophobicContact CB-CZ 4.36Å; K595-F597 HydrophobicContact CG-CE2 4.25Å; F597-T601 HydrophobicContact CB-CG2 3.91Å; F597-T601 HydrophobicContact CD1-CG2 4.49Å; F597-T601 HydrophobicContact CG-CG2 4.23Å; F597-V602 HydrophobicContact CB-CG2 4.28Å; F597-K631 HydrophobicContact CE1-CB 3.93Å; F597-V632 HydrophobicContact CD1-CG2 3.68Å; F597-V632 HydrophobicContact CE1-CB 4.24Å; F597-V632 HydrophobicContact CE1-CG2 3.5Å; F597-V632 HydrophobicContact CE2-CG2 4.38Å; F597-V632 HydrophobicContact CG-CG2 4.2Å; F597-V632 HydrophobicContact CZ-CB 4.29Å; F597-V632 HydrophobicContact CZ-CG2 3.88Å; F597-Q635 HydrophobicContact CZ-CB 4.2Å; F597-Q635 HydrophobicContact CZ-CG 3.89Å
598	S	88.5	Confident	88.4	Confident	41 Å²	41	55 Å²	55	29%	0.287	31%	0.308	S	S	.	.			trans	-57.2	154.4	178.7	73.1	0	0	0	0	112.6	I600 T601 V602 E628	S598-I600 PolarHBondContact O-N 3.38Å; S598-I600 VanDerWaalsContact O-N 3.16Å; S598-T601 PolarHBondContact O-N 3.12Å; S598-T601 VanDerWaalsContact O-N 3.09Å; S598-T601 PolarHBondContact OG-N 3.04Å; S598-T601 PolarHBondContact OG-OG1 3.3Å; S598-T601 VanDerWaalsContact OG-OG1 3.09Å; S598-V602 WeakPolarHBondContact O-CG2 3.4Å; S598-V602 PolarHBondContact O-N 3.27Å; S598-E628 WeakPolarHBondContact CB-OE2 3.49Å; S598-E628 PolarHBondContact N-OE1 3.46Å; S598-E628 VanDerWaalsContact N-OE1 3.13Å; S598-E628 PolarHBondContact N-OE2 3.44Å; S598-E628 PolarHBondContact OG-OE2 3.42Å
599	R	85.3	Confident	88.4	Confident	208 Å²	208	57.8 Å²	57.8	79%	0.785	33%	0.325	S	S	*	.	H	α-helix	trans	-57.7	-31.6	178.1	-67.2	-174.4	179.5	-161	0.1	112.8	S603	R599-S603 VanDerWaalsContact O-CB 3.25Å; R599-S603 WeakPolarHBondContact O-CB 3.42Å; R599-S603 PolarHBondContact O-N 3.36Å; R599-S603 PolarHBondContact O-OG 3.49Å
600	I	84.1	Confident	88.4	Confident	119 Å²	119	53.4 Å²	53.4	61%	0.61	31%	0.306	S	S	*	.	H	α-helix	trans	-68.1	-50.1	177.1	-61.4	171.3	0	0	0	109.2	S598 V602 S603 S604	S598-I600 PolarHBondContact O-N 3.38Å; S598-I600 VanDerWaalsContact O-N 3.16Å; I600-V602 PolarHBondContact O-N 3.47Å; I600-S603 PolarHBondContact O-N 3.04Å; I600-S604 WeakPolarHBondContact O-CB 3.42Å; I600-S604 PolarHBondContact O-N 3.48Å; I600-S604 PolarHBondContact O-OG 3.21Å; I600-S604 VanDerWaalsContact O-OG 3.05Å
601	T	87.9	Confident	88.5	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-60.2	-44.8	176.9	-62.7	0	0	0	0	112.2	F597 S598 S603 S604 L605 C625 E628 V632	F597-T601 HydrophobicContact CB-CG2 3.91Å; F597-T601 HydrophobicContact CD1-CG2 4.49Å; F597-T601 HydrophobicContact CG-CG2 4.23Å; S598-T601 PolarHBondContact O-N 3.12Å; S598-T601 VanDerWaalsContact O-N 3.09Å; S598-T601 PolarHBondContact OG-N 3.04Å; S598-T601 PolarHBondContact OG-OG1 3.3Å; S598-T601 VanDerWaalsContact OG-OG1 3.09Å; T601-S603 VanDerWaalsContact C-N 3.33Å; T601-S603 PolarHBondContact O-N 2.88Å; T601-S604 PolarHBondContact O-N 2.72Å; T601-L605 HydrophobicContact CG2-CD1 3.86Å; T601-L605 WeakPolarHBondContact O-CB 3.41Å; T601-L605 PolarHBondContact O-N 3.38Å; T601-C625 HydrophobicContact CG2-CB 4.21Å; T601-C625 VanDerWaalsContact OG1-CB 3.31Å; T601-C625 WeakPolarHBondContact OG1-CB 3.45Å; T601-E628 WeakPolarHBondContact CB-OE2 3.37Å; T601-E628 PolarHBondContact OG1-OE2 3.05Å; T601-V632 HydrophobicContact CG2-CG2 3.55Å
602	V	90.3	Very high	88.3	Confident	7 Å²	7	63 Å²	63	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-60.8	-41.6	175.5	172.3	0	0	0	0	111.3	K589 L592 E593 F597 S598 I600 G606	K589-V602 HydrophobicContact CG-CG1 3.7Å; L592-V602 HydrophobicContact CB-CG2 3.92Å; E593-V602 HydrophobicContact CG-CB 4.42Å; E593-V602 HydrophobicContact CG-CG1 3.52Å; E593-V602 HydrophobicContact CG-CG2 3.99Å; F597-V602 HydrophobicContact CB-CG2 4.28Å; S598-V602 WeakPolarHBondContact O-CG2 3.4Å; S598-V602 PolarHBondContact O-N 3.27Å; I600-V602 PolarHBondContact O-N 3.47Å; V602-G606 WeakPolarHBondContact O-CA 3.36Å; V602-G606 PolarHBondContact O-N 3.25Å
603	S	86.8	Confident	88.4	Confident	75 Å²	75	63 Å²	63	52%	0.524	34%	0.344	S	S	.	.	H	α-helix	trans	-73.3	-38.9	-179.4	-59.1	0	0	0	0	112.4	R599 I600 T601	R599-S603 VanDerWaalsContact O-CB 3.25Å; R599-S603 WeakPolarHBondContact O-CB 3.42Å; R599-S603 PolarHBondContact O-N 3.36Å; R599-S603 PolarHBondContact O-OG 3.49Å; I600-S603 PolarHBondContact O-N 3.04Å; T601-S603 VanDerWaalsContact C-N 3.33Å; T601-S603 PolarHBondContact O-N 2.88Å
604	S	87.9	Confident	88.4	Confident	46 Å²	46	57.9 Å²	57.9	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-76.1	-39.5	-177.9	-64	0	0	0	0	113.1	I600 T601 V607	I600-S604 WeakPolarHBondContact O-CB 3.42Å; I600-S604 PolarHBondContact O-N 3.48Å; I600-S604 PolarHBondContact O-OG 3.21Å; I600-S604 VanDerWaalsContact O-OG 3.05Å; T601-S604 PolarHBondContact O-N 2.72Å; S604-V607 WeakPolarHBondContact O-CG2 3.26Å
605	L	89.9	Confident	88.4	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-97.9	-23.9	-178.5	-64.7	177.5	0	0	0	113.1	L592 T601 V607 L608 L613 M616 I621 V624 V632	L592-L605 HydrophobicContact CD1-CB 3.67Å; T601-L605 HydrophobicContact CG2-CD1 3.86Å; T601-L605 WeakPolarHBondContact O-CB 3.41Å; T601-L605 PolarHBondContact O-N 3.38Å; L605-V607 PolarHBondContact O-N 3.03Å; L605-L608 HydrophobicContact CD2-CD1 3.95Å; L605-L608 VanDerWaalsContact O-CB 3.31Å; L605-L608 WeakPolarHBondContact O-CB 3.41Å; L605-L608 WeakPolarHBondContact O-CG 3.45Å; L605-L608 PolarHBondContact O-N 2.96Å; L605-L613 HydrophobicContact CB-CD1 4.12Å; L605-L613 HydrophobicContact CD1-CD1 4.12Å; L605-L613 HydrophobicContact CD2-CD1 4.02Å; L605-L613 HydrophobicContact CG-CD1 4.34Å; L605-M616 HydrophobicContact CD2-CE 4.11Å; L605-M616 HydrophobicContact CD2-SD 4.1Å; L605-I621 HydrophobicContact CD1-CG2 4.24Å; L605-V624 HydrophobicContact CD2-CG2 3.52Å; L605-V624 HydrophobicContact CG-CG2 4.3Å; L605-V632 HydrophobicContact CD1-CB 4.49Å; L605-V632 HydrophobicContact CD1-CG1 3.67Å; L605-V632 HydrophobicContact CD1-CG2 4.26Å
606	G	87.8	Confident	88.6	Confident	6 Å²	6	53.8 Å²	53.8	6%	0.062	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-7.6	-179.9	0	0	0	0	0	114.7	S585 V602 L608	S585-G606 CarbonylContact C-O 3.57Å; S585-G606 WeakPolarHBondContact CB-O 3.33Å; V602-G606 WeakPolarHBondContact O-CA 3.36Å; V602-G606 PolarHBondContact O-N 3.25Å; G606-L608 VanDerWaalsContact C-N 3.31Å
607	V	90.3	Very high	88.7	Confident	107 Å²	107	53.8 Å²	53.8	65%	0.648	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-14.4	170.2	-63.9	0	0	0	0	112.7	S604 L605	S604-V607 WeakPolarHBondContact O-CG2 3.26Å; L605-V607 PolarHBondContact O-N 3.03Å
608	L	90.6	Very high	88.4	Confident	40 Å²	40	55.4 Å²	55.4	21%	0.209	30%	0.304	C	S	.	.	S	Bend	trans	-85.2	150.9	-177.5	-56	176.9	0	0	0	111.1	S585 V588 L605 G606 L612 L613 M616	S585-L608 WeakPolarHBondContact CA-O 3.34Å; V588-L608 WeakPolarHBondContact CB-O 3.5Å; V588-L608 WeakPolarHBondContact CG2-O 3.36Å; L605-L608 HydrophobicContact CD2-CD1 3.95Å; L605-L608 VanDerWaalsContact O-CB 3.31Å; L605-L608 WeakPolarHBondContact O-CB 3.41Å; L605-L608 WeakPolarHBondContact O-CG 3.45Å; L605-L608 PolarHBondContact O-N 2.96Å; G606-L608 VanDerWaalsContact C-N 3.31Å; L608-L612 HydrophobicContact CB-CB 4.24Å; L608-L612 HydrophobicContact CD2-CD1 4.47Å; L608-L613 HydrophobicContact CB-CB 4.41Å; L608-L613 HydrophobicContact CD1-CD1 4.37Å; L608-M616 HydrophobicContact CD1-CE 4.4Å; L608-M616 HydrophobicContact CD1-SD 3.33Å; L608-M616 WeakPolarHBondContact CD1-SD 3.46Å
609	T	92.4	Very high	88.2	Confident	59 Å²	59	59.3 Å²	59.3	36%	0.362	32%	0.318	S	S	.	.			trans	-77.8	157.8	167.7	58.5	0	0	0	0	110.9	K611 L612 L613	T609-K611 VanDerWaalsContact C-N 3.26Å; T609-K611 PolarHBondContact O-N 2.99Å; T609-L612 WeakPolarHBondContact O-CA 3.46Å; T609-L612 PolarHBondContact O-N 3.34Å; T609-L612 WeakPolarHBondContact OG1-CG 3.43Å; T609-L613 PolarHBondContact O-N 3.3Å
610	G	88.5	Confident	88.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-52.6	-41.1	178.9	0	0	0	0	0	113.2	D580 S583 L612 L613 L614	D580-G610 WeakPolarHBondContact O-CA 3.44Å; S583-G610 PolarHBondContact O-N 2.87Å; G610-L612 VanDerWaalsContact C-N 3.35Å; G610-L612 PolarHBondContact O-N 3.24Å; G610-L613 PolarHBondContact O-N 3.31Å; G610-L614 WeakPolarHBondContact O-CB 3.4Å; G610-L614 VanDerWaalsContact O-CG 3.29Å; G610-L614 WeakPolarHBondContact O-CG 2.97Å; G610-L614 PolarHBondContact O-N 3.49Å
611	K	89.2	Confident	88.5	Confident	147 Å²	147	48.2 Å²	48.2	64%	0.639	27%	0.272	S	S	*	.	H	α-helix	trans	-57.7	-42.3	173.3	-172.7	175.3	179.3	179.1	0	114	Y581 T609 G615	Y581-K611 WeakPolarHBondContact O-CB 3.34Å; Y581-K611 PolarHBondContact O-N 3.02Å; T609-K611 VanDerWaalsContact C-N 3.26Å; T609-K611 PolarHBondContact O-N 2.99Å; K611-G615 PolarHBondContact O-N 2.99Å
612	L	87.9	Confident	88.5	Confident	99 Å²	99	54.9 Å²	54.9	52%	0.518	30%	0.297	S	S	.	.	H	α-helix	trans	-73.9	-47.9	-178.9	-71.5	171.9	0	0	0	110	L608 T609 G610 G615 M616	L608-L612 HydrophobicContact CB-CB 4.24Å; L608-L612 HydrophobicContact CD2-CD1 4.47Å; T609-L612 WeakPolarHBondContact O-CA 3.46Å; T609-L612 PolarHBondContact O-N 3.34Å; T609-L612 WeakPolarHBondContact OG1-CG 3.43Å; G610-L612 VanDerWaalsContact C-N 3.35Å; G610-L612 PolarHBondContact O-N 3.24Å; L612-G615 CarbonylContact O-C 3.46Å; L612-G615 WeakPolarHBondContact O-CA 3.33Å; L612-G615 PolarHBondContact O-N 3.36Å; L612-M616 WeakPolarHBondContact O-CG 3.42Å; L612-M616 PolarHBondContact O-N 3.2Å; L612-M616 VanDerWaalsContact O-N 3.09Å
613	L	92.8	Very high	88.2	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-46	179.7	-177	63	0	0	0	112.1	L579 V588 L605 L608 T609 G610 G615 M616 L636	L579-L613 HydrophobicContact CD2-CD2 4.27Å; V588-L613 HydrophobicContact CG1-CD2 3.42Å; V588-L613 VanDerWaalsContact CG1-CD2 3.42Å; L605-L613 HydrophobicContact CB-CD1 4.12Å; L605-L613 HydrophobicContact CD1-CD1 4.12Å; L605-L613 HydrophobicContact CD2-CD1 4.02Å; L605-L613 HydrophobicContact CG-CD1 4.34Å; L608-L613 HydrophobicContact CB-CB 4.41Å; L608-L613 HydrophobicContact CD1-CD1 4.37Å; T609-L613 PolarHBondContact O-N 3.3Å; G610-L613 PolarHBondContact O-N 3.31Å; L613-G615 PolarHBondContact O-N 3Å; L613-M616 HydrophobicContact CD1-SD 4.3Å; L613-M616 PolarHBondContact O-N 3.49Å; L613-L636 HydrophobicContact CD1-CD1 3.87Å; L613-L636 HydrophobicContact CD2-CD2 3.86Å; L613-L636 HydrophobicContact CG-CD1 3.82Å; L613-L636 HydrophobicContact CG-CD2 3.79Å; L613-L636 HydrophobicContact CG-CG 4.46Å
614	L	89.8	Confident	88	Confident	3 Å²	3	59 Å²	59	2%	0.016	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.3	172.6	-65.1	166.6	0	0	0	111.7	L579 Y581 G610 L636 V639 K640 L643	L579-L614 HydrophobicContact CD2-CD2 4.05Å; L579-L614 HydrophobicContact CD2-CG 4.24Å; L579-L614 HydrophobicContact CG-CD1 4.43Å; Y581-L614 HydrophobicContact CD1-CB 4.31Å; Y581-L614 HydrophobicContact CD1-CD1 4.17Å; Y581-L614 HydrophobicContact CD2-CD1 4.4Å; Y581-L614 HydrophobicContact CE1-CB 3.9Å; Y581-L614 HydrophobicContact CE1-CD1 4.28Å; Y581-L614 HydrophobicContact CE2-CD1 4.5Å; Y581-L614 HydrophobicContact CG-CD1 4.23Å; G610-L614 WeakPolarHBondContact O-CB 3.4Å; G610-L614 VanDerWaalsContact O-CG 3.29Å; G610-L614 WeakPolarHBondContact O-CG 2.97Å; G610-L614 PolarHBondContact O-N 3.49Å; L614-L636 HydrophobicContact CD2-CB 4.32Å; L614-L636 HydrophobicContact CD2-CD2 3.82Å; L614-V639 HydrophobicContact CD2-CB 4.29Å; L614-V639 HydrophobicContact CD2-CG1 3.88Å; L614-K640 HydrophobicContact CD2-CG 3.91Å; L614-K640 WeakPolarHBondContact O-CE 3.22Å; L614-K640 PolarHBondContact O-NZ 2.87Å; L614-L643 HydrophobicContact CD1-CD1 4.02Å
615	G	85.4	Confident	87.9	Confident	54 Å²	54	57 Å²	57	56%	0.557	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-20.8	175.6	0	0	0	0	0	114.2	K611 L612 L613	K611-G615 PolarHBondContact O-N 2.99Å; L612-G615 CarbonylContact O-C 3.46Å; L612-G615 WeakPolarHBondContact O-CA 3.33Å; L612-G615 PolarHBondContact O-N 3.36Å; L613-G615 PolarHBondContact O-N 3Å
616	M	88.4	Confident	87.3	Confident	31 Å²	31	61.3 Å²	61.3	15%	0.153	33%	0.333	C	S	.	.			trans	-70.4	143	-174	-71.1	172.7	81	0	0	113.1	L605 L608 L612 L613 E620 I621 V624	L605-M616 HydrophobicContact CD2-CE 4.11Å; L605-M616 HydrophobicContact CD2-SD 4.1Å; L608-M616 HydrophobicContact CD1-CE 4.4Å; L608-M616 HydrophobicContact CD1-SD 3.33Å; L608-M616 WeakPolarHBondContact CD1-SD 3.46Å; L612-M616 WeakPolarHBondContact O-CG 3.42Å; L612-M616 PolarHBondContact O-N 3.2Å; L612-M616 VanDerWaalsContact O-N 3.09Å; L613-M616 HydrophobicContact CD1-SD 4.3Å; L613-M616 PolarHBondContact O-N 3.49Å; M616-E620 WeakPolarHBondContact CA-OE2 3.44Å; M616-E620 HydrophobicContact CB-CB 4.39Å; M616-E620 HydrophobicContact CE-CB 3.88Å; M616-I621 HydrophobicContact CB-CD1 4.24Å; M616-I621 HydrophobicContact CB-CG1 3.84Å; M616-I621 HydrophobicContact CE-CG1 3.97Å; M616-I621 HydrophobicContact SD-CG1 4.3Å; M616-V624 HydrophobicContact CE-CG2 4.21Å
617	T	87.2	Confident	87.1	Confident	63 Å²	63	69.6 Å²	69.6	39%	0.387	37%	0.37	S	S	.	.			trans	-76.5	161.7	167.7	60.9	0	0	0	0	111.1	E619 E620 I621	T617-E619 PolarHBondContact O-N 3.22Å; T617-E620 WeakPolarHBondContact CB-OE2 3.4Å; T617-E620 PolarHBondContact N-OE2 2.93Å; T617-E620 PolarHBondContact O-N 3.31Å; T617-E620 WeakPolarHBondContact OG1-CB 3.45Å; T617-E620 WeakPolarHBondContact OG1-CG 3.46Å; T617-E620 PolarHBondContact OG1-N 3.19Å; T617-E620 PolarHBondContact OG1-OE2 3Å; T617-I621 WeakPolarHBondContact O-CG1 3.47Å; T617-I621 PolarHBondContact O-N 3.44Å; T617-I621 VanDerWaalsContact O-N 3.09Å
618	K	85.3	Confident	87	Confident	56 Å²	56	66 Å²	66	24%	0.243	35%	0.346	C	S	.	.	H	α-helix	trans	-61.4	-36.5	178.5	-174.3	-179.4	178.2	-177.1	0	110.9	I621 R622 F633	K618-I621 PolarHBondContact O-N 3.48Å; K618-R622 WeakPolarHBondContact O-CB 3.28Å; K618-R622 PolarHBondContact O-N 3Å; K618-F633 HydrophobicContact CB-CD1 4.15Å; K618-F633 HydrophobicContact CB-CD2 3.82Å; K618-F633 HydrophobicContact CB-CE1 4.25Å; K618-F633 HydrophobicContact CB-CE2 3.93Å; K618-F633 HydrophobicContact CB-CG 3.91Å; K618-F633 HydrophobicContact CB-CZ 4.13Å; K618-F633 HydrophobicContact CD-CD1 4.25Å; K618-F633 HydrophobicContact CG-CB 4.28Å; K618-F633 HydrophobicContact CG-CD1 4.23Å; K618-F633 HydrophobicContact CG-CD2 4.45Å; K618-F633 HydrophobicContact CG-CG 4.07Å
619	E	84.5	Confident	86.6	Confident	123 Å²	123	64.1 Å²	64.1	58%	0.575	34%	0.337	S	S	*	.	H	α-helix	trans	-66.8	-43.7	179.3	-66.5	62.7	-136.6	0	0	111	T617 R622 T623	T617-E619 PolarHBondContact O-N 3.22Å; E619-R622 VanDerWaalsContact O-CB 3.32Å; E619-R622 WeakPolarHBondContact O-CB 3.37Å; E619-R622 PolarHBondContact O-N 3.06Å; E619-R622 VanDerWaalsContact O-N 3.16Å; E619-T623 WeakPolarHBondContact O-CG2 3.33Å; E619-T623 PolarHBondContact O-N 3.37Å
620	E	85.6	Confident	86.1	Confident	93 Å²	93	63.2 Å²	63.2	44%	0.435	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-42.2	175.3	-73.9	164.9	145.4	0	0	111.7	M616 T617 R622 T623	M616-E620 WeakPolarHBondContact CA-OE2 3.44Å; M616-E620 HydrophobicContact CB-CB 4.39Å; M616-E620 HydrophobicContact CE-CB 3.88Å; T617-E620 WeakPolarHBondContact CB-OE2 3.4Å; T617-E620 PolarHBondContact N-OE2 2.93Å; T617-E620 PolarHBondContact O-N 3.31Å; T617-E620 WeakPolarHBondContact OG1-CB 3.45Å; T617-E620 WeakPolarHBondContact OG1-CG 3.46Å; T617-E620 PolarHBondContact OG1-N 3.19Å; T617-E620 PolarHBondContact OG1-OE2 3Å; E620-R622 VanDerWaalsContact C-N 3.26Å; E620-R622 PolarHBondContact O-N 2.91Å; E620-T623 PolarHBondContact O-N 3.24Å; E620-T623 PolarHBondContact O-OG1 2.98Å
621	I	90.3	Very high	86.1	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-63.1	-36.6	174.9	-63.2	172.5	0	0	0	110.4	L605 M616 T617 K618 T623 V624 C625 A629 V632 F633 L636	L605-I621 HydrophobicContact CD1-CG2 4.24Å; M616-I621 HydrophobicContact CB-CD1 4.24Å; M616-I621 HydrophobicContact CB-CG1 3.84Å; M616-I621 HydrophobicContact CE-CG1 3.97Å; M616-I621 HydrophobicContact SD-CG1 4.3Å; T617-I621 WeakPolarHBondContact O-CG1 3.47Å; T617-I621 PolarHBondContact O-N 3.44Å; T617-I621 VanDerWaalsContact O-N 3.09Å; K618-I621 PolarHBondContact O-N 3.48Å; I621-T623 PolarHBondContact O-N 2.99Å; I621-V624 WeakPolarHBondContact O-CG2 3.34Å; I621-V624 PolarHBondContact O-N 3.31Å; I621-V624 VanDerWaalsContact O-N 3.15Å; I621-C625 WeakPolarHBondContact CG2-SG 3.34Å; I621-C625 PolarHBondContact O-N 3.49Å; I621-C625 PolarHBondContact O-SG 2.97Å; I621-C625 VanDerWaalsContact O-SG 3.35Å; I621-A629 HydrophobicContact CB-CB 4.4Å; I621-A629 HydrophobicContact CG2-CB 3.81Å; I621-V632 HydrophobicContact CD1-CG1 4.31Å; I621-V632 HydrophobicContact CG2-CB 4.15Å; I621-V632 HydrophobicContact CG2-CG1 4.1Å; I621-F633 HydrophobicContact CD1-CB 4.19Å; I621-F633 HydrophobicContact CD1-CD2 3.97Å; I621-L636 HydrophobicContact CD1-CD1 3.78Å
622	R	86.9	Confident	86	Confident	144 Å²	144	62.9 Å²	62.9	54%	0.543	34%	0.337	S	S	.	.	H	α-helix	trans	-63.6	-27.9	177.1	-155.2	179.3	-148.5	137.9	1.4	113.4	K618 E619 E620 V624 P626 A629	K618-R622 WeakPolarHBondContact O-CB 3.28Å; K618-R622 PolarHBondContact O-N 3Å; E619-R622 VanDerWaalsContact O-CB 3.32Å; E619-R622 WeakPolarHBondContact O-CB 3.37Å; E619-R622 PolarHBondContact O-N 3.06Å; E619-R622 VanDerWaalsContact O-N 3.16Å; E620-R622 VanDerWaalsContact C-N 3.26Å; E620-R622 PolarHBondContact O-N 2.91Å; R622-V624 VanDerWaalsContact C-N 3.27Å; R622-V624 PolarHBondContact O-N 3.01Å; R622-P626 WeakPolarHBondContact O-CA 3.2Å; R622-A629 HydrophobicContact CB-CB 3.98Å; R622-A629 HydrophobicContact CG-CB 4.16Å
623	T	85	Confident	86.2	Confident	114 Å²	114	60.5 Å²	60.5	70%	0.699	32%	0.323	S	S	*	.	H	α-helix	trans	-69.2	-24.7	176.5	69.3	0	0	0	0	113.5	E619 E620 I621	E619-T623 WeakPolarHBondContact O-CG2 3.33Å; E619-T623 PolarHBondContact O-N 3.37Å; E620-T623 PolarHBondContact O-N 3.24Å; E620-T623 PolarHBondContact O-OG1 2.98Å; I621-T623 PolarHBondContact O-N 2.99Å
624	V	83.1	Confident	86	Confident	55 Å²	55	67.3 Å²	67.3	33%	0.333	35%	0.353	S	S	.	.	H	α-helix	trans	-108.4	-27.4	-175.2	-73.8	0	0	0	0	113.9	L605 M616 I621 R622	L605-V624 HydrophobicContact CD2-CG2 3.52Å; L605-V624 HydrophobicContact CG-CG2 4.3Å; M616-V624 HydrophobicContact CE-CG2 4.21Å; I621-V624 WeakPolarHBondContact O-CG2 3.34Å; I621-V624 PolarHBondContact O-N 3.31Å; I621-V624 VanDerWaalsContact O-N 3.15Å; R622-V624 VanDerWaalsContact C-N 3.27Å; R622-V624 PolarHBondContact O-N 3.01Å
625	C	85.1	Confident	85.9	Confident	4 Å²	4	70 Å²	70	3%	0.027	37%	0.365	C	S	.	.			trans	-143.7	77	175	58.2	0	0	0	0	111.6	T601 I621 E627 E628 A629	T601-C625 HydrophobicContact CG2-CB 4.21Å; T601-C625 VanDerWaalsContact OG1-CB 3.31Å; T601-C625 WeakPolarHBondContact OG1-CB 3.45Å; I621-C625 WeakPolarHBondContact CG2-SG 3.34Å; I621-C625 PolarHBondContact O-N 3.49Å; I621-C625 PolarHBondContact O-SG 2.97Å; I621-C625 VanDerWaalsContact O-SG 3.35Å; C625-E627 VanDerWaalsContact C-N 3.3Å; C625-E627 PolarHBondContact O-N 3.04Å; C625-E628 PolarHBondContact O-N 2.93Å; C625-A629 WeakPolarHBondContact O-CA 3.31Å; C625-A629 VanDerWaalsContact O-CB 3.25Å; C625-A629 WeakPolarHBondContact O-CB 3.03Å; C625-A629 PolarHBondContact O-N 2.9Å
626	P	77.6	Confident	86.1	Confident	89 Å²	89	67.5 Å²	67.5	58%	0.578	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.5	-170.1	23	-33.1	0	0	0	114.3	R622	R622-P626 WeakPolarHBondContact O-CA 3.2Å
627	E	82.5	Confident	86	Confident	181 Å²	181	69.7 Å²	69.7	85%	0.846	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-32.2	-178.1	-64.2	174.4	-172.1	0	0	113	C625	C625-E627 VanDerWaalsContact C-N 3.3Å; C625-E627 PolarHBondContact O-N 3.04Å
628	E	88.3	Confident	85.7	Confident	30 Å²	30	68.6 Å²	68.6	14%	0.14	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-1	-174.5	-66.3	-172.4	130.1	0	0	113.9	S598 T601 C625 G630 K631 V632	S598-E628 WeakPolarHBondContact CB-OE2 3.49Å; S598-E628 PolarHBondContact N-OE1 3.46Å; S598-E628 VanDerWaalsContact N-OE1 3.13Å; S598-E628 PolarHBondContact N-OE2 3.44Å; S598-E628 PolarHBondContact OG-OE2 3.42Å; T601-E628 WeakPolarHBondContact CB-OE2 3.37Å; T601-E628 PolarHBondContact OG1-OE2 3.05Å; C625-E628 PolarHBondContact O-N 2.93Å; E628-G630 VanDerWaalsContact C-N 3.26Å; E628-G630 PolarHBondContact O-N 3.44Å; E628-G630 VanDerWaalsContact O-N 3.14Å; E628-K631 PolarHBondContact O-N 3.47Å; E628-V632 HydrophobicContact CB-CG2 4.4Å; E628-V632 WeakPolarHBondContact O-CG2 3.35Å; E628-V632 PolarHBondContact O-N 2.99Å
629	A	83.8	Confident	85.8	Confident	2 Å²	2	66.4 Å²	66.4	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-54.9	-38.2	-173.8	0	0	0	0	0	113.9	I621 R622 C625 F633	I621-A629 HydrophobicContact CB-CB 4.4Å; I621-A629 HydrophobicContact CG2-CB 3.81Å; R622-A629 HydrophobicContact CB-CB 3.98Å; R622-A629 HydrophobicContact CG-CB 4.16Å; C625-A629 WeakPolarHBondContact O-CA 3.31Å; C625-A629 VanDerWaalsContact O-CB 3.25Å; C625-A629 WeakPolarHBondContact O-CB 3.03Å; C625-A629 PolarHBondContact O-N 2.9Å; A629-F633 WeakPolarHBondContact O-CB 3.43Å; A629-F633 PolarHBondContact O-N 2.96Å
630	G	81.8	Confident	85.7	Confident	40 Å²	40	62.5 Å²	62.5	41%	0.412	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-43.6	175.5	0	0	0	0	0	112.9	E628 F634	E628-G630 VanDerWaalsContact C-N 3.26Å; E628-G630 PolarHBondContact O-N 3.44Å; E628-G630 VanDerWaalsContact O-N 3.14Å; G630-F634 WeakPolarHBondContact O-CB 3.49Å; G630-F634 PolarHBondContact O-N 2.84Å
631	K	87.3	Confident	85.4	Confident	140 Å²	140	61.2 Å²	61.2	61%	0.609	32%	0.32	S	S	*	.	H	α-helix	trans	-69.1	-44.2	-179.6	-62.9	178.6	-178.7	172.8	0	111.4	F597 E628 F634 Q635	F597-K631 HydrophobicContact CE1-CB 3.93Å; E628-K631 PolarHBondContact O-N 3.47Å; K631-F634 PolarHBondContact O-N 3.34Å; K631-Q635 PolarHBondContact O-N 3.43Å; K631-Q635 VanDerWaalsContact O-N 3.13Å
632	V	88.8	Confident	84.8	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.1	-51	176.4	176.1	0	0	0	0	110.3	F597 T601 L605 I621 E628 F634 Q635 L636	F597-V632 HydrophobicContact CD1-CG2 3.68Å; F597-V632 HydrophobicContact CE1-CB 4.24Å; F597-V632 HydrophobicContact CE1-CG2 3.5Å; F597-V632 HydrophobicContact CE2-CG2 4.38Å; F597-V632 HydrophobicContact CG-CG2 4.2Å; F597-V632 HydrophobicContact CZ-CB 4.29Å; F597-V632 HydrophobicContact CZ-CG2 3.88Å; T601-V632 HydrophobicContact CG2-CG2 3.55Å; L605-V632 HydrophobicContact CD1-CB 4.49Å; L605-V632 HydrophobicContact CD1-CG1 3.67Å; L605-V632 HydrophobicContact CD1-CG2 4.26Å; I621-V632 HydrophobicContact CD1-CG1 4.31Å; I621-V632 HydrophobicContact CG2-CB 4.15Å; I621-V632 HydrophobicContact CG2-CG1 4.1Å; E628-V632 HydrophobicContact CB-CG2 4.4Å; E628-V632 WeakPolarHBondContact O-CG2 3.35Å; E628-V632 PolarHBondContact O-N 2.99Å; V632-F634 VanDerWaalsContact C-N 3.3Å; V632-F634 PolarHBondContact O-N 3.19Å; V632-Q635 PolarHBondContact O-N 2.83Å; V632-L636 HydrophobicContact CG1-CD1 3.9Å; V632-L636 HydrophobicContact CG1-CG 4.36Å; V632-L636 WeakPolarHBondContact O-CG 3.41Å; V632-L636 PolarHBondContact O-N 2.93Å
633	F	90.8	Very high	84.5	Confident	48 Å²	48	62.2 Å²	62.2	21%	0.211	33%	0.332	C	S	.	.	H	α-helix	trans	-60.2	-40.4	-179.6	-174.6	-100.5	0	0	0	111.9	K618 I621 A629 L636 Q637	K618-F633 HydrophobicContact CB-CD1 4.15Å; K618-F633 HydrophobicContact CB-CD2 3.82Å; K618-F633 HydrophobicContact CB-CE1 4.25Å; K618-F633 HydrophobicContact CB-CE2 3.93Å; K618-F633 HydrophobicContact CB-CG 3.91Å; K618-F633 HydrophobicContact CB-CZ 4.13Å; K618-F633 HydrophobicContact CD-CD1 4.25Å; K618-F633 HydrophobicContact CG-CB 4.28Å; K618-F633 HydrophobicContact CG-CD1 4.23Å; K618-F633 HydrophobicContact CG-CD2 4.45Å; K618-F633 HydrophobicContact CG-CG 4.07Å; I621-F633 HydrophobicContact CD1-CB 4.19Å; I621-F633 HydrophobicContact CD1-CD2 3.97Å; A629-F633 WeakPolarHBondContact O-CB 3.43Å; A629-F633 PolarHBondContact O-N 2.96Å; F633-L636 PolarHBondContact O-N 3.31Å; F633-Q637 HydrophobicContact CD1-CG 4.12Å; F633-Q637 HydrophobicContact CE1-CG 3.82Å; F633-Q637 HydrophobicContact CZ-CG 4.13Å; F633-Q637 WeakPolarHBondContact O-CG 3.2Å; F633-Q637 PolarHBondContact O-N 3.39Å
634	F	88.2	Confident	84.1	Confident	144 Å²	144	59.4 Å²	59.4	63%	0.632	32%	0.32	S	S	*	.	H	α-helix	trans	-60.6	-47.4	176.4	-178.6	-96	0	0	0	112.6	G630 K631 V632 L636 Q637 A638	G630-F634 WeakPolarHBondContact O-CB 3.49Å; G630-F634 PolarHBondContact O-N 2.84Å; K631-F634 PolarHBondContact O-N 3.34Å; V632-F634 VanDerWaalsContact C-N 3.3Å; V632-F634 PolarHBondContact O-N 3.19Å; F634-L636 VanDerWaalsContact C-N 3.31Å; F634-L636 PolarHBondContact O-N 3.4Å; F634-Q637 PolarHBondContact O-N 3.29Å; F634-A638 PolarHBondContact O-N 3.46Å
635	Q	87.8	Confident	83.5	Confident	59 Å²	59	62.5 Å²	62.5	28%	0.276	33%	0.334	S	S	.	.	H	α-helix	trans	-63.8	-37.6	177.3	-69.5	-70.3	-26.2	0	0	111.8	W591 F597 K631 V632 A638 V639	W591-Q635 HydrophobicContact CH2-CB 3.66Å; W591-Q635 HydrophobicContact CZ2-CB 4.08Å; F597-Q635 HydrophobicContact CZ-CB 4.2Å; F597-Q635 HydrophobicContact CZ-CG 3.89Å; K631-Q635 PolarHBondContact O-N 3.43Å; K631-Q635 VanDerWaalsContact O-N 3.13Å; V632-Q635 PolarHBondContact O-N 2.83Å; Q635-A638 PolarHBondContact O-N 2.74Å; Q635-V639 WeakPolarHBondContact O-CG2 3.42Å; Q635-V639 PolarHBondContact O-N 3.41Å
636	L	90.2	Very high	82.5	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-66	-36.3	175.1	-66.6	173.6	0	0	0	112.4	L579 W591 L613 L614 I621 V632 F633 F634 V639 K640	L579-L636 HydrophobicContact CD2-CD2 3.45Å; L579-L636 VanDerWaalsContact CD2-CD2 3.45Å; W591-L636 HydrophobicContact CH2-CD2 3.89Å; W591-L636 HydrophobicContact CH2-CG 4.4Å; W591-L636 HydrophobicContact CZ3-CD2 3.94Å; L613-L636 HydrophobicContact CD1-CD1 3.87Å; L613-L636 HydrophobicContact CD2-CD2 3.86Å; L613-L636 HydrophobicContact CG-CD1 3.82Å; L613-L636 HydrophobicContact CG-CD2 3.79Å; L613-L636 HydrophobicContact CG-CG 4.46Å; L614-L636 HydrophobicContact CD2-CB 4.32Å; L614-L636 HydrophobicContact CD2-CD2 3.82Å; I621-L636 HydrophobicContact CD1-CD1 3.78Å; V632-L636 HydrophobicContact CG1-CD1 3.9Å; V632-L636 HydrophobicContact CG1-CG 4.36Å; V632-L636 WeakPolarHBondContact O-CG 3.41Å; V632-L636 PolarHBondContact O-N 2.93Å; F633-L636 PolarHBondContact O-N 3.31Å; F634-L636 VanDerWaalsContact C-N 3.31Å; F634-L636 PolarHBondContact O-N 3.4Å; L636-V639 PolarHBondContact O-N 3.46Å; L636-K640 VanDerWaalsContact O-CG 3.3Å; L636-K640 WeakPolarHBondContact O-CG 3.24Å; L636-K640 PolarHBondContact O-N 2.88Å
637	Q	87.1	Confident	81.8	Confident	78 Å²	78	66.5 Å²	66.5	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-66.6	-39	173.9	-69.9	-60.2	-24.3	0	0	112.2	F633 F634 V639 K640 S641	F633-Q637 HydrophobicContact CD1-CG 4.12Å; F633-Q637 HydrophobicContact CE1-CG 3.82Å; F633-Q637 HydrophobicContact CZ-CG 4.13Å; F633-Q637 WeakPolarHBondContact O-CG 3.2Å; F633-Q637 PolarHBondContact O-N 3.39Å; F634-Q637 PolarHBondContact O-N 3.29Å; Q637-V639 VanDerWaalsContact C-N 3.32Å; Q637-V639 PolarHBondContact O-N 3.19Å; Q637-K640 PolarHBondContact O-N 3.37Å; Q637-S641 WeakPolarHBondContact O-CB 3.17Å; Q637-S641 PolarHBondContact O-N 3.23Å
638	A	80.9	Confident	80.1	Confident	39 Å²	39	64.6 Å²	64.6	32%	0.322	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-42.4	173	0	0	0	0	0	111.5	F634 Q635 S641 Q642	F634-A638 PolarHBondContact O-N 3.46Å; Q635-A638 PolarHBondContact O-N 2.74Å; A638-S641 PolarHBondContact O-N 3.32Å; A638-Q642 WeakPolarHBondContact O-CG 3.32Å; A638-Q642 PolarHBondContact O-N 2.87Å
639	V	86.1	Confident	78	Confident	10 Å²	10	68.7 Å²	68.7	6%	0.061	39%	0.39	C	S	.	.	H	α-helix	trans	-63.9	-46.4	175	170.8	0	0	0	0	111.7	L579 W591 L614 Q635 L636 Q637 S641 Q642 L643	L579-V639 HydrophobicContact CB-CG1 4.12Å; L579-V639 HydrophobicContact CB-CG2 4.48Å; L579-V639 HydrophobicContact CD2-CG1 4.39Å; L579-V639 HydrophobicContact CG-CG1 4.38Å; L579-V639 WeakPolarHBondContact O-CG1 3.5Å; W591-V639 HydrophobicContact CZ2-CG2 3.68Å; L614-V639 HydrophobicContact CD2-CB 4.29Å; L614-V639 HydrophobicContact CD2-CG1 3.88Å; Q635-V639 WeakPolarHBondContact O-CG2 3.42Å; Q635-V639 PolarHBondContact O-N 3.41Å; L636-V639 PolarHBondContact O-N 3.46Å; Q637-V639 VanDerWaalsContact C-N 3.32Å; Q637-V639 PolarHBondContact O-N 3.19Å; V639-S641 VanDerWaalsContact C-N 3.31Å; V639-S641 PolarHBondContact O-N 3.42Å; V639-Q642 PolarHBondContact O-N 3.12Å; V639-L643 HydrophobicContact CG1-CD1 3.84Å; V639-L643 HydrophobicContact CG1-CG 4.36Å; V639-L643 WeakPolarHBondContact O-CG 3.45Å; V639-L643 PolarHBondContact O-N 3.05Å
640	K	83.7	Confident	76	Confident	41 Å²	41	74.2 Å²	74.2	18%	0.178	43%	0.428	C	S	.	.	H	α-helix	trans	-58.9	-42.3	176.4	-72.7	172.7	-174.5	-175.8	0	112.4	L614 L636 Q637 L643 A644	L614-K640 HydrophobicContact CD2-CG 3.91Å; L614-K640 WeakPolarHBondContact O-CE 3.22Å; L614-K640 PolarHBondContact O-NZ 2.87Å; L636-K640 VanDerWaalsContact O-CG 3.3Å; L636-K640 WeakPolarHBondContact O-CG 3.24Å; L636-K640 PolarHBondContact O-N 2.88Å; Q637-K640 PolarHBondContact O-N 3.37Å; K640-L643 PolarHBondContact O-N 3.43Å; K640-A644 WeakPolarHBondContact O-CB 3.25Å; K640-A644 PolarHBondContact O-N 3.27Å
641	S	77.6	Confident	73.9	Confident	67 Å²	67	81 Å²	81	47%	0.469	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-46.1	176	176.9	0	0	0	0	111.3	Q637 A638 V639 L643 A644 L645	Q637-S641 WeakPolarHBondContact O-CB 3.17Å; Q637-S641 PolarHBondContact O-N 3.23Å; A638-S641 PolarHBondContact O-N 3.32Å; V639-S641 VanDerWaalsContact C-N 3.31Å; V639-S641 PolarHBondContact O-N 3.42Å; S641-L643 PolarHBondContact O-N 3.02Å; S641-A644 PolarHBondContact O-N 3.22Å; S641-L645 WeakPolarHBondContact O-CG 3.33Å; S641-L645 PolarHBondContact O-N 3.35Å
642	Q	78.2	Confident	71.5	Confident	118 Å²	118	82.4 Å²	82.4	55%	0.551	46%	0.46	S	S	*	.	H	α-helix	trans	-62.2	-41.2	176.1	-72.7	175.7	-9.8	0	0	112.6	A638 V639 L645 A646	A638-Q642 WeakPolarHBondContact O-CG 3.32Å; A638-Q642 PolarHBondContact O-N 2.87Å; V639-Q642 PolarHBondContact O-N 3.12Å; Q642-L645 PolarHBondContact O-N 2.85Å; Q642-A646 WeakPolarHBondContact O-CB 3.44Å; Q642-A646 PolarHBondContact O-N 3.06Å
643	L	81.1	Confident	69	Low	46 Å²	46	93.7 Å²	93.7	24%	0.241	51%	0.505	C	S	.	.	H	α-helix	trans	-67.4	-37.2	176.3	-68.2	168.6	0	0	0	112.3	D580 Y581 L614 V639 K640 S641 A646 S647	D580-L643 HydrophobicContact CB-CD2 3.98Å; Y581-L643 HydrophobicContact CD2-CD1 3.96Å; Y581-L643 HydrophobicContact CE2-CD1 3.93Å; L614-L643 HydrophobicContact CD1-CD1 4.02Å; V639-L643 HydrophobicContact CG1-CD1 3.84Å; V639-L643 HydrophobicContact CG1-CG 4.36Å; V639-L643 WeakPolarHBondContact O-CG 3.45Å; V639-L643 PolarHBondContact O-N 3.05Å; K640-L643 PolarHBondContact O-N 3.43Å; S641-L643 PolarHBondContact O-N 3.02Å; L643-A646 PolarHBondContact O-N 3.39Å; L643-S647 WeakPolarHBondContact O-CB 3.29Å; L643-S647 PolarHBondContact O-N 3.4Å; L643-S647 VanDerWaalsContact O-N 3.09Å; L643-S647 PolarHBondContact O-OG 2.89Å
644	A	75.4	Confident	66.4	Low	55 Å²	55	98.4 Å²	98.4	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-63.8	-45.5	175.6	0	0	0	0	0	111.2	K640 S641 A646 S647	K640-A644 WeakPolarHBondContact O-CB 3.25Å; K640-A644 PolarHBondContact O-N 3.27Å; S641-A644 PolarHBondContact O-N 3.22Å; A644-A646 VanDerWaalsContact C-N 3.32Å; A644-A646 PolarHBondContact O-N 3.18Å; A644-S647 PolarHBondContact O-N 2.92Å; A644-S647 VanDerWaalsContact O-N 3.12Å; A644-S647 PolarHBondContact O-OG 2.89Å
645	L	70.5	Confident	64.2	Low	120 Å²	120	98.8 Å²	98.8	63%	0.628	54%	0.54	S	S	*	.	H	α-helix	trans	-63.8	-35.2	175.7	-68.4	170.4	0	0	0	112.7	S641 Q642 S647	S641-L645 WeakPolarHBondContact O-CG 3.33Å; S641-L645 PolarHBondContact O-N 3.35Å; Q642-L645 PolarHBondContact O-N 2.85Å; L645-S647 VanDerWaalsContact C-N 3.27Å; L645-S647 PolarHBondContact O-N 3.06Å
646	A	65.6	Low	61.9	Low	87 Å²	87	106.8 Å²	106.8	72%	0.719	57%	0.568	S	S	*	*	H	α-helix	trans	-74.1	-17.2	175.8	0	0	0	0	0	113.5	Q642 L643 A644	Q642-A646 WeakPolarHBondContact O-CB 3.44Å; Q642-A646 PolarHBondContact O-N 3.06Å; L643-A646 PolarHBondContact O-N 3.39Å; A644-A646 VanDerWaalsContact C-N 3.32Å; A644-A646 PolarHBondContact O-N 3.18Å
647	S	62	Low	59.4	Low	90 Å²	90	120.9 Å²	120.9	63%	0.629	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-3.5	-178.5	71.8	0	0	0	0	114.5	L643 A644 L645 P649	L643-S647 WeakPolarHBondContact O-CB 3.29Å; L643-S647 PolarHBondContact O-N 3.4Å; L643-S647 VanDerWaalsContact O-N 3.09Å; L643-S647 PolarHBondContact O-OG 2.89Å; A644-S647 PolarHBondContact O-N 2.92Å; A644-S647 VanDerWaalsContact O-N 3.12Å; A644-S647 PolarHBondContact O-OG 2.89Å; L645-S647 VanDerWaalsContact C-N 3.27Å; L645-S647 PolarHBondContact O-N 3.06Å; S647-P649 WeakPolarHBondContact O-CD 3.35Å
648	E	46.5	Very low	58.1	Low	142 Å²	142	123.1 Å²	123.1	66%	0.664	64%	0.636	S	S	*	*	S	Bend	trans	-70.8	122.3	174.6	-72.3	-160.8	158.5	0	0	110.6	S650	E648-S650 PolarHBondContact O-N 3.12Å
649	P	44.3	Very low	56.9	Low	116 Å²	116	127.5 Å²	127.5	75%	0.753	65%	0.653	S	S	*	*			trans	-65.2	121.6	173.7	25.6	-30.5	0	0	0	108.5	S647 Q651	S647-P649 WeakPolarHBondContact O-CD 3.35Å; P649-Q651 PolarHBondContact O-N 2.49Å
650	S	42.4	Very low	55.2	Low	117 Å²	117	134 Å²	134	82%	0.818	69%	0.686	S	S	*	*			trans	-55.4	98.2	173.8	-41.8	0	0	0	0	109	E648 M652	E648-S650 PolarHBondContact O-N 3.12Å; S650-M652 VanDerWaalsContact C-N 3.34Å; S650-M652 PolarHBondContact O-N 2.95Å
651	Q	38.2	Very low	53.6	Low	183 Å²	183	139.5 Å²	139.5	86%	0.855	72%	0.716	S	S	*	*			trans	-64.8	103.6	167.5	-78.7	-168.5	1.5	0	0	106.7	P649 Y653	P649-Q651 PolarHBondContact O-N 2.49Å; Q651-Y653 PolarHBondContact O-N 3.35Å
652	M	35.3	Very low	52.1	Low	170 Å²	170	144 Å²	144	84%	0.837	73%	0.731	S	S	*	*			trans	-50.4	112.4	171.1	-71.4	-164.3	173.5	0	0	108.9	S650 N654	S650-M652 VanDerWaalsContact C-N 3.34Å; S650-M652 PolarHBondContact O-N 2.95Å; M652-N654 PolarHBondContact O-N 3.12Å
653	Y	36.7	Very low	50.3	Low	237 Å²	237	145.7 Å²	145.7	93%	0.929	74%	0.743	S	S	*	*			trans	-64.1	91.8	156	-103.4	-91.5	0	0	0	107	Q651 N655	Q651-Y653 PolarHBondContact O-N 3.35Å; Y653-N655 PolarHBondContact O-N 3.37Å
654	N	36.7	Very low	48.1	Very low	146 Å²	146	152.9 Å²	152.9	78%	0.781	78%	0.779	S	S	*	*			trans	-72.9	106.7	170.6	-129.7	-4.9	0	0	0	107	M652 R656	M652-N654 PolarHBondContact O-N 3.12Å; N654-R656 PolarHBondContact O-N 3.48Å
655	N	41.6	Very low	46	Very low	152 Å²	152	160.4 Å²	160.4	81%	0.813	80%	0.804	S	S	*	*			trans	-48.3	122.1	158.5	-93.2	-27.7	0	0	0	109.2	Y653	Y653-N655 PolarHBondContact O-N 3.37Å
656	R	38.9	Very low	44	Very low	227 Å²	227	163.8 Å²	163.8	86%	0.857	82%	0.819	S	S	*	*			trans	-173.3	116.4	141.4	-103.8	166.7	-167.6	-161.5	4.2	111.6	N654	N654-R656 PolarHBondContact O-N 3.48Å
657	Y	39.6	Very low	42	Very low	298 Å²	298	170.7 Å²	170.7	100%	1.169	83%	0.828	S	S	*	*			trans	65.3	0	157.6	-72.7	-79.6	0	0	0	119.6

Retrieved 657 of 657 residues in 898.7 ms (Link to these results)

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