A0A087X5J6_POEFO Loading...

Copine-8

Probable calcium-dependent phospholipid-binding protein that may play a role in calcium-mediated intracellular processes.

AlphaFold DB , UniProt , Accession A0A087X5J6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 568 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	31.6	Very low	28.1	Very low	238 Å²	238	154.9 Å²	154.9	100%	1.172	84%	0.839	S	S	*	*				0	116.9	0	-84.6	172.1	-175.5	0	0	105.8
2	E	29.7	Very low	27.7	Very low	201 Å²	201	153.5 Å²	153.5	94%	0.939	84%	0.84	S	S	*	*			trans	60.9	132.7	165.6	-62	171.8	167.1	0	0	115.5
3	G	27.7	Very low	27.3	Very low	71 Å²	71	148.8 Å²	148.8	73%	0.732	84%	0.835	S	S	*	*			cis	159.7	154.4	14.4	0	0	0	0	0	106.1
4	D	31.8	Very low	26.9	Very low	162 Å²	162	147.4 Å²	147.4	87%	0.866	83%	0.831	S	S	*	*			trans	-44.4	155	177.7	-62.8	-63.4	0	0	0	114.9
5	V	28.4	Very low	26.9	Very low	118 Å²	118	145.8 Å²	145.8	72%	0.715	83%	0.826	S	S	*	*				-173.1	124.7	119.8	165	0	0	0	0	109.3	D7	V5-D7 HydrophobicContact CG1-CB 4.21Å
6	M	29.9	Very low	26.9	Very low	189 Å²	189	144.3 Å²	144.3	93%	0.931	83%	0.825	S	S	*	*			trans	-73.6	118.7	161.8	-174.6	176.3	175.9	0	0	107.5
7	D	26.3	Very low	26.6	Very low	144 Å²	144	144.5 Å²	144.5	77%	0.77	82%	0.823	S	S	*	*			trans	-140.6	131.2	169	-107.5	-26.4	0	0	0	112.8	V5	V5-D7 HydrophobicContact CG1-CB 4.21Å
8	K	26.2	Very low	26.7	Very low	189 Å²	189	147.8 Å²	147.8	82%	0.822	83%	0.827	S	S	*	*			trans	-62.4	144.9	171.7	-70.9	172.9	169.4	-176.6	0	109.9
9	V	27.2	Very low	26.5	Very low	136 Å²	136	147.1 Å²	147.1	82%	0.824	82%	0.821	S	S	*	*			trans	-127.8	92.7	157.8	-174.8	0	0	0	0	108.7
10	E	26.1	Very low	26.7	Very low	182 Å²	182	145.5 Å²	145.5	85%	0.85	82%	0.818	S	S	*	*			trans	-81.7	127.6	143.3	-85.8	177.1	142	0	0	107.4
11	A	24.8	Very low	26.6	Very low	74 Å²	74	146.4 Å²	146.4	61%	0.612	82%	0.818	S	S	*	*			trans	-173.2	102.5	151.9	0	0	0	0	0	106.8
12	T	22.8	Very low	26.7	Very low	138 Å²	138	141.3 Å²	141.3	85%	0.847	81%	0.806	S	S	*	*				68.6	136.1	81.1	56.3	0	0	0	0	115.6
13	A	22.1	Very low	26.7	Very low	93 Å²	93	134.6 Å²	134.6	77%	0.769	79%	0.79	S	S	*	*			trans	81.5	130.8	174.4	0	0	0	0	0	114.6
14	T	22.5	Very low	27.2	Very low	128 Å²	128	134 Å²	134	79%	0.785	78%	0.775	S	S	*	*			cis	-147.4	152.1	45.7	18	0	0	0	0	114.8
15	V	26.7	Very low	28	Very low	124 Å²	124	133.4 Å²	133.4	75%	0.752	77%	0.77	S	S	*	*			trans	-27.6	138.9	159.6	177.3	0	0	0	0	112.7	D17	V15-D17 PolarHBondContact O-N 3.32Å
16	C	26.3	Very low	29.1	Very low	121 Å²	121	129.8 Å²	129.8	82%	0.818	75%	0.749	S	S	*	*			trans	-44.6	97.5	171.1	-50	0	0	0	0	111.3	F18	C16-F18 PolarHBondContact O-N 3.17Å
17	D	22.8	Very low	30.6	Very low	148 Å²	148	124.2 Å²	124.2	79%	0.791	73%	0.733	S	S	*	*			trans	-69.9	112	160.9	-81.1	-34.4	0	0	0	106.9	V15 D19	V15-D17 PolarHBondContact O-N 3.32Å; D17-D19 PolarHBondContact O-N 2.82Å
18	F	27.4	Very low	33	Very low	204 Å²	204	118.4 Å²	118.4	90%	0.895	70%	0.702	S	S	*	*			trans	-63.5	108.6	166.8	-132.9	-96.3	0	0	0	106.7	C16 P20	C16-F18 PolarHBondContact O-N 3.17Å; F18-P20 WeakPolarHBondContact O-CD 3.49Å
19	D	24.3	Very low	35.8	Very low	134 Å²	134	114 Å²	114	72%	0.717	68%	0.683	S	S	*	*			trans	-87.9	116.1	175.1	-163.9	0.2	0	0	0	109.2	D17 M21	D17-D19 PolarHBondContact O-N 2.82Å; D19-M21 VanDerWaalsContact C-N 3.3Å; D19-M21 PolarHBondContact O-N 3.44Å; D19-M21 VanDerWaalsContact O-N 3.1Å
20	P	30.3	Very low	38.7	Very low	116 Å²	116	107.5 Å²	107.5	75%	0.753	64%	0.644	S	S	*	*			trans	-86.5	71.6	179.5	35.8	-31.2	0	0	0	109.6	F18	F18-P20 WeakPolarHBondContact O-CD 3.49Å
21	M	22.9	Very low	41.6	Very low	165 Å²	165	101.2 Å²	101.2	81%	0.813	61%	0.614	S	S	*	*	S	Bend	trans	-136	109.1	156	-84.7	-144.7	-91.1	0	0	109.3	D19 G23	D19-M21 VanDerWaalsContact C-N 3.3Å; D19-M21 PolarHBondContact O-N 3.44Å; D19-M21 VanDerWaalsContact O-N 3.1Å; M21-G23 PolarHBondContact O-N 2.57Å
22	S	35.4	Very low	44.6	Very low	131 Å²	131	97.7 Å²	97.7	92%	0.916	59%	0.585	S	S	*	*			trans	-51.7	90.5	-180	53	0	0	0	0	113
23	G	29.8	Very low	47.6	Very low	59 Å²	59	92.5 Å²	92.5	61%	0.608	55%	0.554	S	S	*	*			trans	-100.2	116.7	150.7	0	0	0	0	0	107.1	M21 I25	M21-G23 PolarHBondContact O-N 2.57Å; G23-I25 PolarHBondContact O-N 3.13Å
24	S	37.9	Very low	50.7	Low	60 Å²	60	88.1 Å²	88.1	42%	0.42	52%	0.517	S	S	.	.			trans	-48	112.9	176.5	53.6	0	0	0	0	109.9	K529	S24-K529 WeakPolarHBondContact OG-CE 3.31Å; S24-K529 PolarHBondContact OG-NZ 3.15Å
25	I	48	Very low	53.5	Low	149 Å²	149	82.6 Å²	82.6	76%	0.764	48%	0.484	S	S	*	.			trans	-60.6	135.7	170.8	-61	170.8	0	0	0	106.4	G23 A27	G23-I25 PolarHBondContact O-N 3.13Å; I25-A27 PolarHBondContact O-N 3.23Å
26	P	50.9	Low	56.4	Low	42 Å²	42	76.7 Å²	76.7	27%	0.273	45%	0.448	S	S	.	.			trans	-53.4	137.6	178.7	22.1	-34	0	0	0	112.1	T28 D88 F90	P26-T28 PolarHBondContact O-N 3.1Å; P26-D88 HydrophobicContact CB-CB 3.86Å; P26-D88 HydrophobicContact CG-CB 4.39Å; P26-D88 WeakPolarHBondContact CG-OD1 2.65Å; P26-F90 HydrophobicContact CB-CE1 3.92Å; P26-F90 HydrophobicContact CB-CE2 4.21Å; P26-F90 HydrophobicContact CB-CZ 3.63Å
27	A	62.1	Low	59.5	Low	71 Å²	71	74.1 Å²	74.1	59%	0.587	42%	0.421	S	S	*	.	S	Bend	trans	-57	-39.2	177.5	0	0	0	0	0	110.4	I25 Y89	I25-A27 PolarHBondContact O-N 3.23Å; A27-Y89 PolarHBondContact N-O 3.32Å
28	T	76.1	Confident	62.6	Low	22 Å²	22	72.5 Å²	72.5	14%	0.135	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.1	171.5	170.3	-171.2	0	0	0	0	112.1	P26 V30 Y89 E156 L303	P26-T28 PolarHBondContact O-N 3.1Å; T28-V30 HydrophobicContact CG2-CG2 4.44Å; T28-Y89 HydrophobicContact CG2-CD1 3.77Å; T28-Y89 HydrophobicContact CG2-CG 4.5Å; T28-Y89 PolarHBondContact O-N 2.66Å; T28-E156 WeakPolarHBondContact CB-OE1 3.48Å; T28-E156 HydrophobicContact CG2-CG 3.69Å; T28-E156 WeakPolarHBondContact CG2-OE1 3.35Å; T28-E156 VanDerWaalsContact OG1-CD 3.27Å; T28-E156 WeakPolarHBondContact OG1-CG 3.08Å; T28-E156 PolarHBondContact OG1-OE1 2.99Å; T28-L303 HydrophobicContact CG2-CD1 3.79Å
29	K	85.4	Confident	65.6	Low	97 Å²	97	63 Å²	63	42%	0.422	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.7	169.9	-75.6	-175.9	-177.3	-65.1	0	109.8	I86 L87 D88 L157	K29-I86 HydrophobicContact CD-CG2 4.37Å; K29-L87 CarbonylContact C-O 3.47Å; K29-L87 WeakPolarHBondContact CA-O 3.1Å; K29-D88 WeakPolarHBondContact CG-OD1 3.45Å; K29-D88 IonicContact NZ-OD1 3.26Å; K29-D88 PolarHBondContact NZ-OD1 2.97Å; K29-D88 IonicContact NZ-OD2 3.88Å; K29-L157 HydrophobicContact CB-CB 4Å; K29-L157 HydrophobicContact CB-CD1 4.22Å; K29-L157 PolarHBondContact O-N 2.87Å
30	V	87.5	Confident	68.5	Low	0 Å²	0	58 Å²	58	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.6	178.4	175.2	0	0	0	0	109.9	T28 I86 L87 Y89 L124 V128 A154 E155 L303	T28-V30 HydrophobicContact CG2-CG2 4.44Å; V30-I86 WeakPolarHBondContact O-CA 3.38Å; V30-L87 PolarHBondContact N-O 3.03Å; V30-L87 PolarHBondContact O-N 2.99Å; V30-Y89 HydrophobicContact CG2-CG 4.24Å; V30-L124 HydrophobicContact CG1-CD1 4.46Å; V30-V128 HydrophobicContact CG1-CG1 4.46Å; V30-A154 HydrophobicContact CG1-CB 3.6Å; V30-E155 CarbonylContact C-O 3.57Å; V30-E155 VanDerWaalsContact CA-O 3.3Å; V30-E155 WeakPolarHBondContact CA-O 3.34Å; V30-L303 HydrophobicContact CG2-CD1 4.05Å
31	E	87.6	Confident	70.9	Confident	49 Å²	49	56.1 Å²	56.1	23%	0.229	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.3	169.8	-173.8	174	73.4	0	0	110.1	K84 Y85 A154 E155 L157	E31-K84 VanDerWaalsContact CD-CG 3.5Å; E31-K84 HydrophobicContact CG-CB 3.36Å; E31-K84 HydrophobicContact CG-CG 3.78Å; E31-K84 WeakPolarHBondContact OE2-CB 3.45Å; E31-K84 WeakPolarHBondContact OE2-CG 3.44Å; E31-Y85 CarbonylContact C-O 3.53Å; E31-Y85 WeakPolarHBondContact CA-O 3.34Å; E31-A154 CarbonylContact O-C 3.47Å; E31-A154 WeakPolarHBondContact O-CA 3.5Å; E31-E155 PolarHBondContact N-O 2.88Å; E31-E155 PolarHBondContact O-N 2.81Å; E31-L157 HydrophobicContact CB-CD1 3.99Å; E31-L157 HydrophobicContact CB-CD2 3.85Å; E31-L157 HydrophobicContact CB-CG 3.83Å
32	I	88.6	Confident	73.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	121.3	174.2	-57.2	-178.7	0	0	0	109.7	V34 K84 Y85 L87 L97 F99 L124 I127 L152 S153	I32-V34 HydrophobicContact CG2-CG2 4.09Å; I32-K84 WeakPolarHBondContact O-CA 3.47Å; I32-Y85 PolarHBondContact N-O 3.36Å; I32-Y85 PolarHBondContact O-N 2.94Å; I32-Y85 VanDerWaalsContact O-N 3.09Å; I32-L87 HydrophobicContact CD1-CD1 3.55Å; I32-L87 HydrophobicContact CG1-CD1 4.42Å; I32-L97 HydrophobicContact CD1-CD1 4.01Å; I32-F99 HydrophobicContact CD1-CZ 4.37Å; I32-F99 HydrophobicContact CG2-CZ 4.44Å; I32-L124 HydrophobicContact CD1-CD1 3.88Å; I32-L124 HydrophobicContact CG1-CD1 4.43Å; I32-I127 HydrophobicContact CD1-CD1 4.05Å; I32-L152 HydrophobicContact CG2-CD2 4.46Å; I32-S153 CarbonylContact C-O 3.59Å; I32-S153 WeakPolarHBondContact CA-O 3.4Å
33	T	85.1	Confident	74.5	Confident	30 Å²	30	48.4 Å²	48.4	18%	0.184	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	137.2	164	-69.8	0	0	0	0	110.3	K84 L152 S153	T33-K84 HydrophobicContact CG2-CD 4.49Å; T33-K84 VanDerWaalsContact OG1-CD 3.26Å; T33-K84 WeakPolarHBondContact OG1-CD 3.37Å; T33-K84 WeakPolarHBondContact OG1-CE 3.45Å; T33-K84 PolarHBondContact OG1-NZ 2.94Å; T33-L152 WeakPolarHBondContact O-CA 3.4Å; T33-S153 PolarHBondContact N-O 3.11Å; T33-S153 PolarHBondContact O-N 2.83Å
34	V	87.3	Confident	75.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.8	177.3	-174.4	0	0	0	0	110.2	I32 V52 F81 Y85 F99 I150 L152	I32-V34 HydrophobicContact CG2-CG2 4.09Å; V34-V52 HydrophobicContact CG1-CB 4.42Å; V34-V52 HydrophobicContact CG1-CG1 4.25Å; V34-V52 HydrophobicContact CG1-CG2 4.04Å; V34-F81 HydrophobicContact CB-CD2 4.29Å; V34-F81 HydrophobicContact CG1-CD2 4.21Å; V34-F81 WeakPolarHBondContact O-CD2 3.37Å; V34-F81 PolarHBondContact O-N 3.32Å; V34-Y85 HydrophobicContact CG2-CD2 4Å; V34-Y85 HydrophobicContact CG2-CE2 3.78Å; V34-F99 HydrophobicContact CG2-CD1 4.42Å; V34-F99 HydrophobicContact CG2-CE1 4.04Å; V34-I150 HydrophobicContact CG1-CD1 3.82Å; V34-I150 HydrophobicContact CG1-CG1 3.95Å; V34-L152 HydrophobicContact CB-CD2 4.3Å; V34-L152 HydrophobicContact CG1-CD2 3.99Å; V34-L152 HydrophobicContact CG2-CD2 3.73Å
35	S	80.5	Confident	76.9	Confident	12 Å²	12	58.3 Å²	58.3	8%	0.084	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	155.5	167.4	54.4	0	0	0	0	109.7	P79 D80 I151	S35-P79 CarbonylContact C-O 3.49Å; S35-P79 WeakPolarHBondContact CA-O 3.36Å; S35-P79 WeakPolarHBondContact CB-O 3.27Å; S35-D80 WeakPolarHBondContact CB-OD1 3.23Å; S35-I151 PolarHBondContact N-O 3.25Å; S35-I151 PolarHBondContact O-N 3.36Å; S35-I151 WeakPolarHBondContact OG-CB 3.44Å
36	C	87.6	Confident	78	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	154.6	176.2	-55.9	0	0	0	0	110.8	L39 N78 P79 T149	C36-L39 HydrophobicContact CB-CD1 3.89Å; C36-L39 HydrophobicContact CB-CD2 3.68Å; C36-L39 HydrophobicContact CB-CG 3.81Å; C36-N78 CarbonylContact O-C 3.6Å; C36-N78 VanDerWaalsContact O-CA 3.22Å; C36-N78 WeakPolarHBondContact O-CA 3.42Å; C36-P79 HydrophobicContact CB-CG 3.73Å; C36-P79 PolarHBondContact N-O 2.83Å; C36-P79 WeakPolarHBondContact O-CD 3.48Å; C36-T149 CarbonylContact C-O 3.55Å; C36-T149 WeakPolarHBondContact CA-O 2.87Å; C36-T149 WeakPolarHBondContact CB-O 3.41Å
37	R	91.3	Very high	79.3	Confident	67 Å²	67	56.8 Å²	56.8	25%	0.253	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	142.3	174.9	-56.3	-68.5	179.4	-97.6	3.5	111.4	L39 L77 N78 P79 D80 G148 T149 I151	R37-L39 VanDerWaalsContact C-N 3.29Å; R37-L39 PolarHBondContact O-N 3.13Å; R37-L77 CarbonylContact C-O 3.56Å; R37-N78 VanDerWaalsContact CA-OD1 3.24Å; R37-N78 WeakPolarHBondContact CA-OD1 3.13Å; R37-N78 WeakPolarHBondContact CD-OD1 3.1Å; R37-P79 PolarHBondContact NH1-O 2.92Å; R37-D80 IonicContact CZ-OD1 3.27Å; R37-D80 VanDerWaalsContact CZ-OD1 3.27Å; R37-D80 IonicContact CZ-OD2 3.98Å; R37-D80 IonicContact NH1-OD1 2.86Å; R37-D80 PolarHBondContact NH1-OD1 3.16Å; R37-D80 IonicContact NH1-OD2 3.82Å; R37-D80 IonicContact NH2-OD1 3.62Å; R37-D80 PolarHBondContact NH2-OD1 3.38Å; R37-D80 IonicContact NH2-OD2 3.32Å; R37-D80 PolarHBondContact NH2-OD2 2.89Å; R37-G148 WeakPolarHBondContact O-CA 3.38Å; R37-T149 WeakPolarHBondContact CB-OG1 3.2Å; R37-T149 PolarHBondContact N-O 2.87Å; R37-T149 PolarHBondContact O-N 3.02Å; R37-T149 PolarHBondContact O-OG1 2.79Å; R37-I151 HydrophobicContact CG-CD1 3.75Å
38	N	89.6	Confident	80.3	Confident	115 Å²	115	53.4 Å²	53.4	62%	0.615	27%	0.265	S	S	*	.	S	Bend	trans	53.1	43.6	176.9	-52.3	-48.8	0	0	0	113.1	L77 N78 G148	N38-L77 PolarHBondContact N-O 3.1Å; N38-N78 PolarHBondContact N-OD1 2.8Å; N38-G148 WeakPolarHBondContact O-CA 3.34Å
39	L	89.3	Confident	80.8	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.026	27%	0.27	C	S	.	.			trans	-56.7	152.1	176	-67.6	179.4	0	0	0	111.5	C36 R37 D41 P50 L77 P79 V101 L117 L139	C36-L39 HydrophobicContact CB-CD1 3.89Å; C36-L39 HydrophobicContact CB-CD2 3.68Å; C36-L39 HydrophobicContact CB-CG 3.81Å; R37-L39 VanDerWaalsContact C-N 3.29Å; R37-L39 PolarHBondContact O-N 3.13Å; L39-D41 PolarHBondContact O-N 3.04Å; L39-P50 HydrophobicContact CD1-CB 3.61Å; L39-P50 HydrophobicContact CD1-CG 4.06Å; L39-L77 HydrophobicContact CB-CB 4.33Å; L39-L77 HydrophobicContact CB-CD2 4.36Å; L39-L77 PolarHBondContact N-O 2.82Å; L39-P79 HydrophobicContact CD1-CG 3.87Å; L39-V101 HydrophobicContact CD1-CG1 4.19Å; L39-V101 HydrophobicContact CD2-CG1 4.22Å; L39-L117 HydrophobicContact CD1-CD1 4.28Å; L39-L139 HydrophobicContact CD2-CD1 3.42Å; L39-L139 VanDerWaalsContact CD2-CD1 3.42Å
40	L	85.1	Confident	81	Confident	27 Å²	27	49.8 Å²	49.8	14%	0.141	25%	0.25	C	C	.	.			trans	-63.5	123	175.7	177.7	67.3	0	0	0	110.2	R42 S48 L117 I142 K145 C147	L40-R42 HydrophobicContact CD2-CG 4.43Å; L40-R42 HydrophobicContact CG-CG 4.49Å; L40-R42 PolarHBondContact O-N 3.32Å; L40-S48 PolarHBondContact O-OG 2.64Å; L40-L117 HydrophobicContact CB-CD2 4.49Å; L40-L117 WeakPolarHBondContact O-CD2 3.5Å; L40-I142 HydrophobicContact CD2-CD1 3.92Å; L40-K145 HydrophobicContact CD1-CD 4.05Å; L40-K145 HydrophobicContact CD2-CD 3.66Å; L40-C147 PolarHBondContact N-O 3.4Å
41	D	80.9	Confident	81.3	Confident	78 Å²	78	50.5 Å²	50.5	42%	0.417	25%	0.253	S	S	.	.			trans	-77.1	115.8	173.9	-155.4	-6.6	0	0	0	109.8	L39 L77	L39-D41 PolarHBondContact O-N 3.04Å; D41-L77 HydrophobicContact CB-CD1 4.13Å; D41-L77 HydrophobicContact CB-CD2 4.2Å
42	R	70.8	Confident	81.7	Confident	89 Å²	89	48.1 Å²	48.1	34%	0.336	24%	0.242	S	C	.	.			trans	-101.3	-19.6	179.2	-78.4	-72.5	-177.2	161.4	6.6	113	L40 D115 L117	L40-R42 HydrophobicContact CD2-CG 4.43Å; L40-R42 HydrophobicContact CG-CG 4.49Å; L40-R42 PolarHBondContact O-N 3.32Å; R42-D115 HydrophobicContact CG-CB 4.44Å; R42-L117 HydrophobicContact CB-CD2 4.41Å; R42-L117 HydrophobicContact CG-CD2 3.59Å
43	D	64.1	Low	82.2	Confident	45 Å²	45	48.1 Å²	48.1	24%	0.241	24%	0.242	C	C	.	.			trans	-85.5	143.7	-175.2	-87.6	-17.8	0	0	0	112.6	S46	D43-S46 WeakPolarHBondContact CB-O 3.1Å; D43-S46 WeakPolarHBondContact CB-OG 3.24Å; D43-S46 VanDerWaalsContact CG-OG 3.3Å; D43-S46 PolarHBondContact OD2-OG 3.1Å
44	T	59.2	Low	82.8	Confident	123 Å²	123	46.7 Å²	46.7	76%	0.755	23%	0.234	S	C	*	.	S	Bend	trans	-86.9	-19.9	-177.6	-38.3	0	0	0	0	112.3
45	F	57.5	Low	83.2	Confident	204 Å²	204	48 Å²	48	90%	0.895	24%	0.239	S	C	*	.	S	Bend	trans	-137.1	-1.5	-172.6	-60.2	-74.3	0	0	0	114.3
46	S	71.7	Confident	83.9	Confident	56 Å²	56	49.2 Å²	49.2	39%	0.392	25%	0.246	S	C	.	.	S	Bend	trans	-140.4	175.3	177.2	36.6	0	0	0	0	109.1	D43	D43-S46 WeakPolarHBondContact CB-O 3.1Å; D43-S46 WeakPolarHBondContact CB-OG 3.24Å; D43-S46 VanDerWaalsContact CG-OG 3.3Å; D43-S46 PolarHBondContact OD2-OG 3.1Å
47	K	77.9	Confident	84.1	Confident	103 Å²	103	51.5 Å²	51.5	45%	0.448	26%	0.256	S	S	.	.			trans	-93.9	160.4	162	-55.4	170.8	178.4	175.1	0	108.3	N75 L77	K47-N75 WeakPolarHBondContact CB-OD1 3.36Å; K47-N75 WeakPolarHBondContact CG-OD1 3.4Å; K47-N75 PolarHBondContact N-OD1 3.5Å; K47-L77 HydrophobicContact CB-CD2 4.15Å; K47-L77 HydrophobicContact CB-CG 4.26Å; K47-L77 HydrophobicContact CD-CG 4.37Å; K47-L77 HydrophobicContact CG-CG 4.43Å
48	S	83.3	Confident	83.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.			trans	-52.6	151.6	175.1	-61.5	0	0	0	0	115	L40 P50 N75 T76 D103	L40-S48 PolarHBondContact O-OG 2.64Å; S48-P50 WeakPolarHBondContact O-CD 3.5Å; S48-N75 CarbonylContact O-C 3.55Å; S48-N75 WeakPolarHBondContact O-CA 3.25Å; S48-N75 PolarHBondContact O-N 2.8Å; S48-T76 PolarHBondContact O-N 2.69Å; S48-D103 VanDerWaalsContact CA-OD1 3.26Å; S48-D103 WeakPolarHBondContact CA-OD1 3.2Å; S48-D103 VanDerWaalsContact CA-OD2 3.3Å; S48-D103 WeakPolarHBondContact CA-OD2 3.45Å; S48-D103 WeakPolarHBondContact CB-OD1 3.41Å; S48-D103 WeakPolarHBondContact CB-OD2 3.34Å; S48-D103 PolarHBondContact OG-OD2 3.22Å
49	D	86.9	Confident	82.4	Confident	43 Å²	43	47.8 Å²	47.8	23%	0.23	25%	0.252	C	S	.	.			trans	-105.9	74.6	173.2	-66.3	-20.6	0	0	0	109.7	V72 I73 D74 N75 D103 I104	D49-V72 HydrophobicContact CB-CG1 3.94Å; D49-I73 WeakPolarHBondContact CA-O 3.38Å; D49-D74 VanDerWaalsContact OD1-CA 3.28Å; D49-D74 WeakPolarHBondContact OD1-CA 3.37Å; D49-N75 PolarHBondContact OD1-N 3.39Å; D49-D103 PolarHBondContact N-OD1 3.37Å; D49-I104 PolarHBondContact O-N 3Å
50	P	89.8	Confident	81.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	143	-168.4	25.8	-39.3	0	0	0	115	L39 S48 I73 T76 P79 F81 Y102	L39-P50 HydrophobicContact CD1-CB 3.61Å; L39-P50 HydrophobicContact CD1-CG 4.06Å; S48-P50 WeakPolarHBondContact O-CD 3.5Å; P50-I73 WeakPolarHBondContact CD-O 3.19Å; P50-I73 PolarHBondContact O-N 3.24Å; P50-T76 VanDerWaalsContact CD-O 3.3Å; P50-T76 WeakPolarHBondContact CD-O 3.4Å; P50-T76 HydrophobicContact CG-CG2 3.87Å; P50-T76 WeakPolarHBondContact CG-O 3.21Å; P50-P79 HydrophobicContact CB-CB 4.46Å; P50-P79 HydrophobicContact CB-CG 3.97Å; P50-P79 HydrophobicContact CG-CB 3.71Å; P50-P79 HydrophobicContact CG-CG 3.57Å; P50-F81 HydrophobicContact CB-CZ 4.25Å; P50-F81 WeakPolarHBondContact O-CE1 3.34Å; P50-Y102 CarbonylContact C-O 3.47Å; P50-Y102 VanDerWaalsContact CA-O 3.26Å; P50-Y102 WeakPolarHBondContact CA-O 3.35Å
51	L	93.9	Very high	80.4	Confident	14 Å²	14	55 Å²	55	7%	0.073	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	142.6	167.4	174.5	145.5	0	0	0	110	V53 R69 V72 V101 Y102 I104	L51-V53 HydrophobicContact CD2-CG2 3.49Å; L51-V53 VanDerWaalsContact CD2-CG2 3.49Å; L51-R69 HydrophobicContact CD1-CB 4.33Å; L51-R69 HydrophobicContact CD2-CB 4.24Å; L51-R69 HydrophobicContact CD2-CG 4.47Å; L51-V72 HydrophobicContact CB-CG2 4.24Å; L51-V72 HydrophobicContact CD1-CG2 3.7Å; L51-V101 WeakPolarHBondContact O-CA 3.33Å; L51-Y102 PolarHBondContact N-O 2.91Å; L51-Y102 PolarHBondContact O-N 2.94Å; L51-I104 HydrophobicContact CB-CD1 3.99Å; L51-I104 HydrophobicContact CB-CG1 3.68Å; L51-I104 HydrophobicContact CD1-CD1 4.48Å; L51-I104 HydrophobicContact CD1-CG1 4.46Å
52	V	95.6	Very high	80	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.4	175.4	-175.5	0	0	0	0	110.4	V34 R69 T70 F81 Y85 F99 D100 V101 I150	V34-V52 HydrophobicContact CG1-CB 4.42Å; V34-V52 HydrophobicContact CG1-CG1 4.25Å; V34-V52 HydrophobicContact CG1-CG2 4.04Å; V52-R69 WeakPolarHBondContact O-CA 3.36Å; V52-T70 HydrophobicContact CB-CG2 4.02Å; V52-T70 PolarHBondContact N-OG1 3.4Å; V52-T70 PolarHBondContact O-N 3.2Å; V52-F81 HydrophobicContact CG2-CD2 4.26Å; V52-F81 HydrophobicContact CG2-CE2 3.53Å; V52-F81 HydrophobicContact CG2-CZ 3.76Å; V52-Y85 PolarHBondContact O-OH 2.77Å; V52-F99 HydrophobicContact CG1-CB 4.15Å; V52-F99 HydrophobicContact CG1-CD1 3.99Å; V52-D100 CarbonylContact C-O 3.53Å; V52-D100 WeakPolarHBondContact CA-O 3.47Å; V52-V101 HydrophobicContact CG2-CG1 4.4Å; V52-V101 HydrophobicContact CG2-CG2 4.21Å; V52-I150 HydrophobicContact CG1-CD1 4.47Å
53	V	97.9	Very high	80.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.9	174.1	-170.9	0	0	0	0	108.7	L51 Y55 E66 R69 F99 D100 Y102 L111	L51-V53 HydrophobicContact CD2-CG2 3.49Å; L51-V53 VanDerWaalsContact CD2-CG2 3.49Å; V53-Y55 HydrophobicContact CB-CD2 4.48Å; V53-Y55 HydrophobicContact CB-CE2 3.76Å; V53-Y55 HydrophobicContact CG1-CD2 4Å; V53-Y55 HydrophobicContact CG1-CE1 4.41Å; V53-Y55 HydrophobicContact CG1-CE2 3.33Å; V53-E66 HydrophobicContact CG1-CG 3.67Å; V53-R69 HydrophobicContact CG1-CG 4.18Å; V53-R69 HydrophobicContact CG2-CG 4.09Å; V53-F99 WeakPolarHBondContact O-CA 3.31Å; V53-D100 PolarHBondContact N-O 2.57Å; V53-D100 PolarHBondContact O-N 3.34Å; V53-Y102 HydrophobicContact CG2-CD2 3.95Å; V53-Y102 HydrophobicContact CG2-CE2 4Å; V53-L111 HydrophobicContact CG1-CD1 4.48Å; V53-L111 HydrophobicContact CG2-CD1 4Å; V53-L111 HydrophobicContact CG2-CD2 3.97Å
54	L	97.9	Very high	82.2	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	130.5	171.9	173.4	59.3	0	0	0	109.5	F67 G68 Y85 L87 L97 F99	L54-F67 HydrophobicContact CB-CB 4.39Å; L54-F67 HydrophobicContact CD2-CB 4.22Å; L54-F67 HydrophobicContact CD2-CD1 3.77Å; L54-F67 HydrophobicContact CD2-CG 4.16Å; L54-F67 HydrophobicContact CG-CB 3.97Å; L54-F67 HydrophobicContact CG-CD1 4.41Å; L54-F67 HydrophobicContact CG-CG 4.45Å; L54-F67 WeakPolarHBondContact O-CB 3.39Å; L54-F67 PolarHBondContact O-N 3.36Å; L54-G68 PolarHBondContact N-O 2.88Å; L54-G68 PolarHBondContact O-N 3.19Å; L54-Y85 HydrophobicContact CB-CD1 4.05Å; L54-Y85 HydrophobicContact CB-CD2 4.27Å; L54-Y85 HydrophobicContact CB-CE1 3.74Å; L54-Y85 HydrophobicContact CB-CE2 3.98Å; L54-Y85 HydrophobicContact CB-CG 4.28Å; L54-Y85 HydrophobicContact CD2-CD1 3.88Å; L54-Y85 HydrophobicContact CD2-CD2 3.99Å; L54-Y85 HydrophobicContact CD2-CE1 4.44Å; L54-Y85 HydrophobicContact CD2-CG 3.6Å; L54-L87 HydrophobicContact CD2-CD1 4.24Å; L54-L97 HydrophobicContact CD1-CB 4.08Å; L54-L97 HydrophobicContact CD1-CD2 4.23Å; L54-F99 HydrophobicContact CB-CD1 4.4Å; L54-F99 HydrophobicContact CB-CE1 4.35Å; L54-F99 HydrophobicContact CD1-CD1 4.03Å; L54-F99 HydrophobicContact CD1-CD2 4.28Å; L54-F99 HydrophobicContact CD1-CE1 3.7Å; L54-F99 HydrophobicContact CD1-CE2 3.94Å; L54-F99 HydrophobicContact CD1-CG 4.32Å; L54-F99 HydrophobicContact CD1-CZ 3.65Å; L54-F99 HydrophobicContact CD2-CE1 4.48Å; L54-F99 HydrophobicContact CG-CE1 4.38Å
55	Y	97.3	Very high	83.8	Confident	27 Å²	27	62.1 Å²	62.1	11%	0.106	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	141.8	167.7	-60.1	-99.6	0	0	0	110.4	V53 W64 R65 E66 R98 D100 L111	V53-Y55 HydrophobicContact CB-CD2 4.48Å; V53-Y55 HydrophobicContact CB-CE2 3.76Å; V53-Y55 HydrophobicContact CG1-CD2 4Å; V53-Y55 HydrophobicContact CG1-CE1 4.41Å; V53-Y55 HydrophobicContact CG1-CE2 3.33Å; Y55-W64 HydrophobicContact CD1-CB 4.43Å; Y55-R65 CarbonylContact C-O 3.58Å; Y55-R65 WeakPolarHBondContact CA-O 3.49Å; Y55-E66 HydrophobicContact CD1-CB 4.08Å; Y55-E66 HydrophobicContact CE1-CB 3.85Å; Y55-E66 HydrophobicContact CE1-CG 4.37Å; Y55-R98 VanDerWaalsContact CE2-NH2 3.29Å; Y55-R98 PolarHBondContact N-O 3.48Å; Y55-R98 PolarHBondContact O-N 3.09Å; Y55-D100 HydrophobicContact CE2-CB 4.07Å; Y55-D100 WeakPolarHBondContact CE2-OD2 3.31Å; Y55-L111 VanDerWaalsContact OH-CD1 3.31Å; Y55-L111 WeakPolarHBondContact OH-CD1 3.47Å
56	T	94.9	Very high	85.7	Confident	38 Å²	38	56.6 Å²	56.6	23%	0.233	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	151.2	172.4	54.9	0	0	0	0	109.5	W64 R65 F67 L87 L97	T56-W64 WeakPolarHBondContact O-CA 3.32Å; T56-R65 PolarHBondContact N-O 3.4Å; T56-R65 PolarHBondContact O-N 3.23Å; T56-F67 HydrophobicContact CG2-CB 3.97Å; T56-F67 HydrophobicContact CG2-CD2 3.86Å; T56-F67 HydrophobicContact CG2-CG 4.1Å; T56-L87 HydrophobicContact CG2-CD2 4.2Å; T56-L97 HydrophobicContact CG2-CD2 3.97Å
57	Q	91	Very high	86.8	Confident	47 Å²	47	58.2 Å²	58.2	22%	0.22	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.5	176.3	-163.8	-178.5	43.4	0	0	109.8	K62 W64 N96	Q57-K62 PolarHBondContact NE2-O 2.96Å; Q57-W64 HydrophobicContact CB-CD2 4.18Å; Q57-W64 HydrophobicContact CB-CE3 3.85Å; Q57-W64 HydrophobicContact CB-CH2 4.13Å; Q57-W64 HydrophobicContact CB-CZ2 4.42Å; Q57-W64 HydrophobicContact CB-CZ3 3.82Å; Q57-W64 HydrophobicContact CG-CD2 4.48Å; Q57-N96 HydrophobicContact CB-CB 4.05Å; Q57-N96 PolarHBondContact N-O 2.84Å; Q57-N96 PolarHBondContact OE1-ND2 2.82Å
58	G	77.3	Confident	87.5	Confident	36 Å²	36	54 Å²	54	37%	0.371	27%	0.266	S	S	.	.			trans	-71.8	143.1	174.4	0	0	0	0	0	111.9	E60 S61 K62	G58-E60 PolarHBondContact O-N 3.48Å; G58-S61 PolarHBondContact O-N 2.86Å; G58-K62 PolarHBondContact O-N 3.28Å
59	V	67.9	Low	88.2	Confident	68 Å²	68	56.9 Å²	56.9	41%	0.412	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-38.1	-178.6	-178.4	0	0	0	0	112.2	A525	V59-A525 HydrophobicContact CG1-CB 3.53Å
60	E	64.6	Low	88.3	Confident	138 Å²	138	55 Å²	55	65%	0.645	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-41.3	-175.2	-66.7	-169.3	160.2	0	0	114.4	G58 L522	G58-E60 PolarHBondContact O-N 3.48Å; E60-L522 HydrophobicContact CB-CD1 4.49Å; E60-L522 HydrophobicContact CG-CD1 3.89Å; E60-L522 HydrophobicContact CG-CD2 3.81Å; E60-L522 HydrophobicContact CG-CG 4.08Å
61	S	67.1	Low	88.2	Confident	46 Å²	46	57.7 Å²	57.7	32%	0.322	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-16	-164.8	64.2	0	0	0	0	113.7	G58 Q63	G58-S61 PolarHBondContact O-N 2.86Å; S61-Q63 WeakPolarHBondContact O-CG 3.45Å; S61-Q63 PolarHBondContact O-N 2.74Å; S61-Q63 PolarHBondContact OG-N 3.13Å
62	K	74.3	Confident	88	Confident	131 Å²	131	59.6 Å²	59.6	57%	0.57	29%	0.292	S	S	*	.			trans	48.7	12.6	-166.9	-64	-172.1	178	-177.3	0	113.8	Q57 G58	Q57-K62 PolarHBondContact NE2-O 2.96Å; G58-K62 PolarHBondContact O-N 3.28Å
63	Q	87.2	Confident	86.9	Confident	124 Å²	124	61.7 Å²	61.7	58%	0.579	30%	0.302	S	S	*	.			trans	-90.3	132.1	-179.5	-74.9	-179.5	-7.8	0	0	109.3	S61	S61-Q63 WeakPolarHBondContact O-CG 3.45Å; S61-Q63 PolarHBondContact O-N 2.74Å; S61-Q63 PolarHBondContact OG-N 3.13Å
64	W	93.1	Very high	86.1	Confident	75 Å²	75	67.5 Å²	67.5	28%	0.284	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	129.1	171.1	-67.1	103	0	0	0	109.7	Y55 T56 Q57 N96 R98 Y121	Y55-W64 HydrophobicContact CD1-CB 4.43Å; T56-W64 WeakPolarHBondContact O-CA 3.32Å; Q57-W64 HydrophobicContact CB-CD2 4.18Å; Q57-W64 HydrophobicContact CB-CE3 3.85Å; Q57-W64 HydrophobicContact CB-CH2 4.13Å; Q57-W64 HydrophobicContact CB-CZ2 4.42Å; Q57-W64 HydrophobicContact CB-CZ3 3.82Å; Q57-W64 HydrophobicContact CG-CD2 4.48Å; W64-N96 HydrophobicContact CH2-CB 3.93Å; W64-N96 HydrophobicContact CZ3-CB 4.43Å; W64-R98 HydrophobicContact CD2-CB 4.28Å; W64-R98 HydrophobicContact CE3-CB 3.81Å; W64-R98 HydrophobicContact CH2-CB 3.74Å; W64-R98 HydrophobicContact CZ2-CB 4.23Å; W64-R98 HydrophobicContact CZ3-CB 3.53Å; W64-Y121 HydrophobicContact CH2-CD1 4.07Å; W64-Y121 HydrophobicContact CH2-CE1 4.4Å; W64-Y121 AromaticContact CZ2-CD1 3.74Å; W64-Y121 HydrophobicContact CZ2-CD1 3.74Å; W64-Y121 AromaticContact CZ2-CE1 3.73Å; W64-Y121 HydrophobicContact CZ2-CE1 3.73Å
65	R	93.7	Very high	85.3	Confident	155 Å²	155	71.8 Å²	71.8	59%	0.585	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	132.9	175.3	-65.5	-177.1	-177.9	173.9	1.6	108.9	Y55 T56 F67	Y55-R65 CarbonylContact C-O 3.58Å; Y55-R65 WeakPolarHBondContact CA-O 3.49Å; T56-R65 PolarHBondContact N-O 3.4Å; T56-R65 PolarHBondContact O-N 3.23Å; R65-F67 PolarHBondContact O-N 3.2Å
66	E	95.6	Very high	84.4	Confident	88 Å²	88	71.9 Å²	71.9	41%	0.411	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	120.9	173.9	-171.6	-177.7	139.1	0	0	108.6	V53 Y55 R69	V53-E66 HydrophobicContact CG1-CG 3.67Å; Y55-E66 HydrophobicContact CD1-CB 4.08Å; Y55-E66 HydrophobicContact CE1-CB 3.85Å; Y55-E66 HydrophobicContact CE1-CG 4.37Å; E66-R69 WeakPolarHBondContact OE1-CG 3.27Å; E66-R69 IonicContact OE1-CZ 3.8Å; E66-R69 IonicContact OE1-NE 3.66Å; E66-R69 PolarHBondContact OE1-NE 2.89Å; E66-R69 IonicContact OE1-NH2 3.65Å; E66-R69 PolarHBondContact OE1-NH2 3.41Å; E66-R69 IonicContact OE2-CZ 2.76Å; E66-R69 IonicContact OE2-NE 2.72Å; E66-R69 PolarHBondContact OE2-NE 3.06Å; E66-R69 IonicContact OE2-NH2 3.46Å; E66-R69 PolarHBondContact OE2-NH2 3Å
67	F	94.8	Very high	83.9	Confident	90 Å²	90	71.6 Å²	71.6	40%	0.395	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	-42.8	176	-175.4	-91.6	0	0	0	110.7	L54 T56 R65 Y85 I86 L87	L54-F67 HydrophobicContact CB-CB 4.39Å; L54-F67 HydrophobicContact CD2-CB 4.22Å; L54-F67 HydrophobicContact CD2-CD1 3.77Å; L54-F67 HydrophobicContact CD2-CG 4.16Å; L54-F67 HydrophobicContact CG-CB 3.97Å; L54-F67 HydrophobicContact CG-CD1 4.41Å; L54-F67 HydrophobicContact CG-CG 4.45Å; L54-F67 WeakPolarHBondContact O-CB 3.39Å; L54-F67 PolarHBondContact O-N 3.36Å; T56-F67 HydrophobicContact CG2-CB 3.97Å; T56-F67 HydrophobicContact CG2-CD2 3.86Å; T56-F67 HydrophobicContact CG2-CG 4.1Å; R65-F67 PolarHBondContact O-N 3.2Å; F67-Y85 HydrophobicContact CD1-CD1 4.05Å; F67-Y85 HydrophobicContact CE1-CD1 4.4Å; F67-I86 VanDerWaalsContact CZ-O 3.24Å; F67-I86 WeakPolarHBondContact CZ-O 3.29Å; F67-L87 HydrophobicContact CD1-CD2 4.19Å; F67-L87 HydrophobicContact CD2-CD2 3.83Å; F67-L87 HydrophobicContact CE1-CD2 3.82Å; F67-L87 HydrophobicContact CE2-CD2 3.43Å; F67-L87 VanDerWaalsContact CE2-CD2 3.43Å; F67-L87 HydrophobicContact CG-CD2 4.21Å; F67-L87 HydrophobicContact CZ-CD2 3.43Å; F67-L87 VanDerWaalsContact CZ-CD2 3.43Å; F67-L87 HydrophobicContact CZ-CG 4.35Å
68	G	94.4	Very high	83.4	Confident	15 Å²	15	72.6 Å²	72.6	16%	0.155	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.1	179.1	175.7	0	0	0	0	0	113.3	L54 Y85	L54-G68 PolarHBondContact N-O 2.88Å; L54-G68 PolarHBondContact O-N 3.19Å; G68-Y85 WeakPolarHBondContact O-CE1 3.28Å; G68-Y85 PolarHBondContact O-OH 3.18Å
69	R	96.1	Very high	83.6	Confident	59 Å²	59	70.9 Å²	70.9	22%	0.223	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.1	-177.6	-51.9	-172.9	-172.3	-177.4	0	111.2	L51 V52 V53 E66 R83 P109	L51-R69 HydrophobicContact CD1-CB 4.33Å; L51-R69 HydrophobicContact CD2-CB 4.24Å; L51-R69 HydrophobicContact CD2-CG 4.47Å; V52-R69 WeakPolarHBondContact O-CA 3.36Å; V53-R69 HydrophobicContact CG1-CG 4.18Å; V53-R69 HydrophobicContact CG2-CG 4.09Å; E66-R69 WeakPolarHBondContact OE1-CG 3.27Å; E66-R69 IonicContact OE1-CZ 3.8Å; E66-R69 IonicContact OE1-NE 3.66Å; E66-R69 PolarHBondContact OE1-NE 2.89Å; E66-R69 IonicContact OE1-NH2 3.65Å; E66-R69 PolarHBondContact OE1-NH2 3.41Å; E66-R69 IonicContact OE2-CZ 2.76Å; E66-R69 IonicContact OE2-NE 2.72Å; E66-R69 PolarHBondContact OE2-NE 3.06Å; E66-R69 IonicContact OE2-NH2 3.46Å; E66-R69 PolarHBondContact OE2-NH2 3Å; R69-R83 VanDerWaalsContact O-CD 3.3Å; R69-R83 WeakPolarHBondContact O-CD 3.44Å; R69-R83 PolarHBondContact O-NE 3.32Å; R69-R83 PolarHBondContact O-NH1 2.89Å; R69-P109 PolarHBondContact NH1-O 3.46Å
70	T	90.1	Very high	83.9	Confident	5 Å²	5	72.2 Å²	72.2	3%	0.031	35%	0.351	C	S	.	.			trans	-69.4	175.2	166.4	61.9	0	0	0	0	111	V52 F81 Y85	V52-T70 HydrophobicContact CB-CG2 4.02Å; V52-T70 PolarHBondContact N-OG1 3.4Å; V52-T70 PolarHBondContact O-N 3.2Å; T70-F81 HydrophobicContact CG2-CB 3.95Å; T70-F81 HydrophobicContact CG2-CD1 4Å; T70-F81 HydrophobicContact CG2-CD2 4.38Å; T70-F81 HydrophobicContact CG2-CG 3.86Å; T70-F81 WeakPolarHBondContact OG1-CD1 3.17Å; T70-F81 WeakPolarHBondContact OG1-CE1 3.35Å; T70-Y85 HydrophobicContact CG2-CE2 4.11Å; T70-Y85 WeakPolarHBondContact CG2-OH 3.37Å; T70-Y85 PolarHBondContact N-OH 2.93Å
71	E	87.7	Confident	84.5	Confident	55 Å²	55	65.9 Å²	65.9	26%	0.257	32%	0.321	S	S	.	.			trans	-65.2	163.4	156.8	73.8	-77.2	-172	0	0	111.8	I73 F81 V82 R83	E71-I73 HydrophobicContact CG-CG1 4.32Å; E71-F81 WeakPolarHBondContact O-CD1 3.35Å; E71-F81 WeakPolarHBondContact O-CE1 3.13Å; E71-F81 WeakPolarHBondContact OE1-CA 3.44Å; E71-V82 WeakPolarHBondContact OE1-CB 3.35Å; E71-V82 PolarHBondContact OE1-N 2.98Å; E71-R83 WeakPolarHBondContact OE2-CB 3.22Å; E71-R83 PolarHBondContact OE2-N 3.02Å
72	V	88.6	Confident	84.7	Confident	55 Å²	55	69.2 Å²	69.2	33%	0.333	34%	0.339	S	S	.	.			trans	-87.6	138.8	169.3	-172.7	0	0	0	0	108.1	D49 L51 I104	D49-V72 HydrophobicContact CB-CG1 3.94Å; L51-V72 HydrophobicContact CB-CG2 4.24Å; L51-V72 HydrophobicContact CD1-CG2 3.7Å; V72-I104 HydrophobicContact CG1-CB 3.99Å; V72-I104 HydrophobicContact CG1-CG1 4.12Å; V72-I104 HydrophobicContact CG2-CB 4.3Å; V72-I104 HydrophobicContact CG2-CG1 3.94Å; V72-I104 HydrophobicContact CG2-CG2 4.24Å
73	I	74.1	Confident	84.6	Confident	43 Å²	43	70 Å²	70	22%	0.221	34%	0.339	C	S	.	.			trans	-117.5	118.4	174.2	-59.5	177.5	0	0	0	108.8	D49 P50 E71 T76 P79 D80 F81	D49-I73 WeakPolarHBondContact CA-O 3.38Å; P50-I73 WeakPolarHBondContact CD-O 3.19Å; P50-I73 PolarHBondContact O-N 3.24Å; E71-I73 HydrophobicContact CG-CG1 4.32Å; I73-T76 HydrophobicContact CB-CG2 4.08Å; I73-T76 HydrophobicContact CG2-CG2 3.52Å; I73-P79 HydrophobicContact CB-CB 4.38Å; I73-P79 HydrophobicContact CD1-CB 3.8Å; I73-D80 VanDerWaalsContact CD1-O 3.25Å; I73-D80 WeakPolarHBondContact CD1-O 3.4Å; I73-F81 HydrophobicContact CD1-CD1 3.62Å; I73-F81 HydrophobicContact CD1-CE1 3.85Å; I73-F81 HydrophobicContact CD1-CG 4.19Å; I73-F81 HydrophobicContact CG1-CD1 4.04Å; I73-F81 HydrophobicContact CG1-CE1 4.01Å
74	D	80.9	Confident	84.3	Confident	122 Å²	122	67 Å²	67	65%	0.652	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	137.6	-172.7	-53.6	-13.7	0	0	0	112.4	D49 T76	D49-D74 VanDerWaalsContact OD1-CA 3.28Å; D49-D74 WeakPolarHBondContact OD1-CA 3.37Å; D74-T76 PolarHBondContact O-N 3.07Å
75	N	80.4	Confident	84.2	Confident	90 Å²	90	63.8 Å²	63.8	48%	0.481	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	52	164.1	-166.5	16.3	0	0	0	114.4	K47 S48 D49	K47-N75 WeakPolarHBondContact CB-OD1 3.36Å; K47-N75 WeakPolarHBondContact CG-OD1 3.4Å; K47-N75 PolarHBondContact N-OD1 3.5Å; S48-N75 CarbonylContact O-C 3.55Å; S48-N75 WeakPolarHBondContact O-CA 3.25Å; S48-N75 PolarHBondContact O-N 2.8Å; D49-N75 PolarHBondContact OD1-N 3.39Å
76	T	79.1	Confident	83.9	Confident	29 Å²	29	60.5 Å²	60.5	18%	0.178	31%	0.305	C	S	.	.			trans	-144.8	140.6	179.4	-170.8	0	0	0	0	113.7	S48 P50 I73 D74 N78 P79	S48-T76 PolarHBondContact O-N 2.69Å; P50-T76 VanDerWaalsContact CD-O 3.3Å; P50-T76 WeakPolarHBondContact CD-O 3.4Å; P50-T76 HydrophobicContact CG-CG2 3.87Å; P50-T76 WeakPolarHBondContact CG-O 3.21Å; I73-T76 HydrophobicContact CB-CG2 4.08Å; I73-T76 HydrophobicContact CG2-CG2 3.52Å; D74-T76 PolarHBondContact O-N 3.07Å; T76-N78 PolarHBondContact OG1-N 2.94Å; T76-N78 VanDerWaalsContact OG1-N 3.1Å; T76-P79 HydrophobicContact CG2-CB 3.93Å
77	L	83.5	Confident	83.6	Confident	32 Å²	32	57 Å²	57	17%	0.168	29%	0.289	C	S	.	.	S	Bend	trans	-97.5	-0.3	169.8	-54	-179.5	0	0	0	112.3	R37 N38 L39 D41 K47 P79	R37-L77 CarbonylContact C-O 3.56Å; N38-L77 PolarHBondContact N-O 3.1Å; L39-L77 HydrophobicContact CB-CB 4.33Å; L39-L77 HydrophobicContact CB-CD2 4.36Å; L39-L77 PolarHBondContact N-O 2.82Å; D41-L77 HydrophobicContact CB-CD1 4.13Å; D41-L77 HydrophobicContact CB-CD2 4.2Å; K47-L77 HydrophobicContact CB-CD2 4.15Å; K47-L77 HydrophobicContact CB-CG 4.26Å; K47-L77 HydrophobicContact CD-CG 4.37Å; K47-L77 HydrophobicContact CG-CG 4.43Å; L77-P79 VanDerWaalsContact C-CD 3.47Å
78	N	81.8	Confident	83.3	Confident	68 Å²	68	55.5 Å²	55.5	36%	0.364	29%	0.285	S	S	.	.	S	Bend	trans	-133	58.6	-176.5	-59.7	-72.8	0	0	0	111.3	C36 R37 N38 T76	C36-N78 CarbonylContact O-C 3.6Å; C36-N78 VanDerWaalsContact O-CA 3.22Å; C36-N78 WeakPolarHBondContact O-CA 3.42Å; R37-N78 VanDerWaalsContact CA-OD1 3.24Å; R37-N78 WeakPolarHBondContact CA-OD1 3.13Å; R37-N78 WeakPolarHBondContact CD-OD1 3.1Å; N38-N78 PolarHBondContact N-OD1 2.8Å; T76-N78 PolarHBondContact OG1-N 2.94Å; T76-N78 VanDerWaalsContact OG1-N 3.1Å
79	P	80.1	Confident	83.1	Confident	1 Å²	1	55 Å²	55	1%	0.006	28%	0.278	C	S	.	.			trans	-69.1	143.5	-177.2	30.1	-37.5	0	0	0	112.6	S35 C36 R37 L39 P50 I73 T76 L77 F81	S35-P79 CarbonylContact C-O 3.49Å; S35-P79 WeakPolarHBondContact CA-O 3.36Å; S35-P79 WeakPolarHBondContact CB-O 3.27Å; C36-P79 HydrophobicContact CB-CG 3.73Å; C36-P79 PolarHBondContact N-O 2.83Å; C36-P79 WeakPolarHBondContact O-CD 3.48Å; R37-P79 PolarHBondContact NH1-O 2.92Å; L39-P79 HydrophobicContact CD1-CG 3.87Å; P50-P79 HydrophobicContact CB-CB 4.46Å; P50-P79 HydrophobicContact CB-CG 3.97Å; P50-P79 HydrophobicContact CG-CB 3.71Å; P50-P79 HydrophobicContact CG-CG 3.57Å; I73-P79 HydrophobicContact CB-CB 4.38Å; I73-P79 HydrophobicContact CD1-CB 3.8Å; T76-P79 HydrophobicContact CG2-CB 3.93Å; L77-P79 VanDerWaalsContact C-CD 3.47Å; P79-F81 HydrophobicContact CB-CD2 4.37Å; P79-F81 HydrophobicContact CB-CE1 4.12Å; P79-F81 HydrophobicContact CB-CE2 3.69Å; P79-F81 HydrophobicContact CB-CZ 3.56Å; P79-F81 HydrophobicContact CG-CE2 3.64Å; P79-F81 HydrophobicContact CG-CZ 3.67Å
80	D	74.4	Confident	82.7	Confident	95 Å²	95	53.5 Å²	53.5	51%	0.508	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-119.8	111.6	166	-69.2	-51.6	0	0	0	108	S35 R37 I73	S35-D80 WeakPolarHBondContact CB-OD1 3.23Å; R37-D80 IonicContact CZ-OD1 3.27Å; R37-D80 VanDerWaalsContact CZ-OD1 3.27Å; R37-D80 IonicContact CZ-OD2 3.98Å; R37-D80 IonicContact NH1-OD1 2.86Å; R37-D80 PolarHBondContact NH1-OD1 3.16Å; R37-D80 IonicContact NH1-OD2 3.82Å; R37-D80 IonicContact NH2-OD1 3.62Å; R37-D80 PolarHBondContact NH2-OD1 3.38Å; R37-D80 IonicContact NH2-OD2 3.32Å; R37-D80 PolarHBondContact NH2-OD2 2.89Å; I73-D80 VanDerWaalsContact CD1-O 3.25Å; I73-D80 WeakPolarHBondContact CD1-O 3.4Å
81	F	78.1	Confident	82.6	Confident	5 Å²	5	53.3 Å²	53.3	2%	0.022	27%	0.272	C	S	.	.			trans	-88	132.5	-172.6	-58.9	-83.7	0	0	0	111.9	V34 P50 V52 T70 E71 I73 P79 K84	V34-F81 HydrophobicContact CB-CD2 4.29Å; V34-F81 HydrophobicContact CG1-CD2 4.21Å; V34-F81 WeakPolarHBondContact O-CD2 3.37Å; V34-F81 PolarHBondContact O-N 3.32Å; P50-F81 HydrophobicContact CB-CZ 4.25Å; P50-F81 WeakPolarHBondContact O-CE1 3.34Å; V52-F81 HydrophobicContact CG2-CD2 4.26Å; V52-F81 HydrophobicContact CG2-CE2 3.53Å; V52-F81 HydrophobicContact CG2-CZ 3.76Å; T70-F81 HydrophobicContact CG2-CB 3.95Å; T70-F81 HydrophobicContact CG2-CD1 4Å; T70-F81 HydrophobicContact CG2-CD2 4.38Å; T70-F81 HydrophobicContact CG2-CG 3.86Å; T70-F81 WeakPolarHBondContact OG1-CD1 3.17Å; T70-F81 WeakPolarHBondContact OG1-CE1 3.35Å; E71-F81 WeakPolarHBondContact O-CD1 3.35Å; E71-F81 WeakPolarHBondContact O-CE1 3.13Å; E71-F81 WeakPolarHBondContact OE1-CA 3.44Å; I73-F81 HydrophobicContact CD1-CD1 3.62Å; I73-F81 HydrophobicContact CD1-CE1 3.85Å; I73-F81 HydrophobicContact CD1-CG 4.19Å; I73-F81 HydrophobicContact CG1-CD1 4.04Å; I73-F81 HydrophobicContact CG1-CE1 4.01Å; P79-F81 HydrophobicContact CB-CD2 4.37Å; P79-F81 HydrophobicContact CB-CE1 4.12Å; P79-F81 HydrophobicContact CB-CE2 3.69Å; P79-F81 HydrophobicContact CB-CZ 3.56Å; P79-F81 HydrophobicContact CG-CE2 3.64Å; P79-F81 HydrophobicContact CG-CZ 3.67Å; F81-K84 PolarHBondContact O-NZ 3.36Å
82	V	69.9	Low	82.6	Confident	116 Å²	116	51.7 Å²	51.7	70%	0.703	27%	0.265	S	S	*	.			trans	-75	-45.7	174.4	179.9	0	0	0	0	110.1	E71 K84	E71-V82 WeakPolarHBondContact OE1-CB 3.35Å; E71-V82 PolarHBondContact OE1-N 2.98Å; V82-K84 WeakPolarHBondContact O-CD 3.44Å; V82-K84 WeakPolarHBondContact O-CE 3.35Å; V82-K84 WeakPolarHBondContact O-CG 3.19Å; V82-K84 PolarHBondContact O-N 3.09Å
83	R	73.9	Confident	82.6	Confident	147 Å²	147	51.7 Å²	51.7	56%	0.555	26%	0.261	S	S	*	.			trans	-68.1	132.5	-178.9	-171.2	170.5	-176	-177.1	7.3	110.6	R69 E71	R69-R83 VanDerWaalsContact O-CD 3.3Å; R69-R83 WeakPolarHBondContact O-CD 3.44Å; R69-R83 PolarHBondContact O-NE 3.32Å; R69-R83 PolarHBondContact O-NH1 2.89Å; E71-R83 WeakPolarHBondContact OE2-CB 3.22Å; E71-R83 PolarHBondContact OE2-N 3.02Å
84	K	80.5	Confident	83.2	Confident	63 Å²	63	53.2 Å²	53.2	27%	0.274	27%	0.266	S	S	.	.			trans	-108.8	156.6	-178.4	-47.2	-59.4	-176.4	-173	0	111.3	E31 I32 T33 F81 V82	E31-K84 VanDerWaalsContact CD-CG 3.5Å; E31-K84 HydrophobicContact CG-CB 3.36Å; E31-K84 HydrophobicContact CG-CG 3.78Å; E31-K84 WeakPolarHBondContact OE2-CB 3.45Å; E31-K84 WeakPolarHBondContact OE2-CG 3.44Å; I32-K84 WeakPolarHBondContact O-CA 3.47Å; T33-K84 HydrophobicContact CG2-CD 4.49Å; T33-K84 VanDerWaalsContact OG1-CD 3.26Å; T33-K84 WeakPolarHBondContact OG1-CD 3.37Å; T33-K84 WeakPolarHBondContact OG1-CE 3.45Å; T33-K84 PolarHBondContact OG1-NZ 2.94Å; F81-K84 PolarHBondContact O-NZ 3.36Å; V82-K84 WeakPolarHBondContact O-CD 3.44Å; V82-K84 WeakPolarHBondContact O-CE 3.35Å; V82-K84 WeakPolarHBondContact O-CG 3.19Å; V82-K84 PolarHBondContact O-N 3.09Å
85	Y	89.7	Confident	83.7	Confident	7 Å²	7	49.1 Å²	49.1	3%	0.027	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.9	170.9	-57.4	-71.5	0	0	0	109.8	E31 I32 V34 V52 L54 F67 G68 T70 F99	E31-Y85 CarbonylContact C-O 3.53Å; E31-Y85 WeakPolarHBondContact CA-O 3.34Å; I32-Y85 PolarHBondContact N-O 3.36Å; I32-Y85 PolarHBondContact O-N 2.94Å; I32-Y85 VanDerWaalsContact O-N 3.09Å; V34-Y85 HydrophobicContact CG2-CD2 4Å; V34-Y85 HydrophobicContact CG2-CE2 3.78Å; V52-Y85 PolarHBondContact O-OH 2.77Å; L54-Y85 HydrophobicContact CB-CD1 4.05Å; L54-Y85 HydrophobicContact CB-CD2 4.27Å; L54-Y85 HydrophobicContact CB-CE1 3.74Å; L54-Y85 HydrophobicContact CB-CE2 3.98Å; L54-Y85 HydrophobicContact CB-CG 4.28Å; L54-Y85 HydrophobicContact CD2-CD1 3.88Å; L54-Y85 HydrophobicContact CD2-CD2 3.99Å; L54-Y85 HydrophobicContact CD2-CE1 4.44Å; L54-Y85 HydrophobicContact CD2-CG 3.6Å; F67-Y85 HydrophobicContact CD1-CD1 4.05Å; F67-Y85 HydrophobicContact CE1-CD1 4.4Å; G68-Y85 WeakPolarHBondContact O-CE1 3.28Å; G68-Y85 PolarHBondContact O-OH 3.18Å; T70-Y85 HydrophobicContact CG2-CE2 4.11Å; T70-Y85 WeakPolarHBondContact CG2-OH 3.37Å; T70-Y85 PolarHBondContact N-OH 2.93Å; Y85-F99 HydrophobicContact CD2-CE1 4.35Å; Y85-F99 HydrophobicContact CE2-CE1 4.29Å
86	I	88	Confident	84.4	Confident	86 Å²	86	46.8 Å²	46.8	44%	0.441	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115	178.6	-60.3	178.9	0	0	0	108.5	K29 V30 F67 L157	K29-I86 HydrophobicContact CD-CG2 4.37Å; V30-I86 WeakPolarHBondContact O-CA 3.38Å; F67-I86 VanDerWaalsContact CZ-O 3.24Å; F67-I86 WeakPolarHBondContact CZ-O 3.29Å; I86-L157 HydrophobicContact CB-CD1 4.25Å; I86-L157 HydrophobicContact CD1-CD1 3.97Å; I86-L157 HydrophobicContact CG1-CD1 3.88Å; I86-L157 HydrophobicContact CG2-CD1 3.52Å
87	L	90.3	Very high	85.2	Confident	14 Å²	14	45.6 Å²	45.6	7%	0.073	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	149.1	-178.5	-64.9	167.7	0	0	0	110.5	K29 V30 I32 L54 T56 F67 L97 L124	K29-L87 CarbonylContact C-O 3.47Å; K29-L87 WeakPolarHBondContact CA-O 3.1Å; V30-L87 PolarHBondContact N-O 3.03Å; V30-L87 PolarHBondContact O-N 2.99Å; I32-L87 HydrophobicContact CD1-CD1 3.55Å; I32-L87 HydrophobicContact CG1-CD1 4.42Å; L54-L87 HydrophobicContact CD2-CD1 4.24Å; T56-L87 HydrophobicContact CG2-CD2 4.2Å; F67-L87 HydrophobicContact CD1-CD2 4.19Å; F67-L87 HydrophobicContact CD2-CD2 3.83Å; F67-L87 HydrophobicContact CE1-CD2 3.82Å; F67-L87 HydrophobicContact CE2-CD2 3.43Å; F67-L87 VanDerWaalsContact CE2-CD2 3.43Å; F67-L87 HydrophobicContact CG-CD2 4.21Å; F67-L87 HydrophobicContact CZ-CD2 3.43Å; F67-L87 VanDerWaalsContact CZ-CD2 3.43Å; F67-L87 HydrophobicContact CZ-CG 4.35Å; L87-L97 HydrophobicContact CD1-CD1 4.3Å; L87-L97 HydrophobicContact CD1-CD2 4.03Å; L87-L124 HydrophobicContact CB-CD2 4.21Å; L87-L124 HydrophobicContact CD1-CD1 4.38Å; L87-L124 HydrophobicContact CD1-CD2 4.37Å
88	D	88.8	Confident	85.9	Confident	59 Å²	59	45.9 Å²	45.9	32%	0.316	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.2	163.2	-69.1	-48	0	0	0	108.9	P26 K29 F90 Q95	P26-D88 HydrophobicContact CB-CB 3.86Å; P26-D88 HydrophobicContact CG-CB 4.39Å; P26-D88 WeakPolarHBondContact CG-OD1 2.65Å; K29-D88 WeakPolarHBondContact CG-OD1 3.45Å; K29-D88 IonicContact NZ-OD1 3.26Å; K29-D88 PolarHBondContact NZ-OD1 2.97Å; K29-D88 IonicContact NZ-OD2 3.88Å; D88-F90 HydrophobicContact CB-CE2 3.71Å; D88-F90 HydrophobicContact CB-CZ 4.29Å; D88-Q95 PolarHBondContact O-NE2 2.68Å
89	Y	88.7	Confident	86.6	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	132.1	178.7	169.8	-106.7	0	0	0	110.7	A27 T28 V30 F91 L124 V128 L303 Y358	A27-Y89 PolarHBondContact N-O 3.32Å; T28-Y89 HydrophobicContact CG2-CD1 3.77Å; T28-Y89 HydrophobicContact CG2-CG 4.5Å; T28-Y89 PolarHBondContact O-N 2.66Å; V30-Y89 HydrophobicContact CG2-CG 4.24Å; Y89-F91 HydrophobicContact CE1-CB 4.41Å; Y89-L124 HydrophobicContact CD2-CD2 3.87Å; Y89-L124 HydrophobicContact CD2-CG 3.95Å; Y89-L124 HydrophobicContact CG-CD2 4.41Å; Y89-V128 HydrophobicContact CE2-CG2 3.81Å; Y89-L303 HydrophobicContact CD1-CD1 3.86Å; Y89-L303 HydrophobicContact CD1-CD2 4.4Å; Y89-L303 HydrophobicContact CD1-CG 4.35Å; Y89-L303 HydrophobicContact CE1-CD1 3.97Å; Y89-L303 HydrophobicContact CE1-CD2 3.67Å; Y89-L303 HydrophobicContact CE1-CG 3.98Å; Y89-Y358 WeakPolarHBondContact CE2-OH 3.3Å; Y89-Y358 VanDerWaalsContact OH-CZ 3.3Å; Y89-Y358 PolarHBondContact OH-OH 2.9Å
90	F	88.6	Confident	87.5	Confident	28 Å²	28	42.8 Å²	42.8	12%	0.123	21%	0.206	C	C	.	.			trans	-128.8	119.5	177.4	-60.6	-90	0	0	0	107.6	P26 D88 E92 E93 Q95	P26-F90 HydrophobicContact CB-CE1 3.92Å; P26-F90 HydrophobicContact CB-CE2 4.21Å; P26-F90 HydrophobicContact CB-CZ 3.63Å; D88-F90 HydrophobicContact CB-CE2 3.71Å; D88-F90 HydrophobicContact CB-CZ 4.29Å; F90-E92 PolarHBondContact O-N 2.87Å; F90-E93 HydrophobicContact CB-CB 3.94Å; F90-E93 HydrophobicContact CB-CG 3.85Å; F90-E93 HydrophobicContact CG-CG 4.45Å; F90-E93 PolarHBondContact O-N 3.37Å; F90-Q95 PolarHBondContact O-OE1 2.82Å
91	F	88.3	Confident	88.5	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-36	-178.9	166.8	-100.9	0	0	0	111.3	Y89 E93 F302 I312 I354 Y358 L532 I535 P536	Y89-F91 HydrophobicContact CE1-CB 4.41Å; F91-E93 VanDerWaalsContact C-N 3.3Å; F91-E93 PolarHBondContact O-N 2.81Å; F91-F302 AromaticContact CD2-CE1 3.6Å; F91-F302 HydrophobicContact CD2-CE1 3.6Å; F91-F302 AromaticContact CD2-CZ 3.64Å; F91-F302 HydrophobicContact CD2-CZ 3.64Å; F91-F302 HydrophobicContact CE2-CE1 4.06Å; F91-F302 AromaticContact CE2-CZ 3.61Å; F91-F302 HydrophobicContact CE2-CZ 3.61Å; F91-F302 HydrophobicContact CG-CE1 4.37Å; F91-F302 HydrophobicContact CZ-CZ 4.46Å; F91-I312 HydrophobicContact CE2-CD1 4.41Å; F91-I354 WeakPolarHBondContact O-CG2 3.41Å; F91-Y358 HydrophobicContact CD2-CD2 4.3Å; F91-Y358 HydrophobicContact CD2-CE1 4.21Å; F91-Y358 AromaticContact CD2-CE2 3.76Å; F91-Y358 HydrophobicContact CD2-CE2 3.76Å; F91-Y358 AromaticContact CD2-CZ 3.74Å; F91-Y358 HydrophobicContact CE2-CD1 4.4Å; F91-Y358 AromaticContact CE2-CD2 3.68Å; F91-Y358 HydrophobicContact CE2-CD2 3.68Å; F91-Y358 HydrophobicContact CE2-CE1 4.33Å; F91-Y358 AromaticContact CE2-CE2 3.59Å; F91-Y358 HydrophobicContact CE2-CE2 3.59Å; F91-Y358 HydrophobicContact CE2-CG 4.12Å; F91-Y358 AromaticContact CE2-CZ 3.97Å; F91-L532 HydrophobicContact CD1-CB 4.13Å; F91-L532 WeakPolarHBondContact CD1-O 3.28Å; F91-L532 HydrophobicContact CE1-CB 3.82Å; F91-L532 HydrophobicContact CE1-CD2 4.17Å; F91-L532 HydrophobicContact CE1-CG 4.45Å; F91-L532 WeakPolarHBondContact CE1-O 3.17Å; F91-I535 HydrophobicContact CE1-CB 3.78Å; F91-I535 HydrophobicContact CE1-CG1 4.37Å; F91-I535 HydrophobicContact CE1-CG2 4.1Å; F91-I535 HydrophobicContact CZ-CB 4.24Å; F91-I535 HydrophobicContact CZ-CG2 4.04Å; F91-P536 HydrophobicContact CB-CG 3.89Å; F91-P536 HydrophobicContact CD1-CG 3.61Å; F91-P536 HydrophobicContact CD2-CG 4.49Å; F91-P536 HydrophobicContact CE1-CG 4.27Å; F91-P536 HydrophobicContact CG-CG 3.73Å
92	E	87.8	Confident	89.3	Confident	21 Å²	21	39.5 Å²	39.5	10%	0.098	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	3.6	-173.4	74	-78	-173.1	0	0	113.8	F90 I354 K529 L532	F90-E92 PolarHBondContact O-N 2.87Å; E92-I354 WeakPolarHBondContact O-CD1 3.44Å; E92-K529 HydrophobicContact CG-CB 4.19Å; E92-K529 HydrophobicContact CG-CG 3.67Å; E92-L532 HydrophobicContact CB-CB 3.74Å
93	E	87.3	Confident	90.4	Very high	54 Å²	54	34 Å²	34	25%	0.252	15%	0.152	S	C	.	.	S	Bend	trans	-121.8	137.9	-179.6	-59.3	-169.2	-178.2	0	0	113.1	F90 F91 Q95 K529	F90-E93 HydrophobicContact CB-CB 3.94Å; F90-E93 HydrophobicContact CB-CG 3.85Å; F90-E93 HydrophobicContact CG-CG 4.45Å; F90-E93 PolarHBondContact O-N 3.37Å; F91-E93 VanDerWaalsContact C-N 3.3Å; F91-E93 PolarHBondContact O-N 2.81Å; E93-Q95 HydrophobicContact CB-CG 4.16Å; E93-Q95 PolarHBondContact O-N 2.53Å; E93-Q95 VanDerWaalsContact O-N 3.08Å; E93-K529 IonicContact OE1-NZ 3.77Å; E93-K529 PolarHBondContact OE1-NZ 3.07Å
94	K	87.6	Confident	91.2	Very high	76 Å²	76	28 Å²	28	33%	0.33	13%	0.132	S	C	.	.			trans	-79.7	91.1	171.3	-166.1	-179.4	-169.3	174.6	0	110.9	N96 T123 E353 I354	K94-N96 PolarHBondContact O-N 3.15Å; K94-T123 HydrophobicContact CG-CG2 4Å; K94-E353 IonicContact NZ-OE2 2.74Å; K94-E353 PolarHBondContact NZ-OE2 3.21Å; K94-I354 HydrophobicContact CB-CD1 4.5Å; K94-I354 HydrophobicContact CB-CG1 4.18Å
95	Q	91.6	Very high	91.4	Very high	36 Å²	36	28.9 Å²	28.9	17%	0.168	14%	0.139	C	C	.	.			trans	-88.8	90.7	-177	-59	179	-93.2	0	0	111.4	D88 F90 E93 T123 L124	D88-Q95 PolarHBondContact O-NE2 2.68Å; F90-Q95 PolarHBondContact O-OE1 2.82Å; E93-Q95 HydrophobicContact CB-CG 4.16Å; E93-Q95 PolarHBondContact O-N 2.53Å; E93-Q95 VanDerWaalsContact O-N 3.08Å; Q95-T123 CarbonylContact O-C 3.4Å; Q95-T123 VanDerWaalsContact O-CA 3.26Å; Q95-T123 WeakPolarHBondContact O-CA 3.47Å; Q95-L124 HydrophobicContact CB-CB 3.91Å; Q95-L124 PolarHBondContact O-N 3.45Å
96	N	94.1	Very high	91.2	Very high	41 Å²	41	31 Å²	31	22%	0.219	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	131.8	-178.2	-64	-37	0	0	0	112.4	Q57 W64 K94	Q57-N96 HydrophobicContact CB-CB 4.05Å; Q57-N96 PolarHBondContact N-O 2.84Å; Q57-N96 PolarHBondContact OE1-ND2 2.82Å; W64-N96 HydrophobicContact CH2-CB 3.93Å; W64-N96 HydrophobicContact CZ3-CB 4.43Å; K94-N96 PolarHBondContact O-N 3.15Å
97	L	96.8	Very high	91	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.5	178.7	-52.4	179.9	0	0	0	110.2	I32 L54 T56 L87 F99 C122 L124 I127	I32-L97 HydrophobicContact CD1-CD1 4.01Å; L54-L97 HydrophobicContact CD1-CB 4.08Å; L54-L97 HydrophobicContact CD1-CD2 4.23Å; T56-L97 HydrophobicContact CG2-CD2 3.97Å; L87-L97 HydrophobicContact CD1-CD1 4.3Å; L87-L97 HydrophobicContact CD1-CD2 4.03Å; L97-F99 HydrophobicContact CB-CD2 4.47Å; L97-F99 HydrophobicContact CB-CE2 3.8Å; L97-F99 HydrophobicContact CB-CZ 4.5Å; L97-F99 HydrophobicContact CD1-CE2 4.11Å; L97-F99 HydrophobicContact CD1-CZ 4.21Å; L97-C122 WeakPolarHBondContact CA-O 3.48Å; L97-C122 PolarHBondContact N-O 2.99Å; L97-C122 PolarHBondContact O-N 3.17Å; L97-C122 VanDerWaalsContact O-N 3.11Å; L97-L124 HydrophobicContact CD1-CB 4.1Å; L97-L124 HydrophobicContact CD1-CD1 4.29Å; L97-I127 HydrophobicContact CD1-CD1 3.79Å
98	R	97.3	Very high	90.8	Very high	38 Å²	38	37.7 Å²	37.7	14%	0.143	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	128.3	168.8	-176.1	-171.9	85.2	-162	5.2	109.1	Y55 W64 D100 V120 Y121	Y55-R98 VanDerWaalsContact CE2-NH2 3.29Å; Y55-R98 PolarHBondContact N-O 3.48Å; Y55-R98 PolarHBondContact O-N 3.09Å; W64-R98 HydrophobicContact CD2-CB 4.28Å; W64-R98 HydrophobicContact CE3-CB 3.81Å; W64-R98 HydrophobicContact CH2-CB 3.74Å; W64-R98 HydrophobicContact CZ2-CB 4.23Å; W64-R98 HydrophobicContact CZ3-CB 3.53Å; R98-D100 WeakPolarHBondContact CD-OD1 3.12Å; R98-D100 WeakPolarHBondContact CG-OD1 3.47Å; R98-D100 IonicContact CZ-OD1 3.09Å; R98-D100 IonicContact CZ-OD2 3.98Å; R98-D100 VanDerWaalsContact CZ-OD2 3.26Å; R98-D100 IonicContact NE-OD1 3.61Å; R98-D100 PolarHBondContact NE-OD1 3.48Å; R98-D100 IonicContact NE-OD2 3.15Å; R98-D100 PolarHBondContact NE-OD2 2.91Å; R98-D100 VanDerWaalsContact NE-OD2 3.07Å; R98-D100 IonicContact NH2-OD2 3.24Å; R98-D100 PolarHBondContact NH2-OD2 2.85Å; R98-V120 WeakPolarHBondContact CA-O 3.33Å; R98-Y121 HydrophobicContact CB-CD1 4.02Å; R98-Y121 HydrophobicContact CB-CE1 4.02Å; R98-Y121 VanDerWaalsContact CD-CZ 3.44Å; R98-Y121 VanDerWaalsContact CD-OH 3.3Å; R98-Y121 WeakPolarHBondContact CD-OH 3.5Å; R98-Y121 HydrophobicContact CG-CD1 3.91Å; R98-Y121 HydrophobicContact CG-CE1 3.61Å; R98-Y121 HydrophobicContact CG-CE2 4.41Å; R98-Y121 HydrophobicContact CG-CG 4.45Å
99	F	98	Very high	90.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.5	175.8	-61	-101.9	0	0	0	108.6	I32 V34 V52 V53 L54 Y85 L97 Q119 V120 I127 I150 L152	I32-F99 HydrophobicContact CD1-CZ 4.37Å; I32-F99 HydrophobicContact CG2-CZ 4.44Å; V34-F99 HydrophobicContact CG2-CD1 4.42Å; V34-F99 HydrophobicContact CG2-CE1 4.04Å; V52-F99 HydrophobicContact CG1-CB 4.15Å; V52-F99 HydrophobicContact CG1-CD1 3.99Å; V53-F99 WeakPolarHBondContact O-CA 3.31Å; L54-F99 HydrophobicContact CB-CD1 4.4Å; L54-F99 HydrophobicContact CB-CE1 4.35Å; L54-F99 HydrophobicContact CD1-CD1 4.03Å; L54-F99 HydrophobicContact CD1-CD2 4.28Å; L54-F99 HydrophobicContact CD1-CE1 3.7Å; L54-F99 HydrophobicContact CD1-CE2 3.94Å; L54-F99 HydrophobicContact CD1-CG 4.32Å; L54-F99 HydrophobicContact CD1-CZ 3.65Å; L54-F99 HydrophobicContact CD2-CE1 4.48Å; L54-F99 HydrophobicContact CG-CE1 4.38Å; Y85-F99 HydrophobicContact CD2-CE1 4.35Å; Y85-F99 HydrophobicContact CE2-CE1 4.29Å; L97-F99 HydrophobicContact CB-CD2 4.47Å; L97-F99 HydrophobicContact CB-CE2 3.8Å; L97-F99 HydrophobicContact CB-CZ 4.5Å; L97-F99 HydrophobicContact CD1-CE2 4.11Å; L97-F99 HydrophobicContact CD1-CZ 4.21Å; F99-Q119 CarbonylContact O-C 3.54Å; F99-Q119 WeakPolarHBondContact O-CA 3.33Å; F99-V120 HydrophobicContact CB-CG1 3.85Å; F99-V120 HydrophobicContact CD2-CG1 4.06Å; F99-V120 HydrophobicContact CG-CG1 4.35Å; F99-V120 PolarHBondContact N-O 3.5Å; F99-V120 PolarHBondContact O-N 2.92Å; F99-I127 HydrophobicContact CE2-CD1 4.43Å; F99-I127 HydrophobicContact CZ-CD1 4.42Å; F99-I150 HydrophobicContact CB-CD1 3.82Å; F99-I150 HydrophobicContact CD1-CD1 4.37Å; F99-I150 HydrophobicContact CG-CD1 4.18Å; F99-L152 HydrophobicContact CD1-CD2 4.04Å; F99-L152 HydrophobicContact CD2-CD1 3.92Å; F99-L152 HydrophobicContact CD2-CD2 4.48Å; F99-L152 HydrophobicContact CE1-CD2 3.74Å; F99-L152 HydrophobicContact CE2-CD1 3.54Å; F99-L152 HydrophobicContact CE2-CD2 4.23Å; F99-L152 HydrophobicContact CG-CD2 4.39Å; F99-L152 HydrophobicContact CZ-CD1 3.87Å; F99-L152 HydrophobicContact CZ-CD2 3.84Å; F99-L152 HydrophobicContact CZ-CG 4.49Å
100	D	97.8	Very high	90.7	Very high	4 Å²	4	43 Å²	43	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.4	176.3	-60.6	-11.2	0	0	0	108.6	V52 V53 Y55 R98 Y102 F116 Q119	V52-D100 CarbonylContact C-O 3.53Å; V52-D100 WeakPolarHBondContact CA-O 3.47Å; V53-D100 PolarHBondContact N-O 2.57Å; V53-D100 PolarHBondContact O-N 3.34Å; Y55-D100 HydrophobicContact CE2-CB 4.07Å; Y55-D100 WeakPolarHBondContact CE2-OD2 3.31Å; R98-D100 WeakPolarHBondContact CD-OD1 3.12Å; R98-D100 WeakPolarHBondContact CG-OD1 3.47Å; R98-D100 IonicContact CZ-OD1 3.09Å; R98-D100 IonicContact CZ-OD2 3.98Å; R98-D100 VanDerWaalsContact CZ-OD2 3.26Å; R98-D100 IonicContact NE-OD1 3.61Å; R98-D100 PolarHBondContact NE-OD1 3.48Å; R98-D100 IonicContact NE-OD2 3.15Å; R98-D100 PolarHBondContact NE-OD2 2.91Å; R98-D100 VanDerWaalsContact NE-OD2 3.07Å; R98-D100 IonicContact NH2-OD2 3.24Å; R98-D100 PolarHBondContact NH2-OD2 2.85Å; D100-Y102 HydrophobicContact CB-CD2 4.32Å; D100-Y102 HydrophobicContact CB-CE2 3.57Å; D100-F116 HydrophobicContact CB-CE2 4.2Å; D100-Q119 WeakPolarHBondContact OD1-CB 3.46Å
101	V	96.2	Very high	90.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.4	-179.7	-167.8	0	0	0	0	109	L39 L51 V52 L117 G118 L139	L39-V101 HydrophobicContact CD1-CG1 4.19Å; L39-V101 HydrophobicContact CD2-CG1 4.22Å; L51-V101 WeakPolarHBondContact O-CA 3.33Å; V52-V101 HydrophobicContact CG2-CG1 4.4Å; V52-V101 HydrophobicContact CG2-CG2 4.21Å; V101-L117 HydrophobicContact CB-CB 4.19Å; V101-L117 HydrophobicContact CG1-CB 4.11Å; V101-L117 HydrophobicContact CG1-CD1 4.16Å; V101-L117 PolarHBondContact O-N 3Å; V101-G118 PolarHBondContact N-O 2.9Å; V101-G118 PolarHBondContact O-N 2.96Å; V101-L139 HydrophobicContact CG2-CD1 3.97Å; V101-L139 HydrophobicContact CG2-CD2 3.74Å
102	Y	95.1	Very high	90.8	Very high	30 Å²	30	47.1 Å²	47.1	12%	0.118	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	151.6	-179.3	-68.4	-91.9	0	0	0	111.3	P50 L51 V53 D100 L111 H114 D115 F116	P50-Y102 CarbonylContact C-O 3.47Å; P50-Y102 VanDerWaalsContact CA-O 3.26Å; P50-Y102 WeakPolarHBondContact CA-O 3.35Å; L51-Y102 PolarHBondContact N-O 2.91Å; L51-Y102 PolarHBondContact O-N 2.94Å; V53-Y102 HydrophobicContact CG2-CD2 3.95Å; V53-Y102 HydrophobicContact CG2-CE2 4Å; D100-Y102 HydrophobicContact CB-CD2 4.32Å; D100-Y102 HydrophobicContact CB-CE2 3.57Å; Y102-L111 HydrophobicContact CD2-CD2 3.99Å; Y102-L111 HydrophobicContact CE1-CB 4.25Å; Y102-L111 HydrophobicContact CE2-CD1 4.12Å; Y102-L111 HydrophobicContact CE2-CD2 4.06Å; Y102-L111 HydrophobicContact CG-CD2 4.23Å; Y102-H114 HydrophobicContact CD1-CB 4.18Å; Y102-D115 CarbonylContact C-O 3.33Å; Y102-D115 WeakPolarHBondContact CA-O 3.31Å; Y102-F116 HydrophobicContact CD1-CB 4.39Å; Y102-F116 HydrophobicContact CD1-CD2 4.42Å; Y102-F116 HydrophobicContact CE1-CB 4.2Å; Y102-F116 AromaticContact CE1-CD2 3.95Å; Y102-F116 HydrophobicContact CE1-CD2 3.95Å; Y102-F116 HydrophobicContact CE2-CD2 4.5Å; Y102-F116 AromaticContact CZ-CD2 3.99Å
103	D	92.7	Very high	90.9	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.5	167.4	-163.5	-4.4	0	0	0	109.2	S48 D49 D105 H114 D115 L117	S48-D103 VanDerWaalsContact CA-OD1 3.26Å; S48-D103 WeakPolarHBondContact CA-OD1 3.2Å; S48-D103 VanDerWaalsContact CA-OD2 3.3Å; S48-D103 WeakPolarHBondContact CA-OD2 3.45Å; S48-D103 WeakPolarHBondContact CB-OD1 3.41Å; S48-D103 WeakPolarHBondContact CB-OD2 3.34Å; S48-D103 PolarHBondContact OG-OD2 3.22Å; D49-D103 PolarHBondContact N-OD1 3.37Å; D103-D105 PolarHBondContact O-N 2.95Å; D103-H114 WeakPolarHBondContact O-CB 3.25Å; D103-D115 HydrophobicContact CB-CB 3.88Å; D103-D115 PolarHBondContact N-O 2.87Å; D103-D115 PolarHBondContact O-N 3.22Å; D103-D115 VanDerWaalsContact O-N 3.12Å; D103-L117 HydrophobicContact CB-CD1 3.94Å; D103-L117 HydrophobicContact CB-CD2 3.97Å; D103-L117 HydrophobicContact CB-CG 3.95Å
104	I	90.7	Very high	91	Very high	23 Å²	23	50 Å²	50	12%	0.118	27%	0.265	C	S	.	.			trans	-97.5	93.1	-167.7	-57.7	-60	0	0	0	111.6	D49 L51 V72 S106 H114	D49-I104 PolarHBondContact O-N 3Å; L51-I104 HydrophobicContact CB-CD1 3.99Å; L51-I104 HydrophobicContact CB-CG1 3.68Å; L51-I104 HydrophobicContact CD1-CD1 4.48Å; L51-I104 HydrophobicContact CD1-CG1 4.46Å; V72-I104 HydrophobicContact CG1-CB 3.99Å; V72-I104 HydrophobicContact CG1-CG1 4.12Å; V72-I104 HydrophobicContact CG2-CB 4.3Å; V72-I104 HydrophobicContact CG2-CG1 3.94Å; V72-I104 HydrophobicContact CG2-CG2 4.24Å; I104-S106 VanDerWaalsContact C-N 3.31Å; I104-S106 VanDerWaalsContact CG2-O 3.26Å; I104-S106 WeakPolarHBondContact CG2-O 3.42Å; I104-S106 PolarHBondContact O-N 2.61Å; I104-H114 HydrophobicContact CD1-CB 4.05Å
105	D	83.7	Confident	91.2	Very high	81 Å²	81	49.5 Å²	49.5	43%	0.433	27%	0.266	S	S	.	.			trans	-75.4	-11.9	-179.5	-50.6	-70.7	0	0	0	115.5	D103 H114 D115	D103-D105 PolarHBondContact O-N 2.95Å; D105-H114 PolarHBondContact N-ND1 3.43Å; D105-D115 PolarHBondContact OD2-N 3.3Å
106	S	86.2	Confident	91.3	Very high	52 Å²	52	50.5 Å²	50.5	36%	0.364	27%	0.27	S	S	.	.	S	Bend	trans	-156.1	169.8	-172.1	77.4	0	0	0	0	113.5	I104 S108 H114	I104-S106 VanDerWaalsContact C-N 3.31Å; I104-S106 VanDerWaalsContact CG2-O 3.26Å; I104-S106 WeakPolarHBondContact CG2-O 3.42Å; I104-S106 PolarHBondContact O-N 2.61Å; S106-S108 PolarHBondContact O-N 3.1Å; S106-S108 WeakPolarHBondContact OG-CB 3.34Å; S106-S108 PolarHBondContact OG-N 3.05Å; S106-H114 PolarHBondContact O-CE1 2.8Å; S106-H114 PolarHBondContact OG-CE1 2.83Å
107	K	82.8	Confident	91.3	Very high	216 Å²	216	48.5 Å²	48.5	94%	0.939	26%	0.259	S	S	*	.	S	Bend	trans	-77.9	6.3	176	-59.5	-172.9	179.3	-175.7	0	114.2
108	S	87.4	Confident	91.2	Very high	24 Å²	24	48.3 Å²	48.3	17%	0.168	26%	0.258	C	S	.	.			trans	-68.8	139.1	179.6	-178.3	0	0	0	0	110.2	S106 D110 K113 H114	S106-S108 PolarHBondContact O-N 3.1Å; S106-S108 WeakPolarHBondContact OG-CB 3.34Å; S106-S108 PolarHBondContact OG-N 3.05Å; S108-D110 VanDerWaalsContact C-N 3.25Å; S108-D110 WeakPolarHBondContact OG-CB 3.43Å; S108-D110 PolarHBondContact OG-N 2.78Å; S108-K113 WeakPolarHBondContact OG-CD 3.42Å; S108-K113 PolarHBondContact OG-NZ 2.95Å; S108-H114 PolarHBondContact O-NE2 3.16Å
109	P	84.4	Confident	91.2	Very high	101 Å²	101	48.5 Å²	48.5	66%	0.656	26%	0.261	S	S	*	.	S	Bend	trans	-80.5	-8.1	171	32.2	-34.9	0	0	0	113.1	R69 L111	R69-P109 PolarHBondContact NH1-O 3.46Å; P109-L111 PolarHBondContact O-N 2.88Å
110	D	89.6	Confident	91.1	Very high	74 Å²	74	48.8 Å²	48.8	40%	0.396	26%	0.262	S	S	.	.			trans	-79.1	111.4	-178.5	-179.5	9	0	0	0	111.9	S108 A112 K113 H114	S108-D110 VanDerWaalsContact C-N 3.25Å; S108-D110 WeakPolarHBondContact OG-CB 3.43Å; S108-D110 PolarHBondContact OG-N 2.78Å; D110-A112 PolarHBondContact O-N 2.78Å; D110-A112 WeakPolarHBondContact OD1-CB 3.15Å; D110-A112 PolarHBondContact OD1-N 3.13Å; D110-A112 VanDerWaalsContact OD1-N 3.1Å; D110-K113 HydrophobicContact CB-CD 4.42Å; D110-K113 HydrophobicContact CB-CG 4.34Å; D110-K113 PolarHBondContact O-N 2.84Å; D110-K113 VanDerWaalsContact O-N 3.13Å; D110-K113 WeakPolarHBondContact OD2-CE 3.29Å; D110-H114 PolarHBondContact O-CD2 2.83Å
111	L	90.1	Very high	91.1	Very high	22 Å²	22	53.5 Å²	53.5	12%	0.115	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-62	-21.7	-179.1	-65.6	174.9	0	0	0	113.6	V53 Y55 Y102 P109 K113 H114	V53-L111 HydrophobicContact CG1-CD1 4.48Å; V53-L111 HydrophobicContact CG2-CD1 4Å; V53-L111 HydrophobicContact CG2-CD2 3.97Å; Y55-L111 VanDerWaalsContact OH-CD1 3.31Å; Y55-L111 WeakPolarHBondContact OH-CD1 3.47Å; Y102-L111 HydrophobicContact CD2-CD2 3.99Å; Y102-L111 HydrophobicContact CE1-CB 4.25Å; Y102-L111 HydrophobicContact CE2-CD1 4.12Å; Y102-L111 HydrophobicContact CE2-CD2 4.06Å; Y102-L111 HydrophobicContact CG-CD2 4.23Å; P109-L111 PolarHBondContact O-N 2.88Å; L111-K113 PolarHBondContact O-N 2.81Å; L111-H114 PolarHBondContact O-N 2.77Å
112	A	89.9	Confident	91	Very high	92 Å²	92	54 Å²	54	76%	0.76	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-68.9	-12.2	177.3	0	0	0	0	0	113.3	D110	D110-A112 PolarHBondContact O-N 2.78Å; D110-A112 WeakPolarHBondContact OD1-CB 3.15Å; D110-A112 PolarHBondContact OD1-N 3.13Å; D110-A112 VanDerWaalsContact OD1-N 3.1Å
113	K	89	Confident	91	Very high	123 Å²	123	53 Å²	53	54%	0.535	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-101.3	10.1	179.3	-55.3	-172.9	-163.3	156.1	0	113.6	S108 D110 L111	S108-K113 WeakPolarHBondContact OG-CD 3.42Å; S108-K113 PolarHBondContact OG-NZ 2.95Å; D110-K113 HydrophobicContact CB-CD 4.42Å; D110-K113 HydrophobicContact CB-CG 4.34Å; D110-K113 PolarHBondContact O-N 2.84Å; D110-K113 VanDerWaalsContact O-N 3.13Å; D110-K113 WeakPolarHBondContact OD2-CE 3.29Å; L111-K113 PolarHBondContact O-N 2.81Å
114	H	90.8	Very high	91	Very high	14 Å²	14	53 Å²	53	7%	0.065	28%	0.281	C	S	.	.	S	Bend	trans	-123.6	148.6	-176	-64.3	-47	0	0	0	109.8	Y102 D103 I104 D105 S106 S108 D110 L111 F116	Y102-H114 HydrophobicContact CD1-CB 4.18Å; D103-H114 WeakPolarHBondContact O-CB 3.25Å; I104-H114 HydrophobicContact CD1-CB 4.05Å; D105-H114 PolarHBondContact N-ND1 3.43Å; S106-H114 PolarHBondContact O-CE1 2.8Å; S106-H114 PolarHBondContact OG-CE1 2.83Å; S108-H114 PolarHBondContact O-NE2 3.16Å; D110-H114 PolarHBondContact O-CD2 2.83Å; L111-H114 PolarHBondContact O-N 2.77Å; H114-F116 PolarHBondContact O-N 2.79Å
115	D	91.1	Very high	91.1	Very high	65 Å²	65	52.2 Å²	52.2	35%	0.348	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	121.9	-176.1	-99.8	9.2	0	0	0	111	R42 Y102 D103 D105 L117	R42-D115 HydrophobicContact CG-CB 4.44Å; Y102-D115 CarbonylContact C-O 3.33Å; Y102-D115 WeakPolarHBondContact CA-O 3.31Å; D103-D115 HydrophobicContact CB-CB 3.88Å; D103-D115 PolarHBondContact N-O 2.87Å; D103-D115 PolarHBondContact O-N 3.22Å; D103-D115 VanDerWaalsContact O-N 3.12Å; D105-D115 PolarHBondContact OD2-N 3.3Å; D115-L117 PolarHBondContact O-N 3.45Å
116	F	94.1	Very high	91.5	Very high	56 Å²	56	50.4 Å²	50.4	25%	0.246	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	125.4	177.6	179.1	-107	0	0	0	110.8	D100 Y102 H114 G118 Q119 I142	D100-F116 HydrophobicContact CB-CE2 4.2Å; Y102-F116 HydrophobicContact CD1-CB 4.39Å; Y102-F116 HydrophobicContact CD1-CD2 4.42Å; Y102-F116 HydrophobicContact CE1-CB 4.2Å; Y102-F116 AromaticContact CE1-CD2 3.95Å; Y102-F116 HydrophobicContact CE1-CD2 3.95Å; Y102-F116 HydrophobicContact CE2-CD2 4.5Å; Y102-F116 AromaticContact CZ-CD2 3.99Å; H114-F116 PolarHBondContact O-N 2.79Å; F116-G118 VanDerWaalsContact CE2-O 3.28Å; F116-G118 WeakPolarHBondContact CE2-O 3.13Å; F116-G118 VanDerWaalsContact CZ-CA 3.5Å; F116-G118 WeakPolarHBondContact CZ-O 3.3Å; F116-Q119 HydrophobicContact CE2-CB 4.12Å; F116-Q119 HydrophobicContact CZ-CB 3.71Å; F116-Q119 HydrophobicContact CZ-CG 3.86Å; F116-I142 HydrophobicContact CD1-CD1 4.2Å; F116-I142 HydrophobicContact CD1-CG1 3.97Å; F116-I142 HydrophobicContact CE1-CG1 4.1Å; F116-I142 VanDerWaalsContact O-CD1 3.25Å; F116-I142 WeakPolarHBondContact O-CD1 3.46Å
117	L	92.8	Very high	91.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-29.1	-178.3	-63.3	-176.3	0	0	0	112.9	L39 L40 R42 V101 D103 D115 I142 C147	L39-L117 HydrophobicContact CD1-CD1 4.28Å; L40-L117 HydrophobicContact CB-CD2 4.49Å; L40-L117 WeakPolarHBondContact O-CD2 3.5Å; R42-L117 HydrophobicContact CB-CD2 4.41Å; R42-L117 HydrophobicContact CG-CD2 3.59Å; V101-L117 HydrophobicContact CB-CB 4.19Å; V101-L117 HydrophobicContact CG1-CB 4.11Å; V101-L117 HydrophobicContact CG1-CD1 4.16Å; V101-L117 PolarHBondContact O-N 3Å; D103-L117 HydrophobicContact CB-CD1 3.94Å; D103-L117 HydrophobicContact CB-CD2 3.97Å; D103-L117 HydrophobicContact CB-CG 3.95Å; D115-L117 PolarHBondContact O-N 3.45Å; L117-I142 WeakPolarHBondContact O-CD1 3.17Å; L117-C147 WeakPolarHBondContact O-CB 3.38Å; L117-C147 PolarHBondContact O-SG 2.86Å
118	G	95.3	Very high	92.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.1	172.1	175.7	0	0	0	0	0	112.6	V101 F116 V140	V101-G118 PolarHBondContact N-O 2.9Å; V101-G118 PolarHBondContact O-N 2.96Å; F116-G118 VanDerWaalsContact CE2-O 3.28Å; F116-G118 WeakPolarHBondContact CE2-O 3.13Å; F116-G118 VanDerWaalsContact CZ-CA 3.5Å; F116-G118 WeakPolarHBondContact CZ-O 3.3Å; G118-V140 CarbonylContact C-O 3.57Å; G118-V140 WeakPolarHBondContact CA-O 3.4Å
119	Q	96.9	Very high	92.1	Very high	41 Å²	41	37.7 Å²	37.7	19%	0.192	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	161	177.3	62.8	-176.1	-13.1	0	0	111.5	F99 D100 F116 Y121 V140	F99-Q119 CarbonylContact O-C 3.54Å; F99-Q119 WeakPolarHBondContact O-CA 3.33Å; D100-Q119 WeakPolarHBondContact OD1-CB 3.46Å; F116-Q119 HydrophobicContact CE2-CB 4.12Å; F116-Q119 HydrophobicContact CZ-CB 3.71Å; F116-Q119 HydrophobicContact CZ-CG 3.86Å; Q119-Y121 HydrophobicContact CG-CE2 4.06Å; Q119-Y121 PolarHBondContact OE1-OH 3.36Å; Q119-V140 HydrophobicContact CG-CG2 4.35Å; Q119-V140 PolarHBondContact N-O 3.41Å; Q119-V140 WeakPolarHBondContact O-CG2 3.47Å; Q119-V140 PolarHBondContact O-N 3.4Å
120	V	97.1	Very high	92.2	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.036	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.6	167.7	70.2	0	0	0	0	110.9	R98 F99 K137 L139 I150	R98-V120 WeakPolarHBondContact CA-O 3.33Å; F99-V120 HydrophobicContact CB-CG1 3.85Å; F99-V120 HydrophobicContact CD2-CG1 4.06Å; F99-V120 HydrophobicContact CG-CG1 4.35Å; F99-V120 PolarHBondContact N-O 3.5Å; F99-V120 PolarHBondContact O-N 2.92Å; V120-K137 HydrophobicContact CG2-CB 3.64Å; V120-K137 HydrophobicContact CG2-CD 3.42Å; V120-K137 VanDerWaalsContact CG2-CD 3.42Å; V120-K137 HydrophobicContact CG2-CG 4.15Å; V120-L139 HydrophobicContact CB-CD2 4.49Å; V120-I150 HydrophobicContact CB-CG2 4.08Å; V120-I150 HydrophobicContact CG1-CD1 4.33Å; V120-I150 HydrophobicContact CG1-CG2 3.58Å
121	Y	96.3	Very high	91.9	Very high	103 Å²	103	35.6 Å²	35.6	40%	0.404	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135.5	171.4	-61.2	-97.7	0	0	0	109.4	W64 R98 Q119 K137	W64-Y121 HydrophobicContact CH2-CD1 4.07Å; W64-Y121 HydrophobicContact CH2-CE1 4.4Å; W64-Y121 AromaticContact CZ2-CD1 3.74Å; W64-Y121 HydrophobicContact CZ2-CD1 3.74Å; W64-Y121 AromaticContact CZ2-CE1 3.73Å; W64-Y121 HydrophobicContact CZ2-CE1 3.73Å; R98-Y121 HydrophobicContact CB-CD1 4.02Å; R98-Y121 HydrophobicContact CB-CE1 4.02Å; R98-Y121 VanDerWaalsContact CD-CZ 3.44Å; R98-Y121 VanDerWaalsContact CD-OH 3.3Å; R98-Y121 WeakPolarHBondContact CD-OH 3.5Å; R98-Y121 HydrophobicContact CG-CD1 3.91Å; R98-Y121 HydrophobicContact CG-CE1 3.61Å; R98-Y121 HydrophobicContact CG-CE2 4.41Å; R98-Y121 HydrophobicContact CG-CG 4.45Å; Q119-Y121 HydrophobicContact CG-CE2 4.06Å; Q119-Y121 PolarHBondContact OE1-OH 3.36Å; Y121-K137 PolarHBondContact O-NZ 3.35Å
122	C	95.6	Very high	91.3	Very high	10 Å²	10	36.4 Å²	36.4	7%	0.068	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	173.3	173.7	56.3	0	0	0	0	110	L97 E126 L135	L97-C122 WeakPolarHBondContact CA-O 3.48Å; L97-C122 PolarHBondContact N-O 2.99Å; L97-C122 PolarHBondContact O-N 3.17Å; L97-C122 VanDerWaalsContact O-N 3.11Å; C122-E126 VanDerWaalsContact CA-OE2 3.25Å; C122-E126 WeakPolarHBondContact CA-OE2 3.36Å; C122-E126 WeakPolarHBondContact CB-OE2 3.21Å; C122-L135 HydrophobicContact CB-CD2 3.91Å
123	T	94.5	Very high	91.1	Very high	11 Å²	11	32.1 Å²	32.1	7%	0.067	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	158.7	166.2	62	0	0	0	0	109.6	K94 Q95 G125 E126 I127 D357	K94-T123 HydrophobicContact CG-CG2 4Å; Q95-T123 CarbonylContact O-C 3.4Å; Q95-T123 VanDerWaalsContact O-CA 3.26Å; Q95-T123 WeakPolarHBondContact O-CA 3.47Å; T123-G125 PolarHBondContact O-N 3.07Å; T123-E126 PolarHBondContact O-N 3.24Å; T123-E126 VanDerWaalsContact OG1-CB 3.27Å; T123-E126 WeakPolarHBondContact OG1-CB 3.49Å; T123-E126 PolarHBondContact OG1-N 2.84Å; T123-I127 PolarHBondContact O-N 3.37Å; T123-D357 PolarHBondContact OG1-OD2 3.4Å
124	L	93.8	Very high	91	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.1	-38.3	168.9	-175.4	53.7	0	0	0	110.8	V30 I32 L87 Y89 Q95 L97 E126 I127 V128	V30-L124 HydrophobicContact CG1-CD1 4.46Å; I32-L124 HydrophobicContact CD1-CD1 3.88Å; I32-L124 HydrophobicContact CG1-CD1 4.43Å; L87-L124 HydrophobicContact CB-CD2 4.21Å; L87-L124 HydrophobicContact CD1-CD1 4.38Å; L87-L124 HydrophobicContact CD1-CD2 4.37Å; Y89-L124 HydrophobicContact CD2-CD2 3.87Å; Y89-L124 HydrophobicContact CD2-CG 3.95Å; Y89-L124 HydrophobicContact CG-CD2 4.41Å; Q95-L124 HydrophobicContact CB-CB 3.91Å; Q95-L124 PolarHBondContact O-N 3.45Å; L97-L124 HydrophobicContact CD1-CB 4.1Å; L97-L124 HydrophobicContact CD1-CD1 4.29Å; L124-E126 PolarHBondContact O-N 2.78Å; L124-I127 PolarHBondContact O-N 3.45Å; L124-V128 HydrophobicContact CD1-CG1 4.38Å; L124-V128 WeakPolarHBondContact O-CG2 3.35Å; L124-V128 PolarHBondContact O-N 2.87Å
125	G	91.6	Very high	91	Very high	6 Å²	6	30.8 Å²	30.8	6%	0.062	17%	0.167	C	C	.	.	H	α-helix	trans	-52.5	-48.3	172.9	0	0	0	0	0	113.1	T123 I127 V128 G129 Y358	T123-G125 PolarHBondContact O-N 3.07Å; G125-I127 VanDerWaalsContact C-N 3.31Å; G125-I127 PolarHBondContact O-N 3.46Å; G125-V128 VanDerWaalsContact O-CG2 3.24Å; G125-V128 WeakPolarHBondContact O-CG2 3.36Å; G125-V128 PolarHBondContact O-N 3.37Å; G125-G129 PolarHBondContact O-N 2.77Å; G125-Y358 WeakPolarHBondContact CA-OH 2.98Å
126	E	93.2	Very high	91.1	Very high	42 Å²	42	32.4 Å²	32.4	20%	0.196	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-37.2	178.9	-172.8	-176.2	-167.8	0	0	112.2	C122 T123 L124 S130 L135 K137	C122-E126 VanDerWaalsContact CA-OE2 3.25Å; C122-E126 WeakPolarHBondContact CA-OE2 3.36Å; C122-E126 WeakPolarHBondContact CB-OE2 3.21Å; T123-E126 PolarHBondContact O-N 3.24Å; T123-E126 VanDerWaalsContact OG1-CB 3.27Å; T123-E126 WeakPolarHBondContact OG1-CB 3.49Å; T123-E126 PolarHBondContact OG1-N 2.84Å; L124-E126 PolarHBondContact O-N 2.78Å; E126-S130 WeakPolarHBondContact O-CB 3.44Å; E126-S130 PolarHBondContact O-N 3.5Å; E126-S130 VanDerWaalsContact O-N 3.14Å; E126-S130 PolarHBondContact O-OG 3.2Å; E126-L135 HydrophobicContact CG-CD1 4.29Å; E126-L135 HydrophobicContact CG-CD2 3.94Å; E126-K137 WeakPolarHBondContact OE1-CE 3.3Å; E126-K137 IonicContact OE1-NZ 3.39Å; E126-K137 PolarHBondContact OE1-NZ 2.87Å; E126-K137 IonicContact OE2-NZ 3.21Å; E126-K137 PolarHBondContact OE2-NZ 3.08Å
127	I	91.4	Very high	91.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.1	-48.8	177.1	-55.4	169.7	0	0	0	110.3	I32 L97 F99 T123 L124 G125 S130 S133 L135 L152 A154	I32-I127 HydrophobicContact CD1-CD1 4.05Å; L97-I127 HydrophobicContact CD1-CD1 3.79Å; F99-I127 HydrophobicContact CE2-CD1 4.43Å; F99-I127 HydrophobicContact CZ-CD1 4.42Å; T123-I127 PolarHBondContact O-N 3.37Å; L124-I127 PolarHBondContact O-N 3.45Å; G125-I127 VanDerWaalsContact C-N 3.31Å; G125-I127 PolarHBondContact O-N 3.46Å; I127-S130 PolarHBondContact O-N 3Å; I127-S133 CarbonylContact O-C 3.56Å; I127-S133 VanDerWaalsContact O-C 3.32Å; I127-S133 VanDerWaalsContact O-CA 3.28Å; I127-S133 WeakPolarHBondContact O-CA 3.21Å; I127-L135 HydrophobicContact CG1-CB 4.34Å; I127-L135 HydrophobicContact CG1-CD2 3.87Å; I127-L135 HydrophobicContact CG2-CB 4.46Å; I127-L152 HydrophobicContact CD1-CB 4.2Å; I127-L152 HydrophobicContact CD1-CD1 3.82Å; I127-L152 HydrophobicContact CG1-CB 4.4Å; I127-L152 HydrophobicContact CG1-CD1 4.22Å; I127-L152 HydrophobicContact CG2-CB 4.21Å; I127-A154 HydrophobicContact CG2-CB 3.69Å
128	V	89.9	Confident	91.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-70	-35.6	-176.8	-60.8	0	0	0	0	112.4	V30 Y89 L124 G125 S133 A154 L303 Y358	V30-V128 HydrophobicContact CG1-CG1 4.46Å; Y89-V128 HydrophobicContact CE2-CG2 3.81Å; L124-V128 HydrophobicContact CD1-CG1 4.38Å; L124-V128 WeakPolarHBondContact O-CG2 3.35Å; L124-V128 PolarHBondContact O-N 2.87Å; G125-V128 VanDerWaalsContact O-CG2 3.24Å; G125-V128 WeakPolarHBondContact O-CG2 3.36Å; G125-V128 PolarHBondContact O-N 3.37Å; V128-S133 PolarHBondContact O-OG 2.71Å; V128-A154 HydrophobicContact CG1-CB 3.87Å; V128-L303 HydrophobicContact CB-CD2 4.11Å; V128-L303 HydrophobicContact CG2-CD2 4.16Å; V128-Y358 HydrophobicContact CG2-CE1 4.01Å
129	G	87.3	Confident	91.3	Very high	24 Å²	24	38.6 Å²	38.6	25%	0.247	20%	0.201	C	C	.	.	H	α-helix	trans	-78.9	-15	178.6	0	0	0	0	0	114.3	G125	G125-G129 PolarHBondContact O-N 2.77Å
130	S	87.1	Confident	91.1	Very high	19 Å²	19	40.4 Å²	40.4	13%	0.133	22%	0.215	C	C	.	.	S	Bend	trans	-63.6	151	172.5	-71.5	0	0	0	0	111.4	E126 I127 A132 S133 R134	E126-S130 WeakPolarHBondContact O-CB 3.44Å; E126-S130 PolarHBondContact O-N 3.5Å; E126-S130 VanDerWaalsContact O-N 3.14Å; E126-S130 PolarHBondContact O-OG 3.2Å; I127-S130 PolarHBondContact O-N 3Å; S130-A132 PolarHBondContact O-N 3.04Å; S130-S133 VanDerWaalsContact O-CA 3.25Å; S130-S133 WeakPolarHBondContact O-CA 3.05Å; S130-S133 PolarHBondContact O-N 3.03Å; S130-R134 WeakPolarHBondContact CB-O 3.36Å
131	P	82.9	Confident	90.6	Very high	112 Å²	112	42.2 Å²	42.2	73%	0.727	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-51.1	130.6	176	-28.3	35.7	0	0	0	112.4	S133 R134	P131-S133 PolarHBondContact O-N 3.08Å; P131-R134 PolarHBondContact O-N 3.31Å; P131-R134 VanDerWaalsContact O-N 3.17Å
132	A	77.5	Confident	90.3	Very high	40 Å²	40	38.5 Å²	38.5	33%	0.331	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	56.1	23.2	-173.4	0	0	0	0	0	114.6	S130 R134 V553	S130-A132 PolarHBondContact O-N 3.04Å; A132-R134 PolarHBondContact O-N 2.87Å; A132-V553 HydrophobicContact CB-CG1 3.9Å
133	S	85	Confident	89.9	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.007	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	48.9	37.5	-171.4	-60.8	0	0	0	0	113.6	I127 V128 S130 P131 S153 A154 K307	I127-S133 CarbonylContact O-C 3.56Å; I127-S133 VanDerWaalsContact O-C 3.32Å; I127-S133 VanDerWaalsContact O-CA 3.28Å; I127-S133 WeakPolarHBondContact O-CA 3.21Å; V128-S133 PolarHBondContact O-OG 2.71Å; S130-S133 VanDerWaalsContact O-CA 3.25Å; S130-S133 WeakPolarHBondContact O-CA 3.05Å; S130-S133 PolarHBondContact O-N 3.03Å; P131-S133 PolarHBondContact O-N 3.08Å; S133-S153 WeakPolarHBondContact O-CA 3.2Å; S133-A154 WeakPolarHBondContact CB-O 3.34Å; S133-A154 PolarHBondContact O-N 3.03Å; S133-K307 WeakPolarHBondContact OG-CE 3.47Å; S133-K307 WeakPolarHBondContact OG-CG 3.35Å
134	R	86.1	Confident	89.4	Confident	94 Å²	94	48 Å²	48	36%	0.355	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	112.4	179.8	-177.4	-175.3	176.5	-75.1	2.5	110.1	S130 P131 A132 E136 I151 L152	S130-R134 WeakPolarHBondContact CB-O 3.36Å; P131-R134 PolarHBondContact O-N 3.31Å; P131-R134 VanDerWaalsContact O-N 3.17Å; A132-R134 PolarHBondContact O-N 2.87Å; R134-E136 IonicContact CZ-OE2 2.71Å; R134-E136 IonicContact NH1-OE2 2.88Å; R134-E136 PolarHBondContact NH1-OE2 3.09Å; R134-E136 IonicContact NH2-OE2 2.92Å; R134-E136 PolarHBondContact NH2-OE2 3.35Å; R134-I151 HydrophobicContact CG-CG2 4.09Å; R134-I151 VanDerWaalsContact CZ-CG2 3.4Å; R134-I151 VanDerWaalsContact NH2-CD1 3.32Å; R134-I151 VanDerWaalsContact NH2-CG2 3.32Å; R134-L152 CarbonylContact C-O 3.26Å; R134-L152 WeakPolarHBondContact CA-O 3.41Å
135	L	91.3	Very high	89.1	Confident	16 Å²	16	52.8 Å²	52.8	8%	0.084	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	131	177	179.1	64.5	0	0	0	110.5	C122 E126 I127 K137 I151 L152	C122-L135 HydrophobicContact CB-CD2 3.91Å; E126-L135 HydrophobicContact CG-CD1 4.29Å; E126-L135 HydrophobicContact CG-CD2 3.94Å; I127-L135 HydrophobicContact CG1-CB 4.34Å; I127-L135 HydrophobicContact CG1-CD2 3.87Å; I127-L135 HydrophobicContact CG2-CB 4.46Å; L135-K137 HydrophobicContact CD1-CG 4.2Å; L135-K137 HydrophobicContact CD2-CD 4.1Å; L135-K137 HydrophobicContact CD2-CG 4.42Å; L135-K137 HydrophobicContact CG-CD 4.4Å; L135-K137 HydrophobicContact CG-CG 4.18Å; L135-I151 WeakPolarHBondContact O-CA 3.47Å; L135-L152 PolarHBondContact N-O 3.43Å; L135-L152 PolarHBondContact O-N 3.3Å
136	E	93.2	Very high	88.9	Confident	99 Å²	99	58.3 Å²	58.3	46%	0.463	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.6	174.2	-174.7	167.9	153.4	0	0	109.7	R134 I150 I151	R134-E136 IonicContact CZ-OE2 2.71Å; R134-E136 IonicContact NH1-OE2 2.88Å; R134-E136 PolarHBondContact NH1-OE2 3.09Å; R134-E136 IonicContact NH2-OE2 2.92Å; R134-E136 PolarHBondContact NH2-OE2 3.35Å; E136-I150 WeakPolarHBondContact CA-O 3.27Å; E136-I151 HydrophobicContact CB-CG1 4.35Å; E136-I151 HydrophobicContact CG-CG1 3.84Å
137	K	95.2	Very high	88.8	Confident	53 Å²	53	56.4 Å²	56.4	23%	0.23	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.1	-177.1	-81.5	-172.3	157	171.8	0	112.1	V120 Y121 E126 L135 T149 I150	V120-K137 HydrophobicContact CG2-CB 3.64Å; V120-K137 HydrophobicContact CG2-CD 3.42Å; V120-K137 VanDerWaalsContact CG2-CD 3.42Å; V120-K137 HydrophobicContact CG2-CG 4.15Å; Y121-K137 PolarHBondContact O-NZ 3.35Å; E126-K137 WeakPolarHBondContact OE1-CE 3.3Å; E126-K137 IonicContact OE1-NZ 3.39Å; E126-K137 PolarHBondContact OE1-NZ 2.87Å; E126-K137 IonicContact OE2-NZ 3.21Å; E126-K137 PolarHBondContact OE2-NZ 3.08Å; L135-K137 HydrophobicContact CD1-CG 4.2Å; L135-K137 HydrophobicContact CD2-CD 4.1Å; L135-K137 HydrophobicContact CD2-CG 4.42Å; L135-K137 HydrophobicContact CG-CD 4.4Å; L135-K137 HydrophobicContact CG-CG 4.18Å; K137-T149 WeakPolarHBondContact O-CA 3.41Å; K137-I150 HydrophobicContact CB-CG2 4.39Å; K137-I150 PolarHBondContact N-O 2.87Å; K137-I150 PolarHBondContact O-N 3.24Å
138	Q	95.8	Very high	88.8	Confident	125 Å²	125	56.7 Å²	56.7	58%	0.584	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	134	171.1	-65.7	-66.3	-27.1	0	0	109.8	G148 T149	Q138-G148 PolarHBondContact OE1-O 3.1Å; Q138-T149 HydrophobicContact CG-CG2 4.42Å
139	L	94.9	Very high	89	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.037	35%	0.351	C	S	.	.			trans	-72.5	138.7	172.3	-69.5	168.3	0	0	0	109.6	L39 V101 V120 C147 G148 I150	L39-L139 HydrophobicContact CD2-CD1 3.42Å; L39-L139 VanDerWaalsContact CD2-CD1 3.42Å; V101-L139 HydrophobicContact CG2-CD1 3.97Å; V101-L139 HydrophobicContact CG2-CD2 3.74Å; V120-L139 HydrophobicContact CB-CD2 4.49Å; L139-C147 HydrophobicContact CB-CB 3.49Å; L139-C147 VanDerWaalsContact CB-CB 3.49Å; L139-C147 WeakPolarHBondContact CD1-O 3.3Å; L139-C147 WeakPolarHBondContact O-CB 3.29Å; L139-G148 WeakPolarHBondContact CB-O 3.37Å; L139-G148 PolarHBondContact N-O 3.46Å; L139-I150 HydrophobicContact CD2-CB 4.04Å; L139-I150 HydrophobicContact CD2-CG2 3.88Å; L139-I150 HydrophobicContact CG-CB 4.34Å; L139-I150 HydrophobicContact CG-CG2 4.35Å
140	V	93.8	Very high	89.3	Confident	79 Å²	79	56 Å²	56	48%	0.479	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-126.6	-179.6	179.6	-61	0	0	0	0	110.9	G118 Q119	G118-V140 CarbonylContact C-O 3.57Å; G118-V140 WeakPolarHBondContact CA-O 3.4Å; Q119-V140 HydrophobicContact CG-CG2 4.35Å; Q119-V140 PolarHBondContact N-O 3.41Å; Q119-V140 WeakPolarHBondContact O-CG2 3.47Å; Q119-V140 PolarHBondContact O-N 3.4Å
141	G	87.3	Confident	89.4	Confident	45 Å²	45	55.5 Å²	55.5	46%	0.464	34%	0.335	S	S	.	.			trans	106.7	-5.4	174.2	0	0	0	0	0	114.9
142	I	89.1	Confident	89.8	Confident	25 Å²	25	50.2 Å²	50.2	13%	0.128	30%	0.3	C	S	.	.	S	Bend	trans	-118.4	106.7	172.4	-50	178.7	0	0	0	108.8	L40 F116 L117 G144 K145	L40-I142 HydrophobicContact CD2-CD1 3.92Å; F116-I142 HydrophobicContact CD1-CD1 4.2Å; F116-I142 HydrophobicContact CD1-CG1 3.97Å; F116-I142 HydrophobicContact CE1-CG1 4.1Å; F116-I142 VanDerWaalsContact O-CD1 3.25Å; F116-I142 WeakPolarHBondContact O-CD1 3.46Å; L117-I142 WeakPolarHBondContact O-CD1 3.17Å; I142-G144 PolarHBondContact O-N 2.98Å; I142-K145 HydrophobicContact CB-CB 4.38Å; I142-K145 HydrophobicContact CG2-CB 4.05Å; I142-K145 HydrophobicContact CG2-CD 3.93Å; I142-K145 HydrophobicContact CG2-CG 4.03Å; I142-K145 PolarHBondContact O-N 3.45Å
143	P	86.9	Confident	90.2	Very high	128 Å²	128	49.9 Å²	49.9	83%	0.831	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	129.6	-176.8	-26.5	34.8	0	0	0	112.6	K145	P143-K145 VanDerWaalsContact C-N 3.29Å; P143-K145 PolarHBondContact O-N 3.47Å
144	G	84.8	Confident	90.3	Very high	91 Å²	91	50 Å²	50	94%	0.938	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	9.2	174.8	0	0	0	0	0	115.8	I142	I142-G144 PolarHBondContact O-N 2.98Å
145	K	87.1	Confident	90.1	Very high	102 Å²	102	51 Å²	51	44%	0.443	31%	0.305	S	S	.	.			trans	-119.7	144.1	176.3	-63.7	-161.7	179.5	-172.8	0	112.2	L40 I142 P143	L40-K145 HydrophobicContact CD1-CD 4.05Å; L40-K145 HydrophobicContact CD2-CD 3.66Å; I142-K145 HydrophobicContact CB-CB 4.38Å; I142-K145 HydrophobicContact CG2-CB 4.05Å; I142-K145 HydrophobicContact CG2-CD 3.93Å; I142-K145 HydrophobicContact CG2-CG 4.03Å; I142-K145 PolarHBondContact O-N 3.45Å; P143-K145 VanDerWaalsContact C-N 3.29Å; P143-K145 PolarHBondContact O-N 3.47Å
146	T	86.4	Confident	89.7	Confident	122 Å²	122	51.6 Å²	51.6	75%	0.748	31%	0.307	S	S	*	.			trans	-81.1	111.9	164.6	44.6	0	0	0	0	108.9	G148	T146-G148 VanDerWaalsContact C-N 3.33Å
147	C	91.4	Very high	88.6	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.007	30%	0.303	C	S	.	.			trans	-86.9	-2.3	-174.4	-70.1	0	0	0	0	114.2	L40 L117 L139	L40-C147 PolarHBondContact N-O 3.4Å; L117-C147 WeakPolarHBondContact O-CB 3.38Å; L117-C147 PolarHBondContact O-SG 2.86Å; L139-C147 HydrophobicContact CB-CB 3.49Å; L139-C147 VanDerWaalsContact CB-CB 3.49Å; L139-C147 WeakPolarHBondContact CD1-O 3.3Å; L139-C147 WeakPolarHBondContact O-CB 3.29Å
148	G	92.8	Very high	87.1	Confident	6 Å²	6	49.5 Å²	49.5	6%	0.062	31%	0.311	C	S	.	.			trans	90.5	-167.9	-170.7	0	0	0	0	0	112.6	R37 N38 Q138 L139 T146	R37-G148 WeakPolarHBondContact O-CA 3.38Å; N38-G148 WeakPolarHBondContact O-CA 3.34Å; Q138-G148 PolarHBondContact OE1-O 3.1Å; L139-G148 WeakPolarHBondContact CB-O 3.37Å; L139-G148 PolarHBondContact N-O 3.46Å; T146-G148 VanDerWaalsContact C-N 3.33Å
149	T	93.4	Very high	85.2	Confident	11 Å²	11	48.4 Å²	48.4	7%	0.067	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	149.2	-177.4	47.5	0	0	0	0	110.7	C36 R37 K137 Q138	C36-T149 CarbonylContact C-O 3.55Å; C36-T149 WeakPolarHBondContact CA-O 2.87Å; C36-T149 WeakPolarHBondContact CB-O 3.41Å; R37-T149 WeakPolarHBondContact CB-OG1 3.2Å; R37-T149 PolarHBondContact N-O 2.87Å; R37-T149 PolarHBondContact O-N 3.02Å; R37-T149 PolarHBondContact O-OG1 2.79Å; K137-T149 WeakPolarHBondContact O-CA 3.41Å; Q138-T149 HydrophobicContact CG-CG2 4.42Å
150	I	93.5	Very high	83.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.8	170.1	-172.2	171.3	0	0	0	108.8	V34 V52 F99 V120 E136 K137 L139 L152	V34-I150 HydrophobicContact CG1-CD1 3.82Å; V34-I150 HydrophobicContact CG1-CG1 3.95Å; V52-I150 HydrophobicContact CG1-CD1 4.47Å; F99-I150 HydrophobicContact CB-CD1 3.82Å; F99-I150 HydrophobicContact CD1-CD1 4.37Å; F99-I150 HydrophobicContact CG-CD1 4.18Å; V120-I150 HydrophobicContact CB-CG2 4.08Å; V120-I150 HydrophobicContact CG1-CD1 4.33Å; V120-I150 HydrophobicContact CG1-CG2 3.58Å; E136-I150 WeakPolarHBondContact CA-O 3.27Å; K137-I150 HydrophobicContact CB-CG2 4.39Å; K137-I150 PolarHBondContact N-O 2.87Å; K137-I150 PolarHBondContact O-N 3.24Å; L139-I150 HydrophobicContact CD2-CB 4.04Å; L139-I150 HydrophobicContact CD2-CG2 3.88Å; L139-I150 HydrophobicContact CG-CB 4.34Å; L139-I150 HydrophobicContact CG-CG2 4.35Å; I150-L152 HydrophobicContact CD1-CD2 3.83Å; I150-L152 HydrophobicContact CG1-CD2 3.89Å; I150-L152 HydrophobicContact CG1-CG 4.3Å
151	I	89.8	Confident	82.5	Confident	9 Å²	9	49.4 Å²	49.4	5%	0.046	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.7	179.1	-61.8	156.6	0	0	0	106.7	S35 R37 R134 L135 E136	S35-I151 PolarHBondContact N-O 3.25Å; S35-I151 PolarHBondContact O-N 3.36Å; S35-I151 WeakPolarHBondContact OG-CB 3.44Å; R37-I151 HydrophobicContact CG-CD1 3.75Å; R134-I151 HydrophobicContact CG-CG2 4.09Å; R134-I151 VanDerWaalsContact CZ-CG2 3.4Å; R134-I151 VanDerWaalsContact NH2-CD1 3.32Å; R134-I151 VanDerWaalsContact NH2-CG2 3.32Å; L135-I151 WeakPolarHBondContact O-CA 3.47Å; E136-I151 HydrophobicContact CB-CG1 4.35Å; E136-I151 HydrophobicContact CG-CG1 3.84Å
152	L	91.1	Very high	82.2	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.4	-178.6	-56	174.2	0	0	0	108.4	I32 T33 V34 F99 I127 R134 L135 I150	I32-L152 HydrophobicContact CG2-CD2 4.46Å; T33-L152 WeakPolarHBondContact O-CA 3.4Å; V34-L152 HydrophobicContact CB-CD2 4.3Å; V34-L152 HydrophobicContact CG1-CD2 3.99Å; V34-L152 HydrophobicContact CG2-CD2 3.73Å; F99-L152 HydrophobicContact CD1-CD2 4.04Å; F99-L152 HydrophobicContact CD2-CD1 3.92Å; F99-L152 HydrophobicContact CD2-CD2 4.48Å; F99-L152 HydrophobicContact CE1-CD2 3.74Å; F99-L152 HydrophobicContact CE2-CD1 3.54Å; F99-L152 HydrophobicContact CE2-CD2 4.23Å; F99-L152 HydrophobicContact CG-CD2 4.39Å; F99-L152 HydrophobicContact CZ-CD1 3.87Å; F99-L152 HydrophobicContact CZ-CD2 3.84Å; F99-L152 HydrophobicContact CZ-CG 4.49Å; I127-L152 HydrophobicContact CD1-CB 4.2Å; I127-L152 HydrophobicContact CD1-CD1 3.82Å; I127-L152 HydrophobicContact CG1-CB 4.4Å; I127-L152 HydrophobicContact CG1-CD1 4.22Å; I127-L152 HydrophobicContact CG2-CB 4.21Å; R134-L152 CarbonylContact C-O 3.26Å; R134-L152 WeakPolarHBondContact CA-O 3.41Å; L135-L152 PolarHBondContact N-O 3.43Å; L135-L152 PolarHBondContact O-N 3.3Å; I150-L152 HydrophobicContact CD1-CD2 3.83Å; I150-L152 HydrophobicContact CG1-CD2 3.89Å; I150-L152 HydrophobicContact CG1-CG 4.3Å
153	S	85.4	Confident	82	Confident	32 Å²	32	51.5 Å²	51.5	22%	0.224	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.9	174.9	-59.8	0	0	0	0	110.3	I32 T33 S133	I32-S153 CarbonylContact C-O 3.59Å; I32-S153 WeakPolarHBondContact CA-O 3.4Å; T33-S153 PolarHBondContact N-O 3.11Å; T33-S153 PolarHBondContact O-N 2.83Å; S133-S153 WeakPolarHBondContact O-CA 3.2Å
154	A	87.6	Confident	82.1	Confident	3 Å²	3	45.4 Å²	45.4	3%	0.025	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.4	-178.5	0	0	0	0	0	112.5	V30 E31 I127 V128 S133 K307	V30-A154 HydrophobicContact CG1-CB 3.6Å; E31-A154 CarbonylContact O-C 3.47Å; E31-A154 WeakPolarHBondContact O-CA 3.5Å; I127-A154 HydrophobicContact CG2-CB 3.69Å; V128-A154 HydrophobicContact CG1-CB 3.87Å; S133-A154 WeakPolarHBondContact CB-O 3.34Å; S133-A154 PolarHBondContact O-N 3.03Å; A154-K307 VanDerWaalsContact O-CE 3.28Å; A154-K307 WeakPolarHBondContact O-CE 3.04Å; A154-K307 PolarHBondContact O-NZ 2.77Å
155	E	81.4	Confident	82.5	Confident	115 Å²	115	42.8 Å²	42.8	54%	0.537	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.6	175.6	-69.6	-171.5	-166.9	0	0	110.7	V30 E31	V30-E155 CarbonylContact C-O 3.57Å; V30-E155 VanDerWaalsContact CA-O 3.3Å; V30-E155 WeakPolarHBondContact CA-O 3.34Å; E31-E155 PolarHBondContact N-O 2.88Å; E31-E155 PolarHBondContact O-N 2.81Å
156	E	82.4	Confident	82.7	Confident	29 Å²	29	38 Å²	38	14%	0.136	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125.5	-178.3	-166.8	-167.1	163.3	0	0	108.6	T28 G158 R161 T301 L303	T28-E156 WeakPolarHBondContact CB-OE1 3.48Å; T28-E156 HydrophobicContact CG2-CG 3.69Å; T28-E156 WeakPolarHBondContact CG2-OE1 3.35Å; T28-E156 VanDerWaalsContact OG1-CD 3.27Å; T28-E156 WeakPolarHBondContact OG1-CG 3.08Å; T28-E156 PolarHBondContact OG1-OE1 2.99Å; E156-G158 VanDerWaalsContact C-N 3.35Å; E156-G158 PolarHBondContact O-N 3.32Å; E156-R161 VanDerWaalsContact CD-CZ 3.47Å; E156-R161 PolarHBondContact O-NH2 3.34Å; E156-R161 IonicContact OE1-CZ 2.74Å; E156-R161 IonicContact OE1-NH1 3.82Å; E156-R161 IonicContact OE1-NH2 3.84Å; E156-R161 PolarHBondContact OE1-NH2 3.17Å; E156-R161 VanDerWaalsContact OE1-NH2 3.15Å; E156-R161 IonicContact OE2-CZ 3.8Å; E156-R161 VanDerWaalsContact OE2-CZ 3.24Å; E156-R161 IonicContact OE2-NH1 3.51Å; E156-R161 PolarHBondContact OE2-NH1 3.31Å; E156-R161 IonicContact OE2-NH2 2.65Å; E156-R161 PolarHBondContact OE2-NH2 2.78Å; E156-T301 PolarHBondContact OE2-OG1 3.43Å; E156-L303 HydrophobicContact CB-CD1 4.27Å; E156-L303 HydrophobicContact CG-CD1 4Å
157	L	71.3	Confident	83.1	Confident	69 Å²	69	34.4 Å²	34.4	36%	0.361	19%	0.187	S	C	.	.			trans	-83	80.2	-179.1	-69	173.6	0	0	0	110	K29 E31 I86	K29-L157 HydrophobicContact CB-CB 4Å; K29-L157 HydrophobicContact CB-CD1 4.22Å; K29-L157 PolarHBondContact O-N 2.87Å; E31-L157 HydrophobicContact CB-CD1 3.99Å; E31-L157 HydrophobicContact CB-CD2 3.85Å; E31-L157 HydrophobicContact CB-CG 3.83Å; I86-L157 HydrophobicContact CB-CD1 4.25Å; I86-L157 HydrophobicContact CD1-CD1 3.97Å; I86-L157 HydrophobicContact CG1-CD1 3.88Å; I86-L157 HydrophobicContact CG2-CD1 3.52Å
158	G	63.6	Low	83.3	Confident	39 Å²	39	34.4 Å²	34.4	40%	0.402	19%	0.187	S	C	.	.			trans	-98.4	122	168.1	0	0	0	0	0	111.8	E156	E156-G158 VanDerWaalsContact C-N 3.35Å; E156-G158 PolarHBondContact O-N 3.32Å
159	N	56	Low	83.5	Confident	103 Å²	103	35.3 Å²	35.3	55%	0.551	19%	0.192	S	C	*	.	S	Bend	trans	-60.4	149.6	155.7	-68.9	-34.5	0	0	0	108.5	R161 R222	N159-R161 WeakPolarHBondContact O-CG 3.45Å; N159-R161 PolarHBondContact O-N 2.94Å; N159-R222 PolarHBondContact ND2-NH1 2.85Å
160	C	58.6	Low	83.6	Confident	51 Å²	51	35 Å²	35	35%	0.345	19%	0.191	S	C	.	.			trans	-24	103.2	179.5	179	0	0	0	0	112.8	D162	C160-D162 PolarHBondContact O-N 2.84Å; C160-D162 PolarHBondContact SG-OD2 3.2Å; C160-D162 VanDerWaalsContact SG-OD2 3.4Å
161	R	71.8	Confident	83.7	Confident	55 Å²	55	38.6 Å²	38.6	21%	0.208	21%	0.21	C	C	.	.			trans	-86.1	10.8	-175.1	-60.3	-176.1	-176.4	153.8	8.5	112.7	E156 N159 E299 D304	E156-R161 VanDerWaalsContact CD-CZ 3.47Å; E156-R161 PolarHBondContact O-NH2 3.34Å; E156-R161 IonicContact OE1-CZ 2.74Å; E156-R161 IonicContact OE1-NH1 3.82Å; E156-R161 IonicContact OE1-NH2 3.84Å; E156-R161 PolarHBondContact OE1-NH2 3.17Å; E156-R161 VanDerWaalsContact OE1-NH2 3.15Å; E156-R161 IonicContact OE2-CZ 3.8Å; E156-R161 VanDerWaalsContact OE2-CZ 3.24Å; E156-R161 IonicContact OE2-NH1 3.51Å; E156-R161 PolarHBondContact OE2-NH1 3.31Å; E156-R161 IonicContact OE2-NH2 2.65Å; E156-R161 PolarHBondContact OE2-NH2 2.78Å; N159-R161 WeakPolarHBondContact O-CG 3.45Å; N159-R161 PolarHBondContact O-N 2.94Å; R161-E299 WeakPolarHBondContact O-CB 3.45Å; R161-E299 PolarHBondContact O-N 3.07Å; R161-D304 IonicContact NH1-OD1 3.07Å; R161-D304 PolarHBondContact NH1-OD1 2.95Å; R161-D304 IonicContact NH1-OD2 2.97Å; R161-D304 PolarHBondContact NH1-OD2 3.41Å
162	D	81.8	Confident	84	Confident	34 Å²	34	45.5 Å²	45.5	18%	0.182	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	136.2	-175.9	-59	-30.7	0	0	0	109.3	C160 V221 V296 E297 S298	C160-D162 PolarHBondContact O-N 2.84Å; C160-D162 PolarHBondContact SG-OD2 3.2Å; C160-D162 VanDerWaalsContact SG-OD2 3.4Å; D162-V221 HydrophobicContact CB-CB 4.04Å; D162-V221 HydrophobicContact CB-CG2 3.6Å; D162-V221 WeakPolarHBondContact O-CB 3.37Å; D162-V221 VanDerWaalsContact O-CG2 3.3Å; D162-V221 WeakPolarHBondContact O-CG2 3.41Å; D162-V221 PolarHBondContact O-N 3.05Å; D162-V296 HydrophobicContact CB-CG1 3.75Å; D162-E297 WeakPolarHBondContact CA-O 3.5Å; D162-S298 WeakPolarHBondContact OD1-CA 3.42Å; D162-S298 WeakPolarHBondContact OD1-CB 3.47Å; D162-S298 PolarHBondContact OD1-OG 3.33Å
163	Y	85.4	Confident	84.3	Confident	80 Å²	80	45.6 Å²	45.6	31%	0.314	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.9	166.6	-76.1	-104.8	0	0	0	108.8	I219 P220 V296 E297 E299	Y163-I219 WeakPolarHBondContact CA-O 3.5Å; Y163-P220 HydrophobicContact CD1-CB 4.4Å; Y163-P220 HydrophobicContact CD1-CG 4.08Å; Y163-P220 HydrophobicContact CE1-CB 4.11Å; Y163-P220 HydrophobicContact CE1-CG 3.49Å; Y163-P220 VanDerWaalsContact CE1-CG 3.49Å; Y163-V296 WeakPolarHBondContact O-CA 3.48Å; Y163-E297 PolarHBondContact N-O 3.32Å; Y163-E297 PolarHBondContact O-N 3.49Å; Y163-E299 HydrophobicContact CD2-CB 3.9Å; Y163-E299 HydrophobicContact CE2-CB 3.87Å; Y163-E299 HydrophobicContact CE2-CG 4.49Å; Y163-E299 WeakPolarHBondContact CE2-OE2 3.03Å; Y163-E299 PolarHBondContact OH-OE2 3.16Å
164	A	89.3	Confident	84.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	108.7	170.4	0	0	0	0	0	108.5	M166 S218 I219 V221 L224 F294 N295	A164-M166 HydrophobicContact CB-CE 3.55Å; A164-S218 WeakPolarHBondContact O-CA 3.41Å; A164-I219 PolarHBondContact N-O 2.98Å; A164-I219 PolarHBondContact O-N 3.13Å; A164-V221 HydrophobicContact CB-CG2 4.23Å; A164-L224 HydrophobicContact CB-CD1 3.81Å; A164-F294 HydrophobicContact CB-CE2 3.68Å; A164-F294 HydrophobicContact CB-CZ 3.72Å; A164-N295 CarbonylContact C-O 3.58Å; A164-N295 WeakPolarHBondContact CA-O 3.49Å
165	T	91.8	Very high	84.9	Confident	37 Å²	37	51.4 Å²	51.4	23%	0.227	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.2	170.7	-61	0	0	0	0	108.8	F217 S218 F294 N295	T165-F217 CarbonylContact C-O 3.51Å; T165-F217 WeakPolarHBondContact CA-O 3.04Å; T165-S218 PolarHBondContact OG1-OG 3.36Å; T165-F294 WeakPolarHBondContact O-CA 3.15Å; T165-N295 PolarHBondContact N-O 3.43Å; T165-N295 PolarHBondContact O-N 3.15Å
166	M	92.2	Very high	85.3	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	150.1	-174.4	61.1	-168.4	80.6	0	0	112.3	A164 F168 P216 F217 I219 L224 L291 S293 F294	A164-M166 HydrophobicContact CB-CE 3.55Å; M166-F168 HydrophobicContact CB-CE2 4.1Å; M166-F168 HydrophobicContact CG-CD2 4.35Å; M166-F168 HydrophobicContact CG-CE2 3.73Å; M166-F168 HydrophobicContact SD-CE2 3.58Å; M166-F168 VanDerWaalsContact SD-CE2 3.58Å; M166-F168 HydrophobicContact SD-CZ 4.17Å; M166-P216 WeakPolarHBondContact O-CA 3.39Å; M166-F217 HydrophobicContact CG-CD2 3.96Å; M166-F217 HydrophobicContact CG-CE1 4.17Å; M166-F217 HydrophobicContact CG-CE2 3.29Å; M166-F217 HydrophobicContact CG-CZ 3.44Å; M166-F217 VanDerWaalsContact CG-CZ 3.44Å; M166-F217 PolarHBondContact N-O 3.3Å; M166-F217 PolarHBondContact O-N 2.92Å; M166-F217 HydrophobicContact SD-CE2 3.62Å; M166-F217 HydrophobicContact SD-CZ 3.86Å; M166-I219 HydrophobicContact CE-CD1 4.39Å; M166-L224 HydrophobicContact CE-CD1 3.79Å; M166-L291 HydrophobicContact CB-CD1 3.93Å; M166-S293 WeakPolarHBondContact CA-O 3.47Å; M166-F294 HydrophobicContact CB-CD2 4.03Å; M166-F294 HydrophobicContact CE-CD2 4.16Å; M166-F294 HydrophobicContact CE-CE2 3.71Å
167	Q	95.1	Very high	85.4	Confident	46 Å²	46	48.5 Å²	48.5	22%	0.215	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.2	175	-168.1	-178.6	22.8	0	0	109.1	W214 P216 L292 S293	Q167-W214 VanDerWaalsContact CG-O 3.31Å; Q167-W214 WeakPolarHBondContact CG-O 3.43Å; Q167-W214 PolarHBondContact NE2-O 3.38Å; Q167-W214 VanDerWaalsContact NE2-O 3.1Å; Q167-P216 HydrophobicContact CB-CB 4.36Å; Q167-P216 HydrophobicContact CB-CG 4.29Å; Q167-P216 HydrophobicContact CG-CG 4.11Å; Q167-L292 HydrophobicContact CB-CB 4.28Å; Q167-L292 HydrophobicContact CG-CB 4.49Å; Q167-L292 HydrophobicContact CG-CD1 4.19Å; Q167-L292 WeakPolarHBondContact O-CB 3.18Å; Q167-L292 PolarHBondContact O-N 3.4Å; Q167-S293 WeakPolarHBondContact CB-OG 3.3Å; Q167-S293 PolarHBondContact N-O 2.84Å; Q167-S293 PolarHBondContact O-N 3.16Å
168	F	95.1	Very high	85.8	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	153.7	178.6	-70.5	-91.5	0	0	0	111.2	M166 M186 F188 W214 F217 L259 Y269 V289 S290 L291	M166-F168 HydrophobicContact CB-CE2 4.1Å; M166-F168 HydrophobicContact CG-CD2 4.35Å; M166-F168 HydrophobicContact CG-CE2 3.73Å; M166-F168 HydrophobicContact SD-CE2 3.58Å; M166-F168 VanDerWaalsContact SD-CE2 3.58Å; M166-F168 HydrophobicContact SD-CZ 4.17Å; F168-M186 HydrophobicContact CB-SD 4.38Å; F168-F188 AromaticContact CD2-CZ 3.84Å; F168-F188 HydrophobicContact CD2-CZ 3.84Å; F168-F188 AromaticContact CE2-CE1 3.85Å; F168-F188 HydrophobicContact CE2-CE1 3.85Å; F168-F188 AromaticContact CE2-CZ 3.54Å; F168-F188 HydrophobicContact CE2-CZ 3.54Å; F168-F188 AromaticContact CZ-CE1 3.95Å; F168-F188 HydrophobicContact CZ-CE1 3.95Å; F168-F188 HydrophobicContact CZ-CZ 4.05Å; F168-W214 HydrophobicContact CB-CE3 3.9Å; F168-W214 HydrophobicContact CB-CZ3 4.28Å; F168-W214 PolarHBondContact O-N 2.9Å; F168-F217 AromaticContact CD2-CE1 3.94Å; F168-F217 HydrophobicContact CD2-CE1 3.94Å; F168-F217 AromaticContact CD2-CZ 3.85Å; F168-F217 HydrophobicContact CD2-CZ 3.85Å; F168-F217 HydrophobicContact CE2-CE1 4.42Å; F168-F217 AromaticContact CE2-CZ 3.86Å; F168-F217 HydrophobicContact CE2-CZ 3.86Å; F168-L259 HydrophobicContact CZ-CD2 4.21Å; F168-Y269 HydrophobicContact CE1-CE2 4.31Å; F168-V289 HydrophobicContact CB-CG1 4.37Å; F168-V289 HydrophobicContact CD1-CG1 3.59Å; F168-V289 HydrophobicContact CE1-CG1 4.31Å; F168-V289 HydrophobicContact CG-CG1 4.35Å; F168-S290 WeakPolarHBondContact CA-O 3.28Å; F168-L291 HydrophobicContact CD1-CB 4.1Å; F168-L291 HydrophobicContact CD1-CD1 4.14Å; F168-L291 HydrophobicContact CD2-CD1 4.27Å; F168-L291 HydrophobicContact CE1-CB 3.79Å; F168-L291 HydrophobicContact CE1-CD1 3.64Å; F168-L291 HydrophobicContact CE1-CG 4.29Å; F168-L291 HydrophobicContact CE2-CD1 3.78Å; F168-L291 HydrophobicContact CG-CD1 4.45Å; F168-L291 HydrophobicContact CZ-CB 4.44Å; F168-L291 HydrophobicContact CZ-CD1 3.45Å; F168-L291 VanDerWaalsContact CZ-CD1 3.45Å; F168-L291 HydrophobicContact CZ-CG 4.47Å
169	C	96.1	Very high	86.5	Confident	25 Å²	25	62.3 Å²	62.3	17%	0.169	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	162	159.5	69.6	0	0	0	0	110.1	P212 V213 V289 S290 L292	C169-P212 CarbonylContact C-O 3.49Å; C169-P212 VanDerWaalsContact CA-O 3.22Å; C169-P212 WeakPolarHBondContact CA-O 3.01Å; C169-P212 WeakPolarHBondContact CB-O 3.37Å; C169-V213 HydrophobicContact CB-CB 4.36Å; C169-V213 HydrophobicContact CB-CG1 4.46Å; C169-V213 HydrophobicContact CB-CG2 3.9Å; C169-V289 CarbonylContact O-C 3.4Å; C169-V289 WeakPolarHBondContact O-CA 3.42Å; C169-S290 PolarHBondContact N-O 3.21Å; C169-S290 PolarHBondContact O-N 2.92Å; C169-L292 HydrophobicContact CB-CD1 3.97Å; C169-L292 HydrophobicContact CB-CG 4.28Å
170	A	96.8	Very high	87.9	Confident	5 Å²	5	59 Å²	59	4%	0.041	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	163.5	168.7	0	0	0	0	0	111.4	L173 N211 P212 W214 T288 V289	A170-L173 HydrophobicContact CB-CD1 3.8Å; A170-L173 HydrophobicContact CB-CD2 3.86Å; A170-L173 HydrophobicContact CB-CG 3.8Å; A170-N211 CarbonylContact O-C 3.49Å; A170-N211 WeakPolarHBondContact O-CA 3.38Å; A170-P212 HydrophobicContact CB-CG 3.81Å; A170-P212 PolarHBondContact N-O 3.09Å; A170-W214 HydrophobicContact CB-CH2 3.67Å; A170-W214 HydrophobicContact CB-CZ3 3.82Å; A170-T288 CarbonylContact C-O 3.5Å; A170-T288 WeakPolarHBondContact CA-O 3.44Å; A170-T288 WeakPolarHBondContact CB-O 3.49Å; A170-V289 HydrophobicContact CB-CG2 3.85Å
171	N	96.2	Very high	89.4	Confident	75 Å²	75	61.1 Å²	61.1	40%	0.401	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	135.6	-178.5	-173	31.8	0	0	0	109.9	L173 N211 G287 T288	N171-L173 VanDerWaalsContact C-N 3.29Å; N171-L173 PolarHBondContact O-N 2.6Å; N171-N211 WeakPolarHBondContact CA-OD1 3.13Å; N171-N211 PolarHBondContact OD1-OD1 3.39Å; N171-G287 WeakPolarHBondContact O-CA 3.23Å; N171-T288 PolarHBondContact N-O 3.34Å; N171-T288 PolarHBondContact O-N 3.15Å
172	K	95.8	Very high	90.5	Very high	153 Å²	153	58.5 Å²	58.5	67%	0.665	28%	0.28	S	S	*	.	S	Bend	trans	51.6	43.9	177.8	-60.2	175.7	-178	174.6	0	113.2	L210 N211 G287	K172-L210 PolarHBondContact N-O 3.06Å; K172-L210 VanDerWaalsContact N-O 3.16Å; K172-N211 PolarHBondContact N-OD1 3.34Å; K172-G287 WeakPolarHBondContact O-CA 3.4Å
173	L	96.3	Very high	91	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.016	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-58.9	150.1	171.9	-65.9	-179.1	0	0	0	111.1	A170 N171 K175 P184 L210 P212 V237 I249 V271 S286	A170-L173 HydrophobicContact CB-CD1 3.8Å; A170-L173 HydrophobicContact CB-CD2 3.86Å; A170-L173 HydrophobicContact CB-CG 3.8Å; N171-L173 VanDerWaalsContact C-N 3.29Å; N171-L173 PolarHBondContact O-N 2.6Å; L173-K175 PolarHBondContact O-N 3Å; L173-P184 HydrophobicContact CD1-CB 3.62Å; L173-P184 HydrophobicContact CD1-CG 3.98Å; L173-L210 HydrophobicContact CB-CB 4.45Å; L173-L210 PolarHBondContact N-O 3.13Å; L173-L210 WeakPolarHBondContact O-CD2 3.31Å; L173-P212 HydrophobicContact CD1-CG 3.85Å; L173-V237 HydrophobicContact CD1-CG1 4.02Å; L173-V237 HydrophobicContact CD2-CG1 4.33Å; L173-I249 HydrophobicContact CD2-CG2 4.41Å; L173-V271 HydrophobicContact CD2-CG2 4.33Å; L173-S286 WeakPolarHBondContact CA-O 3.4Å
174	D	92.9	Very high	91.5	Very high	49 Å²	49	54.3 Å²	54.3	26%	0.262	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-68.7	123.3	175.9	-89.4	-7.9	0	0	0	111	K176 S182 I249 K276 S286	D174-K176 PolarHBondContact O-N 3.49Å; D174-S182 PolarHBondContact O-OG 3.43Å; D174-I249 HydrophobicContact CB-CG2 4.31Å; D174-K276 IonicContact OD2-NZ 2.57Å; D174-K276 PolarHBondContact OD2-NZ 2.9Å; D174-S286 PolarHBondContact N-O 3.11Å; D174-S286 PolarHBondContact OD2-OG 2.96Å
175	K	92.5	Very high	91.7	Very high	109 Å²	109	54.5 Å²	54.5	47%	0.474	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-61.4	127	170.7	-171.2	-162.9	-169.7	-133.4	0	110.9	L173 D177 F178 G180 L210	L173-K175 PolarHBondContact O-N 3Å; K175-D177 WeakPolarHBondContact CE-O 3.3Å; K175-D177 PolarHBondContact NZ-O 3.26Å; K175-F178 PolarHBondContact NZ-O 3.17Å; K175-G180 WeakPolarHBondContact CE-O 3.45Å; K175-G180 PolarHBondContact NZ-O 2.89Å; K175-L210 HydrophobicContact CB-CD1 4.36Å; K175-L210 HydrophobicContact CB-CD2 4.09Å
176	K	90	Very high	92	Very high	42 Å²	42	52.7 Å²	52.7	18%	0.183	25%	0.253	C	S	.	.			trans	-108.9	-32.7	170.6	-39.8	-62.4	-133.1	62.3	0	113.6	D174 S182 D239 D247 F248 I249	D174-K176 PolarHBondContact O-N 3.49Å; K176-S182 PolarHBondContact N-OG 2.95Å; K176-D239 HydrophobicContact CB-CB 4.17Å; K176-D239 WeakPolarHBondContact CB-OD2 3.43Å; K176-D239 HydrophobicContact CG-CB 3.89Å; K176-D239 WeakPolarHBondContact CG-OD2 3.05Å; K176-D247 HydrophobicContact CB-CB 4.05Å; K176-D247 WeakPolarHBondContact CB-OD2 3.32Å; K176-D247 HydrophobicContact CG-CB 4.1Å; K176-D247 IonicContact NZ-OD1 2.93Å; K176-D247 PolarHBondContact NZ-OD1 3.41Å; K176-D247 IonicContact NZ-OD2 3.25Å; K176-F248 VanDerWaalsContact CE-O 3.25Å; K176-F248 WeakPolarHBondContact CE-O 3.41Å; K176-F248 PolarHBondContact NZ-O 2.97Å; K176-I249 HydrophobicContact CD-CG1 4.49Å; K176-I249 HydrophobicContact CG-CG1 4.11Å
177	D	84.6	Confident	92	Very high	40 Å²	40	53.1 Å²	53.1	21%	0.214	26%	0.255	C	S	.	.			trans	-65	140.7	177.2	-72.3	-45.9	0	0	0	115.4	K175	K175-D177 WeakPolarHBondContact CE-O 3.3Å; K175-D177 PolarHBondContact NZ-O 3.26Å
178	F	79.5	Confident	91.9	Very high	190 Å²	190	51.1 Å²	51.1	83%	0.833	25%	0.246	S	C	*	.	S	Bend	trans	-70.8	-47	171.9	-84.1	-89.6	0	0	0	111.6	K175	K175-F178 PolarHBondContact NZ-O 3.17Å
179	F	78.8	Confident	91.7	Very high	208 Å²	208	52.7 Å²	52.7	91%	0.912	25%	0.252	S	S	*	.	S	Bend	trans	-116.4	88.8	-178.1	-68.9	-79.7	0	0	0	111.8
180	G	84.9	Confident	91.4	Very high	33 Å²	33	53.5 Å²	53.5	34%	0.34	25%	0.252	S	S	.	.	S	Bend	trans	132.9	-177.1	-174.8	0	0	0	0	0	110.6	K175	K175-G180 WeakPolarHBondContact CE-O 3.45Å; K175-G180 PolarHBondContact NZ-O 2.89Å
181	K	91.7	Very high	90.9	Very high	97 Å²	97	54.3 Å²	54.3	42%	0.422	26%	0.257	S	S	.	.			trans	-96.1	168.6	158.6	-63.7	168.2	-177.7	171.6	0	107.7	N208 L210	K181-N208 WeakPolarHBondContact CB-OD1 3.19Å; K181-N208 PolarHBondContact N-OD1 2.95Å; K181-L210 HydrophobicContact CB-CD2 3.98Å; K181-L210 HydrophobicContact CB-CG 4.11Å; K181-L210 HydrophobicContact CD-CG 4.19Å; K181-L210 HydrophobicContact CG-CD2 4.48Å; K181-L210 HydrophobicContact CG-CG 4.14Å
182	S	93.1	Very high	89.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.247	C	C	.	.			trans	-54.9	156.6	173.4	-66.5	0	0	0	0	113.5	D174 K176 P184 N208 T209 D239	D174-S182 PolarHBondContact O-OG 3.43Å; K176-S182 PolarHBondContact N-OG 2.95Å; S182-P184 WeakPolarHBondContact O-CD 3.29Å; S182-N208 CarbonylContact O-C 3.56Å; S182-N208 WeakPolarHBondContact O-CA 3.47Å; S182-N208 PolarHBondContact O-N 3.14Å; S182-T209 PolarHBondContact O-N 3Å; S182-D239 WeakPolarHBondContact CA-OD1 3.47Å; S182-D239 WeakPolarHBondContact CA-OD2 3.47Å; S182-D239 VanDerWaalsContact CB-OD1 3.24Å; S182-D239 WeakPolarHBondContact CB-OD1 3.15Å; S182-D239 WeakPolarHBondContact CB-OD2 3.01Å; S182-D239 VanDerWaalsContact OG-CG 3.31Å; S182-D239 PolarHBondContact OG-OD2 2.93Å
183	D	93.1	Very high	88.9	Confident	25 Å²	25	53.2 Å²	53.2	13%	0.134	25%	0.253	C	S	.	.			trans	-106.8	69	170.5	-68.5	-18.6	0	0	0	110.1	V205 V206 K207 N208 D239 W240	D183-V205 HydrophobicContact CB-CG1 3.85Å; D183-V206 CarbonylContact C-O 3.52Å; D183-V206 WeakPolarHBondContact CA-O 3.34Å; D183-K207 WeakPolarHBondContact OD1-CA 3.44Å; D183-K207 WeakPolarHBondContact OD1-CB 3.42Å; D183-N208 PolarHBondContact OD1-N 2.56Å; D183-D239 PolarHBondContact N-OD1 2.82Å; D183-W240 HydrophobicContact CB-CB 4Å; D183-W240 WeakPolarHBondContact O-CB 3.43Å; D183-W240 PolarHBondContact O-N 3.07Å
184	P	95.6	Very high	87.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	143	-168.3	27.8	-39.3	0	0	0	115.6	L173 S182 V206 T209 P212 W214 Y238	L173-P184 HydrophobicContact CD1-CB 3.62Å; L173-P184 HydrophobicContact CD1-CG 3.98Å; S182-P184 WeakPolarHBondContact O-CD 3.29Å; P184-V206 WeakPolarHBondContact CD-O 3.36Å; P184-V206 PolarHBondContact O-N 2.92Å; P184-V206 VanDerWaalsContact O-N 3.15Å; P184-T209 VanDerWaalsContact CD-O 3.27Å; P184-T209 WeakPolarHBondContact CD-O 3.46Å; P184-T209 HydrophobicContact CG-CG2 4.09Å; P184-P212 HydrophobicContact CB-CG 4.09Å; P184-P212 HydrophobicContact CG-CB 3.78Å; P184-P212 HydrophobicContact CG-CG 3.53Å; P184-W214 HydrophobicContact CB-CZ2 4.21Å; P184-W214 PolarHBondContact O-NE1 3.45Å; P184-Y238 WeakPolarHBondContact CA-O 3.49Å
185	F	94.5	Very high	87	Confident	4 Å²	4	59 Å²	59	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	162.4	165.6	70	-84.9	0	0	0	111.4	V187 K202 E204 V205 Y238 W240 H246	F185-V187 HydrophobicContact CD2-CG2 4.01Å; F185-V187 HydrophobicContact CE2-CG2 3.64Å; F185-K202 HydrophobicContact CD2-CD 4.32Å; F185-K202 VanDerWaalsContact CD2-CE 3.45Å; F185-K202 HydrophobicContact CD2-CG 4.13Å; F185-K202 HydrophobicContact CE2-CD 4.28Å; F185-E204 WeakPolarHBondContact CB-O 3.43Å; F185-V205 HydrophobicContact CB-CG2 4.06Å; F185-V205 HydrophobicContact CD1-CG2 4.04Å; F185-V205 HydrophobicContact CG-CG2 4.25Å; F185-Y238 VanDerWaalsContact CE1-CB 3.41Å; F185-Y238 HydrophobicContact CE1-CG 4.41Å; F185-Y238 HydrophobicContact CE2-CD2 4.04Å; F185-Y238 HydrophobicContact CE2-CG 4.2Å; F185-Y238 HydrophobicContact CZ-CD2 4.17Å; F185-Y238 AromaticContact CZ-CG 3.87Å; F185-Y238 HydrophobicContact CZ-CG 3.87Å; F185-Y238 PolarHBondContact N-O 2.63Å; F185-Y238 PolarHBondContact O-N 3.18Å; F185-W240 HydrophobicContact CD1-CB 3.96Å; F185-W240 HydrophobicContact CE1-CB 4.01Å; F185-H246 HydrophobicContact CE1-CB 4.18Å; F185-H246 AromaticContact CE1-CD2 3.98Å; F185-H246 AromaticContact CE1-CG 3.94Å; F185-H246 HydrophobicContact CZ-CB 4.09Å; F185-H246 AromaticContact CZ-CD2 3.59Å; F185-H246 AromaticContact CZ-CG 3.89Å
186	M	96.6	Very high	86.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	147.1	178.7	-65.9	-178	62.3	0	0	112.4	F168 F188 K202 T203 W214 A235 E236 V237 F252 V289	F168-M186 HydrophobicContact CB-SD 4.38Å; M186-F188 HydrophobicContact CB-CE2 3.98Å; M186-F188 HydrophobicContact CB-CZ 4.5Å; M186-F188 HydrophobicContact CE-CE1 3.92Å; M186-F188 HydrophobicContact CE-CE2 4.03Å; M186-F188 HydrophobicContact CE-CZ 3.41Å; M186-F188 VanDerWaalsContact CE-CZ 3.41Å; M186-F188 HydrophobicContact SD-CZ 4.28Å; M186-K202 WeakPolarHBondContact O-CA 3.45Å; M186-T203 HydrophobicContact CB-CG2 3.94Å; M186-T203 PolarHBondContact N-OG1 3.22Å; M186-T203 PolarHBondContact O-N 2.88Å; M186-W214 HydrophobicContact CG-CE3 4.49Å; M186-W214 HydrophobicContact CG-CH2 3.62Å; M186-W214 HydrophobicContact CG-CZ2 3.68Å; M186-W214 HydrophobicContact CG-CZ3 4.07Å; M186-W214 HydrophobicContact SD-CD2 4.37Å; M186-W214 HydrophobicContact SD-CE3 3.81Å; M186-W214 HydrophobicContact SD-CH2 3.51Å; M186-W214 VanDerWaalsContact SD-CH2 3.51Å; M186-W214 HydrophobicContact SD-CZ2 4.12Å; M186-W214 HydrophobicContact SD-CZ3 3.35Å; M186-W214 WeakPolarHBondContact SD-CZ3 3.44Å; M186-A235 HydrophobicContact CE-CB 3.83Å; M186-E236 CarbonylContact C-O 3.57Å; M186-E236 VanDerWaalsContact CA-O 3.29Å; M186-E236 WeakPolarHBondContact CA-O 3.34Å; M186-V237 HydrophobicContact CG-CG2 4.23Å; M186-F252 HydrophobicContact CE-CE1 3.61Å; M186-F252 HydrophobicContact CE-CZ 3.69Å; M186-V289 HydrophobicContact CE-CG1 4.19Å; M186-V289 HydrophobicContact SD-CG1 4.27Å; M186-V289 HydrophobicContact SD-CG2 4.42Å
187	V	92.8	Very high	86.1	Confident	9 Å²	9	58.9 Å²	58.9	6%	0.055	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	126.6	169.4	-168	0	0	0	0	109.1	F185 Y189 I199 K202 A235 E236 Y238	F185-V187 HydrophobicContact CD2-CG2 4.01Å; F185-V187 HydrophobicContact CE2-CG2 3.64Å; V187-Y189 HydrophobicContact CB-CE2 3.69Å; V187-Y189 HydrophobicContact CG1-CD2 4.26Å; V187-Y189 HydrophobicContact CG1-CE1 4.29Å; V187-Y189 HydrophobicContact CG1-CE2 3.51Å; V187-Y189 WeakPolarHBondContact CG1-OH 3.08Å; V187-I199 HydrophobicContact CG1-CD1 4.43Å; V187-I199 HydrophobicContact CG1-CG1 4.19Å; V187-I199 HydrophobicContact CG1-CG2 4.06Å; V187-K202 HydrophobicContact CG2-CD 4.46Å; V187-K202 HydrophobicContact CG2-CG 4.21Å; V187-A235 WeakPolarHBondContact O-CA 3.29Å; V187-E236 PolarHBondContact N-O 3.41Å; V187-E236 PolarHBondContact O-N 2.91Å; V187-Y238 HydrophobicContact CG2-CD2 4.17Å; V187-Y238 HydrophobicContact CG2-CE2 4.24Å
188	F	92.8	Very high	85.6	Confident	5 Å²	5	59.7 Å²	59.7	2%	0.022	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	137.7	178.9	-66.6	-93.6	0	0	0	110.3	F168 M186 C200 H201 T203 F217 I233 K234 A235	F168-F188 AromaticContact CD2-CZ 3.84Å; F168-F188 HydrophobicContact CD2-CZ 3.84Å; F168-F188 AromaticContact CE2-CE1 3.85Å; F168-F188 HydrophobicContact CE2-CE1 3.85Å; F168-F188 AromaticContact CE2-CZ 3.54Å; F168-F188 HydrophobicContact CE2-CZ 3.54Å; F168-F188 AromaticContact CZ-CE1 3.95Å; F168-F188 HydrophobicContact CZ-CE1 3.95Å; F168-F188 HydrophobicContact CZ-CZ 4.05Å; M186-F188 HydrophobicContact CB-CE2 3.98Å; M186-F188 HydrophobicContact CB-CZ 4.5Å; M186-F188 HydrophobicContact CE-CE1 3.92Å; M186-F188 HydrophobicContact CE-CE2 4.03Å; M186-F188 HydrophobicContact CE-CZ 3.41Å; M186-F188 VanDerWaalsContact CE-CZ 3.41Å; M186-F188 HydrophobicContact SD-CZ 4.28Å; F188-C200 HydrophobicContact CB-CB 4.47Å; F188-C200 PolarHBondContact O-N 3.11Å; F188-H201 HydrophobicContact CB-CB 4.48Å; F188-H201 HydrophobicContact CD2-CB 4.43Å; F188-H201 PolarHBondContact N-O 3.02Å; F188-T203 HydrophobicContact CE2-CG2 4.11Å; F188-F217 HydrophobicContact CD2-CE2 4.46Å; F188-F217 HydrophobicContact CD2-CZ 4.14Å; F188-F217 HydrophobicContact CE2-CE1 4.1Å; F188-F217 HydrophobicContact CE2-CE2 4.15Å; F188-F217 AromaticContact CE2-CZ 3.41Å; F188-F217 HydrophobicContact CE2-CZ 3.41Å; F188-F217 VanDerWaalsContact CE2-CZ 3.41Å; F188-F217 HydrophobicContact CZ-CE1 4.45Å; F188-F217 AromaticContact CZ-CZ 3.68Å; F188-F217 HydrophobicContact CZ-CZ 3.68Å; F188-I233 HydrophobicContact CD1-CG2 4.36Å; F188-K234 CarbonylContact C-O 3.59Å; F188-A235 HydrophobicContact CD1-CB 3.91Å; F188-A235 HydrophobicContact CE1-CB 3.89Å
189	Y	90.6	Very high	85.7	Confident	35 Å²	35	55.6 Å²	55.6	14%	0.137	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	142.3	-179.3	-57.6	-100.5	0	0	0	111.1	V187 F197 T198 I199 I233 K234 E236	V187-Y189 HydrophobicContact CB-CE2 3.69Å; V187-Y189 HydrophobicContact CG1-CD2 4.26Å; V187-Y189 HydrophobicContact CG1-CE1 4.29Å; V187-Y189 HydrophobicContact CG1-CE2 3.51Å; V187-Y189 WeakPolarHBondContact CG1-OH 3.08Å; Y189-F197 HydrophobicContact CD1-CB 4.11Å; Y189-F197 HydrophobicContact CG-CB 4.39Å; Y189-T198 CarbonylContact C-O 3.53Å; Y189-T198 WeakPolarHBondContact CA-O 3.34Å; Y189-I199 HydrophobicContact CD1-CB 4.46Å; Y189-I199 HydrophobicContact CD1-CG1 3.63Å; Y189-I199 HydrophobicContact CE1-CB 4.47Å; Y189-I199 HydrophobicContact CE1-CD1 4.03Å; Y189-I199 HydrophobicContact CE1-CG1 3.25Å; Y189-I233 CarbonylContact O-C 3.54Å; Y189-I233 VanDerWaalsContact O-CA 3.25Å; Y189-I233 WeakPolarHBondContact O-CA 3.5Å; Y189-K234 PolarHBondContact N-O 3.01Å; Y189-K234 PolarHBondContact O-N 2.85Å; Y189-E236 HydrophobicContact CD2-CG 4.36Å; Y189-E236 HydrophobicContact CE2-CB 4.17Å; Y189-E236 HydrophobicContact CE2-CG 3.9Å; Y189-E236 PolarHBondContact OH-OE2 3.17Å
190	R	89.8	Confident	85.9	Confident	42 Å²	42	47 Å²	47	16%	0.158	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	136.2	167.3	175.3	-167.9	71.8	-150.6	-1.1	109.8	N192 F197 T198 C200 R222 A223 L224 R231	R190-N192 PolarHBondContact NH2-OD1 3.37Å; R190-F197 WeakPolarHBondContact O-CA 3.32Å; R190-T198 PolarHBondContact N-O 2.78Å; R190-T198 PolarHBondContact O-N 3.47Å; R190-C200 WeakPolarHBondContact CB-SG 3.49Å; R190-C200 PolarHBondContact N-SG 2.86Å; R190-R222 PolarHBondContact NH1-O 3.14Å; R190-A223 WeakPolarHBondContact CD-O 3.35Å; R190-A223 PolarHBondContact NH1-O 3.09Å; R190-L224 WeakPolarHBondContact CG-O 3.34Å; R190-R231 HydrophobicContact CG-CG 4.19Å
191	S	86.4	Confident	86.2	Confident	22 Å²	22	47.8 Å²	47.8	15%	0.154	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	135.5	168.9	63.6	0	0	0	0	112.3	R231 T232	S191-R231 VanDerWaalsContact O-CD 3.3Å; S191-R231 WeakPolarHBondContact O-CD 3.4Å; S191-R231 WeakPolarHBondContact OG-CG 3.47Å; S191-T232 PolarHBondContact N-O 3.44Å; S191-T232 PolarHBondContact OG-N 3.35Å; S191-T232 PolarHBondContact OG-O 3.45Å
192	N	76.5	Confident	86.1	Confident	36 Å²	36	48.2 Å²	48.2	19%	0.193	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-94.5	167.1	173.3	-64.1	-31.4	0	0	0	110.9	R190 D194 G195 T196 T198	R190-N192 PolarHBondContact NH2-OD1 3.37Å; N192-D194 VanDerWaalsContact C-N 3.25Å; N192-D194 WeakPolarHBondContact CB-OD1 3.27Å; N192-D194 PolarHBondContact O-N 2.96Å; N192-G195 PolarHBondContact O-N 3.2Å; N192-T196 WeakPolarHBondContact CB-O 3.32Å; N192-T196 PolarHBondContact N-O 3.07Å; N192-T196 PolarHBondContact ND2-OG1 3.03Å; N192-T198 PolarHBondContact ND2-OG1 3Å; N192-T198 PolarHBondContact OD1-OG1 3.2Å
193	E	73.1	Confident	86.2	Confident	169 Å²	169	48.6 Å²	48.6	79%	0.79	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.3	-178.5	-71.5	171.2	-164.3	0	0	113.2	G195 R231	E193-G195 PolarHBondContact O-N 3.42Å; E193-R231 IonicContact OE1-NH2 3.85Å; E193-R231 PolarHBondContact OE1-NH2 2.79Å
194	D	74.8	Confident	86.3	Confident	118 Å²	118	50.9 Å²	50.9	63%	0.631	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	3.6	174.1	66	-4.5	0	0	0	113.3	N192 T196	N192-D194 VanDerWaalsContact C-N 3.25Å; N192-D194 WeakPolarHBondContact CB-OD1 3.27Å; N192-D194 PolarHBondContact O-N 2.96Å; D194-T196 VanDerWaalsContact C-N 3.26Å; D194-T196 VanDerWaalsContact CG-OG1 3.28Å; D194-T196 PolarHBondContact O-N 3.45Å; D194-T196 WeakPolarHBondContact OD1-CB 3.24Å; D194-T196 WeakPolarHBondContact OD1-CG2 3.49Å; D194-T196 PolarHBondContact OD1-N 3.38Å; D194-T196 PolarHBondContact OD1-OG1 3.24Å; D194-T196 WeakPolarHBondContact OD2-CG2 3.11Å; D194-T196 PolarHBondContact OD2-OG1 2.65Å
195	G	75.6	Confident	86.2	Confident	55 Å²	55	53.1 Å²	53.1	57%	0.567	28%	0.282	S	S	*	.	S	Bend	trans	79.4	1.4	-178	0	0	0	0	0	114.7	N192 E193	N192-G195 PolarHBondContact O-N 3.2Å; E193-G195 PolarHBondContact O-N 3.42Å
196	T	80.4	Confident	86.2	Confident	65 Å²	65	54.6 Å²	54.6	40%	0.399	29%	0.291	S	S	.	.			trans	-77.5	172	172.3	68.3	0	0	0	0	111.2	N192 D194	N192-T196 WeakPolarHBondContact CB-O 3.32Å; N192-T196 PolarHBondContact N-O 3.07Å; N192-T196 PolarHBondContact ND2-OG1 3.03Å; D194-T196 VanDerWaalsContact C-N 3.26Å; D194-T196 VanDerWaalsContact CG-OG1 3.28Å; D194-T196 PolarHBondContact O-N 3.45Å; D194-T196 WeakPolarHBondContact OD1-CB 3.24Å; D194-T196 WeakPolarHBondContact OD1-CG2 3.49Å; D194-T196 PolarHBondContact OD1-N 3.38Å; D194-T196 PolarHBondContact OD1-OG1 3.24Å; D194-T196 WeakPolarHBondContact OD2-CG2 3.11Å; D194-T196 PolarHBondContact OD2-OG1 2.65Å
197	F	82.4	Confident	86	Confident	84 Å²	84	61.7 Å²	61.7	37%	0.368	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.7	179.7	-76.7	-86.7	0	0	0	110.8	Y189 R190 K234	Y189-F197 HydrophobicContact CD1-CB 4.11Å; Y189-F197 HydrophobicContact CG-CB 4.39Å; R190-F197 WeakPolarHBondContact O-CA 3.32Å; F197-K234 HydrophobicContact CD1-CB 4.14Å; F197-K234 HydrophobicContact CE1-CB 3.75Å; F197-K234 HydrophobicContact CE1-CD 4.49Å; F197-K234 HydrophobicContact CZ-CB 4.44Å
198	T	75.8	Confident	86.1	Confident	56 Å²	56	65.9 Å²	65.9	34%	0.344	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.4	175	-50.8	0	0	0	0	109.6	Y189 R190 N192 C200	Y189-T198 CarbonylContact C-O 3.53Å; Y189-T198 WeakPolarHBondContact CA-O 3.34Å; R190-T198 PolarHBondContact N-O 2.78Å; R190-T198 PolarHBondContact O-N 3.47Å; N192-T198 PolarHBondContact ND2-OG1 3Å; N192-T198 PolarHBondContact OD1-OG1 3.2Å; T198-C200 PolarHBondContact O-N 2.74Å
199	I	79.8	Confident	86.2	Confident	105 Å²	105	66.9 Å²	66.9	54%	0.538	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	130.8	174.7	-65.4	170.3	0	0	0	109.5	V187 Y189	V187-I199 HydrophobicContact CG1-CD1 4.43Å; V187-I199 HydrophobicContact CG1-CG1 4.19Å; V187-I199 HydrophobicContact CG1-CG2 4.06Å; Y189-I199 HydrophobicContact CD1-CB 4.46Å; Y189-I199 HydrophobicContact CD1-CG1 3.63Å; Y189-I199 HydrophobicContact CE1-CB 4.47Å; Y189-I199 HydrophobicContact CE1-CD1 4.03Å; Y189-I199 HydrophobicContact CE1-CG1 3.25Å
200	C	83.8	Confident	86.4	Confident	27 Å²	27	67 Å²	67	18%	0.182	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-38.3	174.6	-55	0	0	0	0	111.8	F188 R190 T198 I219 A223 L224	F188-C200 HydrophobicContact CB-CB 4.47Å; F188-C200 PolarHBondContact O-N 3.11Å; R190-C200 WeakPolarHBondContact CB-SG 3.49Å; R190-C200 PolarHBondContact N-SG 2.86Å; T198-C200 PolarHBondContact O-N 2.74Å; C200-I219 HydrophobicContact CB-CG2 4.27Å; C200-A223 PolarHBondContact SG-O 3.44Å; C200-L224 HydrophobicContact CB-CD2 4.43Å
201	H	90.5	Very high	86.8	Confident	50 Å²	50	68.5 Å²	68.5	23%	0.231	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	157.5	-175	-171.2	75.9	0	0	0	111.9	F188 F217 I219	F188-H201 HydrophobicContact CB-CB 4.48Å; F188-H201 HydrophobicContact CD2-CB 4.43Å; F188-H201 PolarHBondContact N-O 3.02Å; H201-F217 AromaticContact CD2-CD2 3.42Å; H201-F217 VanDerWaalsContact CD2-CD2 3.42Å; H201-F217 WeakPolarHBondContact CD2-CD2 3.17Å; H201-F217 AromaticContact CD2-CE2 3.69Å; H201-F217 AromaticContact CD2-CG 3.71Å; H201-F217 AromaticContact CE1-CD2 3.99Å; H201-F217 AromaticContact CE1-CG 3.99Å; H201-F217 AromaticContact CG-CD2 3.92Å; H201-F217 WeakPolarHBondContact NE2-CB 3.1Å; H201-F217 AromaticContact NE2-CD1 3.92Å; H201-F217 AromaticContact NE2-CD2 3.51Å; H201-F217 AromaticContact NE2-CG 3.34Å; H201-F217 VanDerWaalsContact NE2-CG 3.34Å; H201-F217 WeakPolarHBondContact NE2-CG 3.38Å; H201-I219 HydrophobicContact CB-CD1 3.38Å; H201-I219 HydrophobicContact CB-CG1 3.81Å
202	K	91.2	Very high	87.3	Confident	106 Å²	106	67.5 Å²	67.5	46%	0.461	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.3	172.2	177.2	177	178	175.8	0	109.1	F185 M186 V187	F185-K202 HydrophobicContact CD2-CD 4.32Å; F185-K202 VanDerWaalsContact CD2-CE 3.45Å; F185-K202 HydrophobicContact CD2-CG 4.13Å; F185-K202 HydrophobicContact CE2-CD 4.28Å; M186-K202 WeakPolarHBondContact O-CA 3.45Å; V187-K202 HydrophobicContact CG2-CD 4.46Å; V187-K202 HydrophobicContact CG2-CG 4.21Å
203	T	94.4	Very high	88.3	Confident	8 Å²	8	69.7 Å²	69.7	5%	0.049	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-75.7	169.9	178.5	68.7	0	0	0	0	111.7	M186 F188 W214 F217	M186-T203 HydrophobicContact CB-CG2 3.94Å; M186-T203 PolarHBondContact N-OG1 3.22Å; M186-T203 PolarHBondContact O-N 2.88Å; F188-T203 HydrophobicContact CE2-CG2 4.11Å; T203-W214 HydrophobicContact CG2-CG 4.33Å; T203-W214 PolarHBondContact OG1-NE1 3.43Å; T203-F217 HydrophobicContact CG2-CD1 4.19Å; T203-F217 HydrophobicContact CG2-CE1 3.83Å; T203-F217 HydrophobicContact CG2-CZ 4.5Å
204	E	94.1	Very high	89.4	Confident	73 Å²	73	61.6 Å²	61.6	34%	0.341	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-65.3	163.1	164.9	81	-69.2	174	0	0	112.5	F185 W214 E215	F185-E204 WeakPolarHBondContact CB-O 3.43Å; E204-W214 PolarHBondContact O-NE1 3.32Å; E204-W214 WeakPolarHBondContact OE1-CA 3.22Å; E204-W214 WeakPolarHBondContact OE1-CB 3.48Å; E204-E215 PolarHBondContact OE1-N 3.4Å
205	V	93.8	Very high	90.4	Very high	46 Å²	46	62.2 Å²	62.2	28%	0.279	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-92.6	121.2	176.3	176.8	0	0	0	0	109	D183 F185 W240	D183-V205 HydrophobicContact CB-CG1 3.85Å; F185-V205 HydrophobicContact CB-CG2 4.06Å; F185-V205 HydrophobicContact CD1-CG2 4.04Å; F185-V205 HydrophobicContact CG-CG2 4.25Å; V205-W240 HydrophobicContact CB-CB 4.47Å; V205-W240 HydrophobicContact CG1-CB 3.61Å; V205-W240 HydrophobicContact CG1-CG 4.02Å; V205-W240 HydrophobicContact CG2-CB 3.95Å; V205-W240 HydrophobicContact CG2-CG 3.9Å
206	V	95.1	Very high	91.3	Very high	36 Å²	36	62.9 Å²	62.9	22%	0.218	33%	0.328	C	S	.	.			trans	-100	113.4	176.4	-173.1	0	0	0	0	109.1	D183 P184 T209 P212 W214	D183-V206 CarbonylContact C-O 3.52Å; D183-V206 WeakPolarHBondContact CA-O 3.34Å; P184-V206 WeakPolarHBondContact CD-O 3.36Å; P184-V206 PolarHBondContact O-N 2.92Å; P184-V206 VanDerWaalsContact O-N 3.15Å; V206-T209 HydrophobicContact CB-CG2 4.12Å; V206-T209 HydrophobicContact CG1-CG2 3.59Å; V206-P212 HydrophobicContact CB-CB 3.94Å; V206-P212 HydrophobicContact CG1-CB 4.26Å; V206-P212 HydrophobicContact CG2-CB 4.06Å; V206-W214 HydrophobicContact CG2-CG 4.45Å
207	K	93.1	Very high	91.9	Very high	149 Å²	149	60.7 Å²	60.7	65%	0.648	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	144	-170	-63.6	-175.4	178.6	179.9	0	114.2	D183 T209	D183-K207 WeakPolarHBondContact OD1-CA 3.44Å; D183-K207 WeakPolarHBondContact OD1-CB 3.42Å; K207-T209 PolarHBondContact O-N 3.4Å
208	N	93.4	Very high	92.2	Very high	96 Å²	96	59.7 Å²	59.7	51%	0.513	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	49.5	167.2	-170.1	23.7	0	0	0	113.3	K181 S182 D183	K181-N208 WeakPolarHBondContact CB-OD1 3.19Å; K181-N208 PolarHBondContact N-OD1 2.95Å; S182-N208 CarbonylContact O-C 3.56Å; S182-N208 WeakPolarHBondContact O-CA 3.47Å; S182-N208 PolarHBondContact O-N 3.14Å; D183-N208 PolarHBondContact OD1-N 2.56Å
209	T	95.8	Very high	92.7	Very high	26 Å²	26	57.1 Å²	57.1	16%	0.16	30%	0.3	C	S	.	.			trans	-144.7	148.1	179.1	-170.4	0	0	0	0	112.9	S182 P184 V206 K207 N211 P212	S182-T209 PolarHBondContact O-N 3Å; P184-T209 VanDerWaalsContact CD-O 3.27Å; P184-T209 WeakPolarHBondContact CD-O 3.46Å; P184-T209 HydrophobicContact CG-CG2 4.09Å; V206-T209 HydrophobicContact CB-CG2 4.12Å; V206-T209 HydrophobicContact CG1-CG2 3.59Å; K207-T209 PolarHBondContact O-N 3.4Å; T209-N211 PolarHBondContact OG1-N 2.88Å; T209-N211 PolarHBondContact OG1-O 3.43Å; T209-P212 HydrophobicContact CG2-CB 3.95Å
210	L	95.6	Very high	92.9	Very high	37 Å²	37	54.3 Å²	54.3	19%	0.194	29%	0.289	C	S	.	.	S	Bend	trans	-104.1	-0.1	168.8	-54.2	-179.2	0	0	0	111.6	K172 L173 K175 K181 P212	K172-L210 PolarHBondContact N-O 3.06Å; K172-L210 VanDerWaalsContact N-O 3.16Å; L173-L210 HydrophobicContact CB-CB 4.45Å; L173-L210 PolarHBondContact N-O 3.13Å; L173-L210 WeakPolarHBondContact O-CD2 3.31Å; K175-L210 HydrophobicContact CB-CD1 4.36Å; K175-L210 HydrophobicContact CB-CD2 4.09Å; K181-L210 HydrophobicContact CB-CD2 3.98Å; K181-L210 HydrophobicContact CB-CG 4.11Å; K181-L210 HydrophobicContact CD-CG 4.19Å; K181-L210 HydrophobicContact CG-CD2 4.48Å; K181-L210 HydrophobicContact CG-CG 4.14Å; L210-P212 VanDerWaalsContact C-CD 3.46Å
211	N	97.2	Very high	93.1	Very high	75 Å²	75	53.1 Å²	53.1	40%	0.401	28%	0.281	S	S	.	.	S	Bend	trans	-132.4	61.7	-178.8	-41.6	-67.2	0	0	0	109.6	A170 N171 K172 T209	A170-N211 CarbonylContact O-C 3.49Å; A170-N211 WeakPolarHBondContact O-CA 3.38Å; N171-N211 WeakPolarHBondContact CA-OD1 3.13Å; N171-N211 PolarHBondContact OD1-OD1 3.39Å; K172-N211 PolarHBondContact N-OD1 3.34Å; T209-N211 PolarHBondContact OG1-N 2.88Å; T209-N211 PolarHBondContact OG1-O 3.43Å
212	P	97.1	Very high	92.7	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.006	29%	0.291	C	S	.	.			trans	-64.8	144.8	179.4	30	-37.7	0	0	0	111	C169 A170 L173 P184 V206 T209 L210 W214	C169-P212 CarbonylContact C-O 3.49Å; C169-P212 VanDerWaalsContact CA-O 3.22Å; C169-P212 WeakPolarHBondContact CA-O 3.01Å; C169-P212 WeakPolarHBondContact CB-O 3.37Å; A170-P212 HydrophobicContact CB-CG 3.81Å; A170-P212 PolarHBondContact N-O 3.09Å; L173-P212 HydrophobicContact CD1-CG 3.85Å; P184-P212 HydrophobicContact CB-CG 4.09Å; P184-P212 HydrophobicContact CG-CB 3.78Å; P184-P212 HydrophobicContact CG-CG 3.53Å; V206-P212 HydrophobicContact CB-CB 3.94Å; V206-P212 HydrophobicContact CG1-CB 4.26Å; V206-P212 HydrophobicContact CG2-CB 4.06Å; T209-P212 HydrophobicContact CG2-CB 3.95Å; L210-P212 VanDerWaalsContact C-CD 3.46Å; P212-W214 HydrophobicContact CB-CD2 4.27Å; P212-W214 HydrophobicContact CB-CH2 4.26Å; P212-W214 HydrophobicContact CB-CZ2 3.86Å; P212-W214 HydrophobicContact CG-CD2 4.45Å; P212-W214 HydrophobicContact CG-CE3 4.46Å; P212-W214 HydrophobicContact CG-CH2 3.42Å; P212-W214 VanDerWaalsContact CG-CH2 3.42Å; P212-W214 HydrophobicContact CG-CZ2 3.36Å; P212-W214 HydrophobicContact CG-CZ3 3.99Å
213	V	97.1	Very high	92.3	Very high	81 Å²	81	52.7 Å²	52.7	49%	0.491	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-114.6	118	159.1	-178.9	0	0	0	0	104.3	C169 L292	C169-V213 HydrophobicContact CB-CB 4.36Å; C169-V213 HydrophobicContact CB-CG1 4.46Å; C169-V213 HydrophobicContact CB-CG2 3.9Å; V213-L292 HydrophobicContact CG1-CD1 4.1Å
214	W	97.2	Very high	91.8	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-86.7	152.8	178.1	-63.6	-80	0	0	0	110.3	Q167 F168 A170 P184 M186 T203 E204 V206 P212	Q167-W214 VanDerWaalsContact CG-O 3.31Å; Q167-W214 WeakPolarHBondContact CG-O 3.43Å; Q167-W214 PolarHBondContact NE2-O 3.38Å; Q167-W214 VanDerWaalsContact NE2-O 3.1Å; F168-W214 HydrophobicContact CB-CE3 3.9Å; F168-W214 HydrophobicContact CB-CZ3 4.28Å; F168-W214 PolarHBondContact O-N 2.9Å; A170-W214 HydrophobicContact CB-CH2 3.67Å; A170-W214 HydrophobicContact CB-CZ3 3.82Å; P184-W214 HydrophobicContact CB-CZ2 4.21Å; P184-W214 PolarHBondContact O-NE1 3.45Å; M186-W214 HydrophobicContact CG-CE3 4.49Å; M186-W214 HydrophobicContact CG-CH2 3.62Å; M186-W214 HydrophobicContact CG-CZ2 3.68Å; M186-W214 HydrophobicContact CG-CZ3 4.07Å; M186-W214 HydrophobicContact SD-CD2 4.37Å; M186-W214 HydrophobicContact SD-CE3 3.81Å; M186-W214 HydrophobicContact SD-CH2 3.51Å; M186-W214 VanDerWaalsContact SD-CH2 3.51Å; M186-W214 HydrophobicContact SD-CZ2 4.12Å; M186-W214 HydrophobicContact SD-CZ3 3.35Å; M186-W214 WeakPolarHBondContact SD-CZ3 3.44Å; T203-W214 HydrophobicContact CG2-CG 4.33Å; T203-W214 PolarHBondContact OG1-NE1 3.43Å; E204-W214 PolarHBondContact O-NE1 3.32Å; E204-W214 WeakPolarHBondContact OE1-CA 3.22Å; E204-W214 WeakPolarHBondContact OE1-CB 3.48Å; V206-W214 HydrophobicContact CG2-CG 4.45Å; P212-W214 HydrophobicContact CB-CD2 4.27Å; P212-W214 HydrophobicContact CB-CH2 4.26Å; P212-W214 HydrophobicContact CB-CZ2 3.86Å; P212-W214 HydrophobicContact CG-CD2 4.45Å; P212-W214 HydrophobicContact CG-CE3 4.46Å; P212-W214 HydrophobicContact CG-CH2 3.42Å; P212-W214 VanDerWaalsContact CG-CH2 3.42Å; P212-W214 HydrophobicContact CG-CZ2 3.36Å; P212-W214 HydrophobicContact CG-CZ3 3.99Å
215	E	95.9	Very high	91.4	Very high	131 Å²	131	49 Å²	49	61%	0.612	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-62.1	147.7	173.1	-68.1	-60	145.8	0	0	110.6	E204 F217	E204-E215 PolarHBondContact OE1-N 3.4Å; E215-F217 PolarHBondContact O-N 2.84Å
216	P	94.1	Very high	90.6	Very high	69 Å²	69	49.8 Å²	49.8	45%	0.448	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-58.6	138.9	173	-21.1	32.2	0	0	0	111.5	M166 Q167	M166-P216 WeakPolarHBondContact O-CA 3.39Å; Q167-P216 HydrophobicContact CB-CB 4.36Å; Q167-P216 HydrophobicContact CB-CG 4.29Å; Q167-P216 HydrophobicContact CG-CG 4.11Å
217	F	92.6	Very high	89.6	Confident	18 Å²	18	50.8 Å²	50.8	8%	0.079	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	157.7	177.5	62.3	-94.6	0	0	0	111.6	T165 M166 F168 F188 H201 T203 E215 I219	T165-F217 CarbonylContact C-O 3.51Å; T165-F217 WeakPolarHBondContact CA-O 3.04Å; M166-F217 HydrophobicContact CG-CD2 3.96Å; M166-F217 HydrophobicContact CG-CE1 4.17Å; M166-F217 HydrophobicContact CG-CE2 3.29Å; M166-F217 HydrophobicContact CG-CZ 3.44Å; M166-F217 VanDerWaalsContact CG-CZ 3.44Å; M166-F217 PolarHBondContact N-O 3.3Å; M166-F217 PolarHBondContact O-N 2.92Å; M166-F217 HydrophobicContact SD-CE2 3.62Å; M166-F217 HydrophobicContact SD-CZ 3.86Å; F168-F217 AromaticContact CD2-CE1 3.94Å; F168-F217 HydrophobicContact CD2-CE1 3.94Å; F168-F217 AromaticContact CD2-CZ 3.85Å; F168-F217 HydrophobicContact CD2-CZ 3.85Å; F168-F217 HydrophobicContact CE2-CE1 4.42Å; F168-F217 AromaticContact CE2-CZ 3.86Å; F168-F217 HydrophobicContact CE2-CZ 3.86Å; F188-F217 HydrophobicContact CD2-CE2 4.46Å; F188-F217 HydrophobicContact CD2-CZ 4.14Å; F188-F217 HydrophobicContact CE2-CE1 4.1Å; F188-F217 HydrophobicContact CE2-CE2 4.15Å; F188-F217 AromaticContact CE2-CZ 3.41Å; F188-F217 HydrophobicContact CE2-CZ 3.41Å; F188-F217 VanDerWaalsContact CE2-CZ 3.41Å; F188-F217 HydrophobicContact CZ-CE1 4.45Å; F188-F217 AromaticContact CZ-CZ 3.68Å; F188-F217 HydrophobicContact CZ-CZ 3.68Å; H201-F217 AromaticContact CD2-CD2 3.42Å; H201-F217 VanDerWaalsContact CD2-CD2 3.42Å; H201-F217 WeakPolarHBondContact CD2-CD2 3.17Å; H201-F217 AromaticContact CD2-CE2 3.69Å; H201-F217 AromaticContact CD2-CG 3.71Å; H201-F217 AromaticContact CE1-CD2 3.99Å; H201-F217 AromaticContact CE1-CG 3.99Å; H201-F217 AromaticContact CG-CD2 3.92Å; H201-F217 WeakPolarHBondContact NE2-CB 3.1Å; H201-F217 AromaticContact NE2-CD1 3.92Å; H201-F217 AromaticContact NE2-CD2 3.51Å; H201-F217 AromaticContact NE2-CG 3.34Å; H201-F217 VanDerWaalsContact NE2-CG 3.34Å; H201-F217 WeakPolarHBondContact NE2-CG 3.38Å; T203-F217 HydrophobicContact CG2-CD1 4.19Å; T203-F217 HydrophobicContact CG2-CE1 3.83Å; T203-F217 HydrophobicContact CG2-CZ 4.5Å; E215-F217 PolarHBondContact O-N 2.84Å; F217-I219 HydrophobicContact CD2-CD1 4.02Å; F217-I219 HydrophobicContact CD2-CG1 3.88Å; F217-I219 HydrophobicContact CE2-CD1 3.57Å; F217-I219 HydrophobicContact CE2-CG1 3.95Å
218	S	88.8	Confident	89.1	Confident	63 Å²	63	47.1 Å²	47.1	44%	0.441	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	137.1	-178.7	-54	0	0	0	0	111.2	A164 T165	A164-S218 WeakPolarHBondContact O-CA 3.41Å; T165-S218 PolarHBondContact OG1-OG 3.36Å
219	I	86.9	Confident	88.8	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135	175.6	-53	176.3	0	0	0	108.8	Y163 A164 M166 C200 H201 F217 V221 A223 L224	Y163-I219 WeakPolarHBondContact CA-O 3.5Å; A164-I219 PolarHBondContact N-O 2.98Å; A164-I219 PolarHBondContact O-N 3.13Å; M166-I219 HydrophobicContact CE-CD1 4.39Å; C200-I219 HydrophobicContact CB-CG2 4.27Å; H201-I219 HydrophobicContact CB-CD1 3.38Å; H201-I219 HydrophobicContact CB-CG1 3.81Å; F217-I219 HydrophobicContact CD2-CD1 4.02Å; F217-I219 HydrophobicContact CD2-CG1 3.88Å; F217-I219 HydrophobicContact CE2-CD1 3.57Å; F217-I219 HydrophobicContact CE2-CG1 3.95Å; I219-V221 PolarHBondContact O-N 3.26Å; I219-A223 HydrophobicContact CG2-CB 3.98Å; I219-L224 HydrophobicContact CB-CD1 4.24Å; I219-L224 HydrophobicContact CB-CD2 4.2Å; I219-L224 HydrophobicContact CB-CG 4.08Å; I219-L224 HydrophobicContact CD1-CD2 3.8Å; I219-L224 HydrophobicContact CG2-CD1 4.37Å; I219-L224 HydrophobicContact CG2-CD2 3.8Å; I219-L224 HydrophobicContact CG2-CG 3.68Å
220	P	84.3	Confident	88.6	Confident	47 Å²	47	51 Å²	51	31%	0.305	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	131.6	170.2	-18.6	26	0	0	0	110.8	Y163 R222 A223 L224	Y163-P220 HydrophobicContact CD1-CB 4.4Å; Y163-P220 HydrophobicContact CD1-CG 4.08Å; Y163-P220 HydrophobicContact CE1-CB 4.11Å; Y163-P220 HydrophobicContact CE1-CG 3.49Å; Y163-P220 VanDerWaalsContact CE1-CG 3.49Å; P220-R222 PolarHBondContact O-N 2.73Å; P220-A223 HydrophobicContact CB-CB 4.04Å; P220-A223 HydrophobicContact CG-CB 4.22Å; P220-A223 WeakPolarHBondContact O-CA 3.34Å; P220-A223 VanDerWaalsContact O-CB 3.3Å; P220-A223 WeakPolarHBondContact O-CB 3.42Å; P220-A223 PolarHBondContact O-N 3.4Å; P220-L224 PolarHBondContact O-N 3.07Å; P220-L224 VanDerWaalsContact O-N 3.16Å
221	V	86.4	Confident	88.4	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-37.1	179.7	169.8	0	0	0	0	110.7	D162 A164 I219 A223 L224 C225 Y229 Y256 V296	D162-V221 HydrophobicContact CB-CB 4.04Å; D162-V221 HydrophobicContact CB-CG2 3.6Å; D162-V221 WeakPolarHBondContact O-CB 3.37Å; D162-V221 VanDerWaalsContact O-CG2 3.3Å; D162-V221 WeakPolarHBondContact O-CG2 3.41Å; D162-V221 PolarHBondContact O-N 3.05Å; A164-V221 HydrophobicContact CB-CG2 4.23Å; I219-V221 PolarHBondContact O-N 3.26Å; V221-A223 VanDerWaalsContact C-N 3.31Å; V221-A223 PolarHBondContact O-N 3.38Å; V221-L224 WeakPolarHBondContact O-CB 3.39Å; V221-L224 PolarHBondContact O-N 3.14Å; V221-L224 VanDerWaalsContact O-N 3.08Å; V221-C225 PolarHBondContact O-N 3.47Å; V221-C225 PolarHBondContact O-SG 3.16Å; V221-Y229 HydrophobicContact CG1-CE1 4.12Å; V221-Y256 HydrophobicContact CB-CE2 4.37Å; V221-Y256 HydrophobicContact CG1-CD2 4.1Å; V221-Y256 HydrophobicContact CG1-CE2 3.79Å; V221-Y256 HydrophobicContact CG2-CD2 4.4Å; V221-Y256 HydrophobicContact CG2-CE2 3.65Å; V221-V296 HydrophobicContact CG2-CG1 4.33Å
222	R	83.4	Confident	88.2	Confident	119 Å²	119	49.8 Å²	49.8	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-60	-37.9	172.1	-169.4	-177.5	-176.8	-167.2	5.2	113.2	N159 R190 P220 L224 N226	N159-R222 PolarHBondContact ND2-NH1 2.85Å; R190-R222 PolarHBondContact NH1-O 3.14Å; P220-R222 PolarHBondContact O-N 2.73Å; R222-L224 VanDerWaalsContact C-N 3.27Å; R222-L224 PolarHBondContact O-N 3.02Å; R222-N226 WeakPolarHBondContact CG-OD1 3.35Å; R222-N226 PolarHBondContact NE-OD1 3.37Å; R222-N226 WeakPolarHBondContact O-CA 3.32Å; R222-N226 PolarHBondContact O-N 3.15Å
223	A	81.6	Confident	88.1	Confident	29 Å²	29	49.8 Å²	49.8	24%	0.24	27%	0.274	C	S	.	.	H	α-helix	trans	-67.1	-32.4	176.5	0	0	0	0	0	111.4	R190 C200 I219 P220 V221	R190-A223 WeakPolarHBondContact CD-O 3.35Å; R190-A223 PolarHBondContact NH1-O 3.09Å; C200-A223 PolarHBondContact SG-O 3.44Å; I219-A223 HydrophobicContact CG2-CB 3.98Å; P220-A223 HydrophobicContact CB-CB 4.04Å; P220-A223 HydrophobicContact CG-CB 4.22Å; P220-A223 WeakPolarHBondContact O-CA 3.34Å; P220-A223 VanDerWaalsContact O-CB 3.3Å; P220-A223 WeakPolarHBondContact O-CB 3.42Å; P220-A223 PolarHBondContact O-N 3.4Å; V221-A223 VanDerWaalsContact C-N 3.31Å; V221-A223 PolarHBondContact O-N 3.38Å
224	L	85.6	Confident	88.1	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-74.5	-43.4	176.2	-68.8	174.6	0	0	0	113.5	A164 M166 R190 C200 I219 P220 V221 R222 I233	A164-L224 HydrophobicContact CB-CD1 3.81Å; M166-L224 HydrophobicContact CE-CD1 3.79Å; R190-L224 WeakPolarHBondContact CG-O 3.34Å; C200-L224 HydrophobicContact CB-CD2 4.43Å; I219-L224 HydrophobicContact CB-CD1 4.24Å; I219-L224 HydrophobicContact CB-CD2 4.2Å; I219-L224 HydrophobicContact CB-CG 4.08Å; I219-L224 HydrophobicContact CD1-CD2 3.8Å; I219-L224 HydrophobicContact CG2-CD1 4.37Å; I219-L224 HydrophobicContact CG2-CD2 3.8Å; I219-L224 HydrophobicContact CG2-CG 3.68Å; P220-L224 PolarHBondContact O-N 3.07Å; P220-L224 VanDerWaalsContact O-N 3.16Å; V221-L224 WeakPolarHBondContact O-CB 3.39Å; V221-L224 PolarHBondContact O-N 3.14Å; V221-L224 VanDerWaalsContact O-N 3.08Å; R222-L224 VanDerWaalsContact C-N 3.27Å; R222-L224 PolarHBondContact O-N 3.02Å; L224-I233 HydrophobicContact CB-CD1 4.07Å; L224-I233 HydrophobicContact CD2-CD1 4.15Å
225	C	85.1	Confident	88	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.007	26%	0.258	C	S	.	.	H	α-helix	trans	-135.3	-14.3	-163.4	81.1	0	0	0	0	114.5	V221 G227 D228 Y229 R231	V221-C225 PolarHBondContact O-N 3.47Å; V221-C225 PolarHBondContact O-SG 3.16Å; C225-G227 PolarHBondContact O-N 2.71Å; C225-G227 VanDerWaalsContact O-N 3.17Å; C225-D228 VanDerWaalsContact CB-O 3.27Å; C225-D228 WeakPolarHBondContact CB-O 3.35Å; C225-D228 PolarHBondContact O-N 2.98Å; C225-Y229 HydrophobicContact CB-CD1 4.48Å; C225-Y229 VanDerWaalsContact SG-CD1 3.51Å; C225-R231 WeakPolarHBondContact O-CD 3.49Å; C225-R231 PolarHBondContact O-NE 2.88Å
226	N	76.9	Confident	88.1	Confident	63 Å²	63	42.1 Å²	42.1	34%	0.337	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	41.7	-178.1	-163.5	46.8	0	0	0	114	R222 D228	R222-N226 WeakPolarHBondContact CG-OD1 3.35Å; R222-N226 PolarHBondContact NE-OD1 3.37Å; R222-N226 WeakPolarHBondContact O-CA 3.32Å; R222-N226 PolarHBondContact O-N 3.15Å; N226-D228 VanDerWaalsContact C-N 3.34Å; N226-D228 PolarHBondContact O-N 2.86Å
227	G	74.2	Confident	88.2	Confident	58 Å²	58	38.8 Å²	38.8	60%	0.598	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.2	-13.1	-179.7	0	0	0	0	0	115.4	C225	C225-G227 PolarHBondContact O-N 2.71Å; C225-G227 VanDerWaalsContact O-N 3.17Å
228	D	81.7	Confident	88.3	Confident	71 Å²	71	40.2 Å²	40.2	38%	0.38	22%	0.216	S	C	.	.			trans	-100.9	97.9	174.5	173.7	9.5	0	0	0	110.2	C225 N226 E230 R231	C225-D228 VanDerWaalsContact CB-O 3.27Å; C225-D228 WeakPolarHBondContact CB-O 3.35Å; C225-D228 PolarHBondContact O-N 2.98Å; N226-D228 VanDerWaalsContact C-N 3.34Å; N226-D228 PolarHBondContact O-N 2.86Å; D228-E230 PolarHBondContact O-N 2.78Å; D228-E230 VanDerWaalsContact O-N 3.15Å; D228-E230 PolarHBondContact OD1-N 2.86Å; D228-E230 VanDerWaalsContact OD1-N 3.11Å; D228-R231 HydrophobicContact CB-CB 4.07Å; D228-R231 WeakPolarHBondContact O-CB 3.49Å; D228-R231 PolarHBondContact O-N 3.33Å; D228-R231 PolarHBondContact OD1-N 3.45Å; D228-R231 IonicContact OD2-NE 2.94Å
229	Y	88.5	Confident	88.5	Confident	105 Å²	105	37.2 Å²	37.2	41%	0.412	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-12.5	-175.4	-63	-25.4	0	0	0	115.1	V221 C225 Y256 K257	V221-Y229 HydrophobicContact CG1-CE1 4.12Å; C225-Y229 HydrophobicContact CB-CD1 4.48Å; C225-Y229 VanDerWaalsContact SG-CD1 3.51Å; Y229-Y256 AromaticContact CD1-CD1 3.44Å; Y229-Y256 HydrophobicContact CD1-CD1 3.44Å; Y229-Y256 VanDerWaalsContact CD1-CD1 3.44Å; Y229-Y256 AromaticContact CD1-CE1 3.79Å; Y229-Y256 HydrophobicContact CD1-CE1 3.79Å; Y229-Y256 HydrophobicContact CD1-CG 4.16Å; Y229-Y256 HydrophobicContact CD2-CD1 4.36Å; Y229-Y256 HydrophobicContact CD2-CE1 4.37Å; Y229-Y256 HydrophobicContact CE1-CD1 4.07Å; Y229-Y256 AromaticContact CE1-CE1 3.97Å; Y229-Y256 HydrophobicContact CE1-CE1 3.97Å; Y229-Y256 AromaticContact CG-CD1 3.63Å; Y229-Y256 HydrophobicContact CG-CD1 3.63Å; Y229-Y256 HydrophobicContact CG-CE1 4.03Å; Y229-Y256 PolarHBondContact O-N 3.21Å; Y229-K257 WeakPolarHBondContact O-CB 3.3Å; Y229-K257 PolarHBondContact O-N 2.85Å
230	E	91	Very high	88.7	Confident	98 Å²	98	41 Å²	41	46%	0.458	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-4.7	173.7	-62	-74.5	-167.9	0	0	112.3	D228 T232 K257	D228-E230 PolarHBondContact O-N 2.78Å; D228-E230 VanDerWaalsContact O-N 3.15Å; D228-E230 PolarHBondContact OD1-N 2.86Å; D228-E230 VanDerWaalsContact OD1-N 3.11Å; E230-T232 PolarHBondContact O-N 3.36Å; E230-K257 HydrophobicContact CG-CD 4.39Å; E230-K257 WeakPolarHBondContact OE1-CD 3.28Å; E230-K257 WeakPolarHBondContact OE1-CE 3.43Å; E230-K257 IonicContact OE1-NZ 2.8Å; E230-K257 PolarHBondContact OE1-NZ 2.86Å
231	R	90.3	Very high	88.7	Confident	28 Å²	28	40.2 Å²	40.2	11%	0.106	20%	0.203	C	C	.	.			trans	-56.1	135.3	-179.1	-171.4	167.1	-72.8	-146.3	3.8	110.9	R190 S191 E193 C225 D228 I233	R190-R231 HydrophobicContact CG-CG 4.19Å; S191-R231 VanDerWaalsContact O-CD 3.3Å; S191-R231 WeakPolarHBondContact O-CD 3.4Å; S191-R231 WeakPolarHBondContact OG-CG 3.47Å; E193-R231 IonicContact OE1-NH2 3.85Å; E193-R231 PolarHBondContact OE1-NH2 2.79Å; C225-R231 WeakPolarHBondContact O-CD 3.49Å; C225-R231 PolarHBondContact O-NE 2.88Å; D228-R231 HydrophobicContact CB-CB 4.07Å; D228-R231 WeakPolarHBondContact O-CB 3.49Å; D228-R231 PolarHBondContact O-N 3.33Å; D228-R231 PolarHBondContact OD1-N 3.45Å; D228-R231 IonicContact OD2-NE 2.94Å; R231-I233 PolarHBondContact O-N 3.27Å
232	T	94.4	Very high	88.2	Confident	60 Å²	60	51.2 Å²	51.2	37%	0.368	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	125.2	-176	-58.2	0	0	0	0	110.9	S191 E230 T253	S191-T232 PolarHBondContact N-O 3.44Å; S191-T232 PolarHBondContact OG-N 3.35Å; S191-T232 PolarHBondContact OG-O 3.45Å; E230-T232 PolarHBondContact O-N 3.36Å; T232-T253 HydrophobicContact CG2-CG2 4Å
233	I	95.2	Very high	87.9	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	120	168.7	-59.7	164.2	0	0	0	106.8	F188 Y189 L224 R231 T253 T254 L259	F188-I233 HydrophobicContact CD1-CG2 4.36Å; Y189-I233 CarbonylContact O-C 3.54Å; Y189-I233 VanDerWaalsContact O-CA 3.25Å; Y189-I233 WeakPolarHBondContact O-CA 3.5Å; L224-I233 HydrophobicContact CB-CD1 4.07Å; L224-I233 HydrophobicContact CD2-CD1 4.15Å; R231-I233 PolarHBondContact O-N 3.27Å; I233-T253 CarbonylContact O-C 3.47Å; I233-T253 VanDerWaalsContact O-CA 3.29Å; I233-T253 WeakPolarHBondContact O-CA 3.35Å; I233-T254 HydrophobicContact CB-CG2 4.17Å; I233-T254 HydrophobicContact CG2-CG2 4.47Å; I233-T254 PolarHBondContact N-O 3.43Å; I233-T254 PolarHBondContact O-N 3.03Å; I233-L259 HydrophobicContact CD1-CD1 3.9Å
234	K	95.7	Very high	87.3	Confident	33 Å²	33	52.5 Å²	52.5	14%	0.143	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132.8	174.4	-178.7	177	58.5	152.3	0	109.1	F188 Y189 F197 E236 T253	F188-K234 CarbonylContact C-O 3.59Å; Y189-K234 PolarHBondContact N-O 3.01Å; Y189-K234 PolarHBondContact O-N 2.85Å; F197-K234 HydrophobicContact CD1-CB 4.14Å; F197-K234 HydrophobicContact CE1-CB 3.75Å; F197-K234 HydrophobicContact CE1-CD 4.49Å; F197-K234 HydrophobicContact CZ-CB 4.44Å; K234-E236 HydrophobicContact CD-CG 4.38Å; K234-E236 WeakPolarHBondContact CE-OE1 3.24Å; K234-E236 HydrophobicContact CG-CG 4.35Å; K234-E236 IonicContact NZ-OE1 3.54Å; K234-E236 PolarHBondContact NZ-OE1 3.12Å; K234-T253 HydrophobicContact CB-CG2 4.37Å; K234-T253 HydrophobicContact CG-CG2 4.41Å
235	A	96.2	Very high	87	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.008	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.7	174	0	0	0	0	0	109.5	M186 V187 F188 E251 F252	M186-A235 HydrophobicContact CE-CB 3.83Å; V187-A235 WeakPolarHBondContact O-CA 3.29Å; F188-A235 HydrophobicContact CD1-CB 3.91Å; F188-A235 HydrophobicContact CE1-CB 3.89Å; A235-E251 CarbonylContact O-C 3.59Å; A235-E251 VanDerWaalsContact O-CA 3.23Å; A235-E251 WeakPolarHBondContact O-CA 3.39Å; A235-F252 HydrophobicContact CB-CD1 4Å; A235-F252 HydrophobicContact CB-CD2 4.23Å; A235-F252 HydrophobicContact CB-CE1 3.5Å; A235-F252 VanDerWaalsContact CB-CE1 3.5Å; A235-F252 HydrophobicContact CB-CE2 3.76Å; A235-F252 HydrophobicContact CB-CG 4.35Å; A235-F252 HydrophobicContact CB-CZ 3.37Å; A235-F252 PolarHBondContact N-O 3.37Å; A235-F252 PolarHBondContact O-N 2.86Å
236	E	96.9	Very high	86.9	Confident	16 Å²	16	58.4 Å²	58.4	8%	0.075	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.6	178.9	-64.9	-178.1	174.5	0	0	109.8	M186 V187 Y189 K234 Y238 F248 E251	M186-E236 CarbonylContact C-O 3.57Å; M186-E236 VanDerWaalsContact CA-O 3.29Å; M186-E236 WeakPolarHBondContact CA-O 3.34Å; V187-E236 PolarHBondContact N-O 3.41Å; V187-E236 PolarHBondContact O-N 2.91Å; Y189-E236 HydrophobicContact CD2-CG 4.36Å; Y189-E236 HydrophobicContact CE2-CB 4.17Å; Y189-E236 HydrophobicContact CE2-CG 3.9Å; Y189-E236 PolarHBondContact OH-OE2 3.17Å; K234-E236 HydrophobicContact CD-CG 4.38Å; K234-E236 WeakPolarHBondContact CE-OE1 3.24Å; K234-E236 HydrophobicContact CG-CG 4.35Å; K234-E236 IonicContact NZ-OE1 3.54Å; K234-E236 PolarHBondContact NZ-OE1 3.12Å; E236-Y238 HydrophobicContact CB-CD2 4.18Å; E236-Y238 HydrophobicContact CB-CE2 3.47Å; E236-Y238 VanDerWaalsContact CB-CE2 3.47Å; E236-Y238 HydrophobicContact CG-CE2 4.49Å; E236-Y238 WeakPolarHBondContact OE2-CE2 3.27Å; E236-Y238 PolarHBondContact OE2-OH 3.21Å; E236-F248 HydrophobicContact CB-CE2 4.09Å; E236-F248 HydrophobicContact CG-CE2 4.13Å; E236-E251 HydrophobicContact CG-CB 4.1Å
237	V	97.4	Very high	87.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.3	179.2	-167.3	0	0	0	0	108.6	L173 M186 I249 G250 V271 V289	L173-V237 HydrophobicContact CD1-CG1 4.02Å; L173-V237 HydrophobicContact CD2-CG1 4.33Å; M186-V237 HydrophobicContact CG-CG2 4.23Å; V237-I249 HydrophobicContact CB-CB 4.32Å; V237-I249 HydrophobicContact CG1-CB 4.35Å; V237-I249 HydrophobicContact CG1-CD1 4.24Å; V237-I249 WeakPolarHBondContact O-CA 3.38Å; V237-I249 WeakPolarHBondContact O-CB 3.49Å; V237-I249 PolarHBondContact O-N 2.83Å; V237-G250 PolarHBondContact N-O 3.43Å; V237-G250 PolarHBondContact O-N 2.9Å; V237-V271 HydrophobicContact CB-CG1 4.38Å; V237-V271 HydrophobicContact CG2-CG1 4.06Å; V237-V271 HydrophobicContact CG2-CG2 4.25Å; V237-V289 HydrophobicContact CG2-CG2 4.24Å
238	Y	93.7	Very high	88.4	Confident	47 Å²	47	58.2 Å²	58.2	18%	0.184	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	153.8	-176.8	-72.4	-88.1	0	0	0	111.2	P184 F185 V187 E236 H246 F248	P184-Y238 WeakPolarHBondContact CA-O 3.49Å; F185-Y238 VanDerWaalsContact CE1-CB 3.41Å; F185-Y238 HydrophobicContact CE1-CG 4.41Å; F185-Y238 HydrophobicContact CE2-CD2 4.04Å; F185-Y238 HydrophobicContact CE2-CG 4.2Å; F185-Y238 HydrophobicContact CZ-CD2 4.17Å; F185-Y238 AromaticContact CZ-CG 3.87Å; F185-Y238 HydrophobicContact CZ-CG 3.87Å; F185-Y238 PolarHBondContact N-O 2.63Å; F185-Y238 PolarHBondContact O-N 3.18Å; V187-Y238 HydrophobicContact CG2-CD2 4.17Å; V187-Y238 HydrophobicContact CG2-CE2 4.24Å; E236-Y238 HydrophobicContact CB-CD2 4.18Å; E236-Y238 HydrophobicContact CB-CE2 3.47Å; E236-Y238 VanDerWaalsContact CB-CE2 3.47Å; E236-Y238 HydrophobicContact CG-CE2 4.49Å; E236-Y238 WeakPolarHBondContact OE2-CE2 3.27Å; E236-Y238 PolarHBondContact OE2-OH 3.21Å; Y238-H246 HydrophobicContact CD1-CB 4.17Å; Y238-F248 HydrophobicContact CD1-CB 4.18Å; Y238-F248 HydrophobicContact CD1-CD2 4.23Å; Y238-F248 HydrophobicContact CE1-CB 3.91Å; Y238-F248 AromaticContact CE1-CD2 3.68Å; Y238-F248 HydrophobicContact CE1-CD2 3.68Å; Y238-F248 HydrophobicContact CE1-CG 4.29Å; Y238-F248 HydrophobicContact CE2-CD2 4.33Å; Y238-F248 AromaticContact CZ-CD2 3.72Å
239	D	93.4	Very high	89.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.8	162.8	-154.4	-4.1	0	0	0	109.1	K176 S182 D183 H246 D247 I249	K176-D239 HydrophobicContact CB-CB 4.17Å; K176-D239 WeakPolarHBondContact CB-OD2 3.43Å; K176-D239 HydrophobicContact CG-CB 3.89Å; K176-D239 WeakPolarHBondContact CG-OD2 3.05Å; S182-D239 WeakPolarHBondContact CA-OD1 3.47Å; S182-D239 WeakPolarHBondContact CA-OD2 3.47Å; S182-D239 VanDerWaalsContact CB-OD1 3.24Å; S182-D239 WeakPolarHBondContact CB-OD1 3.15Å; S182-D239 WeakPolarHBondContact CB-OD2 3.01Å; S182-D239 VanDerWaalsContact OG-CG 3.31Å; S182-D239 PolarHBondContact OG-OD2 2.93Å; D183-D239 PolarHBondContact N-OD1 2.82Å; D239-H246 CarbonylContact O-C 3.56Å; D239-H246 VanDerWaalsContact O-CA 3.31Å; D239-H246 WeakPolarHBondContact O-CA 3.26Å; D239-H246 WeakPolarHBondContact O-CB 3.43Å; D239-D247 HydrophobicContact CB-CB 3.74Å; D239-D247 PolarHBondContact N-O 3.15Å; D239-D247 PolarHBondContact O-N 3.16Å; D239-I249 HydrophobicContact CB-CD1 4.25Å; D239-I249 HydrophobicContact CB-CG1 4.38Å
240	W	91.6	Very high	89.5	Confident	81 Å²	81	49.8 Å²	49.8	31%	0.307	25%	0.248	S	C	.	.			trans	-81.1	133.4	179.5	-178.2	87.9	0	0	0	111.2	D183 F185 V205 R242 H246	D183-W240 HydrophobicContact CB-CB 4Å; D183-W240 WeakPolarHBondContact O-CB 3.43Å; D183-W240 PolarHBondContact O-N 3.07Å; F185-W240 HydrophobicContact CD1-CB 3.96Å; F185-W240 HydrophobicContact CE1-CB 4.01Å; V205-W240 HydrophobicContact CB-CB 4.47Å; V205-W240 HydrophobicContact CG1-CB 3.61Å; V205-W240 HydrophobicContact CG1-CG 4.02Å; V205-W240 HydrophobicContact CG2-CB 3.95Å; V205-W240 HydrophobicContact CG2-CG 3.9Å; W240-R242 HydrophobicContact CH2-CB 3.89Å; W240-R242 HydrophobicContact CH2-CG 4.02Å; W240-R242 HydrophobicContact CZ3-CB 4.17Å; W240-H246 AromaticContact CD1-CE1 3.18Å; W240-H246 AromaticContact CD1-ND1 3.81Å; W240-H246 AromaticContact CD1-NE2 3.7Å; W240-H246 AromaticContact CG-CE1 3.92Å; W240-H246 AromaticContact NE1-CE1 3.4Å; W240-H246 PolarHBondContact NE1-CE1 3.28Å; W240-H246 AromaticContact NE1-NE2 3.98Å
241	D	82.8	Confident	89.8	Confident	32 Å²	32	47.9 Å²	47.9	17%	0.171	24%	0.24	C	C	.	.			trans	-126.2	139.7	-179.5	-71.9	-63.9	0	0	0	109.6	D243 G244 H246 D247	D241-D243 PolarHBondContact O-N 2.52Å; D241-G244 PolarHBondContact O-N 3.12Å; D241-G244 VanDerWaalsContact O-N 3.13Å; D241-H246 PolarHBondContact N-ND1 2.94Å; D241-H246 PolarHBondContact O-CE1 2.63Å; D241-H246 VanDerWaalsContact O-CE1 3.23Å; D241-H246 PolarHBondContact O-ND1 3.44Å; D241-H246 WeakPolarHBondContact OD2-CA 3.41Å; D241-D247 PolarHBondContact OD2-N 3.47Å; D241-D247 VanDerWaalsContact OD2-N 3.11Å
242	R	75.9	Confident	90	Very high	232 Å²	232	47.2 Å²	47.2	88%	0.875	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.7	-173.9	-166.4	175.5	-170.5	-169.4	3.3	113.8	W240 G244	W240-R242 HydrophobicContact CH2-CB 3.89Å; W240-R242 HydrophobicContact CH2-CG 4.02Å; W240-R242 HydrophobicContact CZ3-CB 4.17Å; R242-G244 VanDerWaalsContact C-N 3.31Å
243	D	76.9	Confident	90.1	Very high	125 Å²	125	48.4 Å²	48.4	67%	0.668	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-0.2	179.9	66.5	3.8	0	0	0	113.5	D241 S245	D241-D243 PolarHBondContact O-N 2.52Å; D243-S245 VanDerWaalsContact C-N 3.31Å; D243-S245 WeakPolarHBondContact OD1-CB 3.3Å; D243-S245 PolarHBondContact OD1-N 3.28Å; D243-S245 PolarHBondContact OD1-OG 2.61Å; D243-S245 PolarHBondContact OD2-OG 3.15Å; D243-S245 VanDerWaalsContact OD2-OG 3.1Å
244	G	70.7	Confident	90	Very high	49 Å²	49	48.8 Å²	48.8	51%	0.505	25%	0.247	S	C	.	.	S	Bend	trans	83.4	-1.9	-178.4	0	0	0	0	0	114.5	D241 R242 H246	D241-G244 PolarHBondContact O-N 3.12Å; D241-G244 VanDerWaalsContact O-N 3.13Å; R242-G244 VanDerWaalsContact C-N 3.31Å; G244-H246 PolarHBondContact O-N 2.96Å
245	S	79	Confident	89.9	Confident	77 Å²	77	47.4 Å²	47.4	54%	0.538	24%	0.241	S	C	.	.			trans	-85.8	47.3	-179.9	71.6	0	0	0	0	113.5	D243 D247	D243-S245 VanDerWaalsContact C-N 3.31Å; D243-S245 WeakPolarHBondContact OD1-CB 3.3Å; D243-S245 PolarHBondContact OD1-N 3.28Å; D243-S245 PolarHBondContact OD1-OG 2.61Å; D243-S245 PolarHBondContact OD2-OG 3.15Å; D243-S245 VanDerWaalsContact OD2-OG 3.1Å; S245-D247 PolarHBondContact O-N 3.26Å
246	H	82.9	Confident	89.7	Confident	50 Å²	50	48.4 Å²	48.4	23%	0.231	25%	0.245	C	C	.	.			trans	-46.1	127	-171.6	-58.1	-30.5	0	0	0	114.3	F185 Y238 D239 W240 D241 G244 F248	F185-H246 HydrophobicContact CE1-CB 4.18Å; F185-H246 AromaticContact CE1-CD2 3.98Å; F185-H246 AromaticContact CE1-CG 3.94Å; F185-H246 HydrophobicContact CZ-CB 4.09Å; F185-H246 AromaticContact CZ-CD2 3.59Å; F185-H246 AromaticContact CZ-CG 3.89Å; Y238-H246 HydrophobicContact CD1-CB 4.17Å; D239-H246 CarbonylContact O-C 3.56Å; D239-H246 VanDerWaalsContact O-CA 3.31Å; D239-H246 WeakPolarHBondContact O-CA 3.26Å; D239-H246 WeakPolarHBondContact O-CB 3.43Å; W240-H246 AromaticContact CD1-CE1 3.18Å; W240-H246 AromaticContact CD1-ND1 3.81Å; W240-H246 AromaticContact CD1-NE2 3.7Å; W240-H246 AromaticContact CG-CE1 3.92Å; W240-H246 AromaticContact NE1-CE1 3.4Å; W240-H246 PolarHBondContact NE1-CE1 3.28Å; W240-H246 AromaticContact NE1-NE2 3.98Å; D241-H246 PolarHBondContact N-ND1 2.94Å; D241-H246 PolarHBondContact O-CE1 2.63Å; D241-H246 VanDerWaalsContact O-CE1 3.23Å; D241-H246 PolarHBondContact O-ND1 3.44Å; D241-H246 WeakPolarHBondContact OD2-CA 3.41Å; G244-H246 PolarHBondContact O-N 2.96Å; H246-F248 PolarHBondContact O-N 3.5Å
247	D	88.4	Confident	89.3	Confident	66 Å²	66	51.4 Å²	51.4	35%	0.353	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	110.5	-169.5	-136.3	-28.6	0	0	0	112	K176 D239 D241 S245 I249	K176-D247 HydrophobicContact CB-CB 4.05Å; K176-D247 WeakPolarHBondContact CB-OD2 3.32Å; K176-D247 HydrophobicContact CG-CB 4.1Å; K176-D247 IonicContact NZ-OD1 2.93Å; K176-D247 PolarHBondContact NZ-OD1 3.41Å; K176-D247 IonicContact NZ-OD2 3.25Å; D239-D247 HydrophobicContact CB-CB 3.74Å; D239-D247 PolarHBondContact N-O 3.15Å; D239-D247 PolarHBondContact O-N 3.16Å; D241-D247 PolarHBondContact OD2-N 3.47Å; D241-D247 VanDerWaalsContact OD2-N 3.11Å; S245-D247 PolarHBondContact O-N 3.26Å; D247-I249 PolarHBondContact O-N 3.4Å
248	F	93.5	Very high	88.9	Confident	50 Å²	50	55.2 Å²	55.2	22%	0.219	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	121.8	-177.1	-179.3	-107.6	0	0	0	112.4	K176 E236 Y238 H246 G250 E251	K176-F248 VanDerWaalsContact CE-O 3.25Å; K176-F248 WeakPolarHBondContact CE-O 3.41Å; K176-F248 PolarHBondContact NZ-O 2.97Å; E236-F248 HydrophobicContact CB-CE2 4.09Å; E236-F248 HydrophobicContact CG-CE2 4.13Å; Y238-F248 HydrophobicContact CD1-CB 4.18Å; Y238-F248 HydrophobicContact CD1-CD2 4.23Å; Y238-F248 HydrophobicContact CE1-CB 3.91Å; Y238-F248 AromaticContact CE1-CD2 3.68Å; Y238-F248 HydrophobicContact CE1-CD2 3.68Å; Y238-F248 HydrophobicContact CE1-CG 4.29Å; Y238-F248 HydrophobicContact CE2-CD2 4.33Å; Y238-F248 AromaticContact CZ-CD2 3.72Å; H246-F248 PolarHBondContact O-N 3.5Å; F248-G250 WeakPolarHBondContact CE2-O 3.39Å; F248-G250 VanDerWaalsContact CZ-CA 3.45Å; F248-E251 HydrophobicContact CE2-CB 4.34Å; F248-E251 HydrophobicContact CZ-CB 3.93Å; F248-E251 HydrophobicContact CZ-CG 4.16Å
249	I	95.9	Very high	88.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-55.9	177.7	-62.5	177.7	0	0	0	109.3	L173 D174 K176 V237 D239 D247 V271 N273 S286	L173-I249 HydrophobicContact CD2-CG2 4.41Å; D174-I249 HydrophobicContact CB-CG2 4.31Å; K176-I249 HydrophobicContact CD-CG1 4.49Å; K176-I249 HydrophobicContact CG-CG1 4.11Å; V237-I249 HydrophobicContact CB-CB 4.32Å; V237-I249 HydrophobicContact CG1-CB 4.35Å; V237-I249 HydrophobicContact CG1-CD1 4.24Å; V237-I249 WeakPolarHBondContact O-CA 3.38Å; V237-I249 WeakPolarHBondContact O-CB 3.49Å; V237-I249 PolarHBondContact O-N 2.83Å; D239-I249 HydrophobicContact CB-CD1 4.25Å; D239-I249 HydrophobicContact CB-CG1 4.38Å; D247-I249 PolarHBondContact O-N 3.4Å; I249-V271 HydrophobicContact CG2-CG1 4.45Å; I249-N273 VanDerWaalsContact O-CB 3.32Å; I249-N273 WeakPolarHBondContact O-CB 3.27Å; I249-N273 PolarHBondContact O-ND2 2.84Å; I249-S286 PolarHBondContact O-OG 3.42Å
250	G	96.8	Very high	88.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-175.5	177	0	0	0	0	0	112.6	V237 F248 V272	V237-G250 PolarHBondContact N-O 3.43Å; V237-G250 PolarHBondContact O-N 2.9Å; F248-G250 WeakPolarHBondContact CE2-O 3.39Å; F248-G250 VanDerWaalsContact CZ-CA 3.45Å; G250-V272 CarbonylContact C-O 3.53Å; G250-V272 VanDerWaalsContact CA-O 3.27Å; G250-V272 WeakPolarHBondContact CA-O 3.45Å
251	E	97.3	Very high	87.8	Confident	58 Å²	58	59 Å²	59	27%	0.271	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	161	-176.5	64.4	-174.7	-172.7	0	0	112	A235 E236 F248 V272 P274	A235-E251 CarbonylContact O-C 3.59Å; A235-E251 VanDerWaalsContact O-CA 3.23Å; A235-E251 WeakPolarHBondContact O-CA 3.39Å; E236-E251 HydrophobicContact CG-CB 4.1Å; F248-E251 HydrophobicContact CE2-CB 4.34Å; F248-E251 HydrophobicContact CZ-CB 3.93Å; F248-E251 HydrophobicContact CZ-CG 4.16Å; E251-V272 PolarHBondContact N-O 2.82Å; E251-V272 PolarHBondContact O-N 3.29Å; E251-P274 WeakPolarHBondContact OE1-CG 3.26Å
252	F	96.1	Very high	86.4	Confident	13 Å²	13	59.1 Å²	59.1	6%	0.057	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	166.5	165.2	67.3	-88.8	0	0	0	110.3	M186 A235 Y269 V289	M186-F252 HydrophobicContact CE-CE1 3.61Å; M186-F252 HydrophobicContact CE-CZ 3.69Å; A235-F252 HydrophobicContact CB-CD1 4Å; A235-F252 HydrophobicContact CB-CD2 4.23Å; A235-F252 HydrophobicContact CB-CE1 3.5Å; A235-F252 VanDerWaalsContact CB-CE1 3.5Å; A235-F252 HydrophobicContact CB-CE2 3.76Å; A235-F252 HydrophobicContact CB-CG 4.35Å; A235-F252 HydrophobicContact CB-CZ 3.37Å; A235-F252 PolarHBondContact N-O 3.37Å; A235-F252 PolarHBondContact O-N 2.86Å; F252-Y269 AromaticContact CD2-CD1 3.55Å; F252-Y269 HydrophobicContact CD2-CD1 3.55Å; F252-Y269 HydrophobicContact CD2-CD2 4.11Å; F252-Y269 HydrophobicContact CD2-CE1 4.25Å; F252-Y269 AromaticContact CD2-CG 3.46Å; F252-Y269 HydrophobicContact CD2-CG 3.46Å; F252-Y269 VanDerWaalsContact CD2-CG 3.46Å; F252-Y269 AromaticContact CE2-CD1 3.87Å; F252-Y269 HydrophobicContact CE2-CD1 3.87Å; F252-Y269 AromaticContact CE2-CD2 3.67Å; F252-Y269 HydrophobicContact CE2-CD2 3.67Å; F252-Y269 HydrophobicContact CE2-CE1 4.29Å; F252-Y269 HydrophobicContact CE2-CE2 4.11Å; F252-Y269 AromaticContact CE2-CG 3.53Å; F252-Y269 HydrophobicContact CE2-CG 3.53Å; F252-Y269 HydrophobicContact CG-CD1 4.41Å; F252-Y269 HydrophobicContact CG-CG 4.11Å; F252-Y269 HydrophobicContact CZ-CD2 4.11Å; F252-Y269 HydrophobicContact CZ-CG 4.22Å; F252-V289 HydrophobicContact CD1-CB 4.48Å; F252-V289 HydrophobicContact CE1-CB 3.82Å; F252-V289 HydrophobicContact CE1-CG1 3.82Å; F252-V289 HydrophobicContact CE1-CG2 3.94Å; F252-V289 HydrophobicContact CZ-CB 4.25Å; F252-V289 HydrophobicContact CZ-CG1 3.82Å
253	T	95.3	Very high	85.2	Confident	85 Å²	85	56 Å²	56	52%	0.521	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.8	177.2	55.6	0	0	0	0	110.8	T232 I233 K234	T232-T253 HydrophobicContact CG2-CG2 4Å; I233-T253 CarbonylContact O-C 3.47Å; I233-T253 VanDerWaalsContact O-CA 3.29Å; I233-T253 WeakPolarHBondContact O-CA 3.35Å; K234-T253 HydrophobicContact CB-CG2 4.37Å; K234-T253 HydrophobicContact CG-CG2 4.41Å
254	T	94.1	Very high	84	Confident	9 Å²	9	55.6 Å²	55.6	6%	0.055	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	-171	172.2	-164.9	0	0	0	0	110.5	I233 E258 L259 Y269	I233-T254 HydrophobicContact CB-CG2 4.17Å; I233-T254 HydrophobicContact CG2-CG2 4.47Å; I233-T254 PolarHBondContact N-O 3.43Å; I233-T254 PolarHBondContact O-N 3.03Å; T254-E258 WeakPolarHBondContact CA-OE2 3.39Å; T254-E258 WeakPolarHBondContact CB-OE2 3.24Å; T254-E258 WeakPolarHBondContact OG1-CB 3.32Å; T254-E258 PolarHBondContact OG1-OE2 3.06Å; T254-L259 HydrophobicContact CG2-CD1 4.12Å; T254-L259 HydrophobicContact CG2-CD2 3.98Å; T254-L259 HydrophobicContact CG2-CG 3.94Å; T254-Y269 PolarHBondContact OG1-OH 2.84Å; T254-Y269 VanDerWaalsContact OG1-OH 3.08Å
255	S	93.5	Very high	83.2	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.028	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	164.5	171.6	73.2	0	0	0	0	110.9	K257 E258 L259	S255-K257 PolarHBondContact O-N 2.66Å; S255-E258 PolarHBondContact N-OE2 3.19Å; S255-E258 PolarHBondContact O-N 2.63Å; S255-E258 VanDerWaalsContact O-N 3.09Å; S255-E258 PolarHBondContact OG-N 2.71Å; S255-L259 WeakPolarHBondContact O-CG 3.37Å; S255-L259 PolarHBondContact O-N 3.03Å
256	Y	90.7	Very high	82.3	Confident	23 Å²	23	63.9 Å²	63.9	9%	0.09	33%	0.331	C	S	.	.	H	α-helix	trans	-56.5	-40.2	175.3	174.9	-95.5	0	0	0	111.7	V221 Y229 E258 L259 C260 F294 V296	V221-Y256 HydrophobicContact CB-CE2 4.37Å; V221-Y256 HydrophobicContact CG1-CD2 4.1Å; V221-Y256 HydrophobicContact CG1-CE2 3.79Å; V221-Y256 HydrophobicContact CG2-CD2 4.4Å; V221-Y256 HydrophobicContact CG2-CE2 3.65Å; Y229-Y256 AromaticContact CD1-CD1 3.44Å; Y229-Y256 HydrophobicContact CD1-CD1 3.44Å; Y229-Y256 VanDerWaalsContact CD1-CD1 3.44Å; Y229-Y256 AromaticContact CD1-CE1 3.79Å; Y229-Y256 HydrophobicContact CD1-CE1 3.79Å; Y229-Y256 HydrophobicContact CD1-CG 4.16Å; Y229-Y256 HydrophobicContact CD2-CD1 4.36Å; Y229-Y256 HydrophobicContact CD2-CE1 4.37Å; Y229-Y256 HydrophobicContact CE1-CD1 4.07Å; Y229-Y256 AromaticContact CE1-CE1 3.97Å; Y229-Y256 HydrophobicContact CE1-CE1 3.97Å; Y229-Y256 AromaticContact CG-CD1 3.63Å; Y229-Y256 HydrophobicContact CG-CD1 3.63Å; Y229-Y256 HydrophobicContact CG-CE1 4.03Å; Y229-Y256 PolarHBondContact O-N 3.21Å; Y256-E258 VanDerWaalsContact C-N 3.31Å; Y256-E258 PolarHBondContact O-N 3.22Å; Y256-L259 PolarHBondContact O-N 3.17Å; Y256-C260 WeakPolarHBondContact O-CB 3.45Å; Y256-C260 PolarHBondContact O-N 3.06Å; Y256-F294 AromaticContact CD2-CZ 3.96Å; Y256-F294 HydrophobicContact CD2-CZ 3.96Å; Y256-F294 HydrophobicContact CE2-CE1 4.27Å; Y256-F294 AromaticContact CE2-CZ 3.8Å; Y256-F294 HydrophobicContact CE2-CZ 3.8Å; Y256-V296 HydrophobicContact CE2-CG2 4.09Å; Y256-V296 WeakPolarHBondContact OH-CG2 3.26Å
257	K	89.6	Confident	82	Confident	79 Å²	79	62.8 Å²	62.8	34%	0.343	33%	0.326	S	S	.	.	H	α-helix	trans	-65.3	-32.8	177.2	-166.6	-175.5	-168.4	177.3	0	113.3	Y229 E230 S255 C260 R261	Y229-K257 WeakPolarHBondContact O-CB 3.3Å; Y229-K257 PolarHBondContact O-N 2.85Å; E230-K257 HydrophobicContact CG-CD 4.39Å; E230-K257 WeakPolarHBondContact OE1-CD 3.28Å; E230-K257 WeakPolarHBondContact OE1-CE 3.43Å; E230-K257 IonicContact OE1-NZ 2.8Å; E230-K257 PolarHBondContact OE1-NZ 2.86Å; S255-K257 PolarHBondContact O-N 2.66Å; K257-C260 PolarHBondContact O-SG 3.28Å; K257-R261 VanDerWaalsContact O-CG 3.29Å; K257-R261 WeakPolarHBondContact O-CG 3.39Å
258	E	89.4	Confident	82	Confident	79 Å²	79	64.2 Å²	64.2	37%	0.369	33%	0.333	S	S	.	.	H	α-helix	trans	-71.7	-47.4	172.8	-73	179.2	167.6	0	0	110.9	T254 S255 Y256 C260 R261 H267	T254-E258 WeakPolarHBondContact CA-OE2 3.39Å; T254-E258 WeakPolarHBondContact CB-OE2 3.24Å; T254-E258 WeakPolarHBondContact OG1-CB 3.32Å; T254-E258 PolarHBondContact OG1-OE2 3.06Å; S255-E258 PolarHBondContact N-OE2 3.19Å; S255-E258 PolarHBondContact O-N 2.63Å; S255-E258 VanDerWaalsContact O-N 3.09Å; S255-E258 PolarHBondContact OG-N 2.71Å; Y256-E258 VanDerWaalsContact C-N 3.31Å; Y256-E258 PolarHBondContact O-N 3.22Å; E258-C260 PolarHBondContact O-N 3.05Å; E258-R261 PolarHBondContact O-N 3.28Å; E258-R261 VanDerWaalsContact O-N 3.07Å; E258-H267 PolarHBondContact O-NE2 2.83Å
259	L	89.7	Confident	82	Confident	6 Å²	6	63 Å²	63	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-56.9	-33.3	177.9	-67.5	170.5	0	0	0	112.6	F168 I233 T254 S255 Y256 L291 F294	F168-L259 HydrophobicContact CZ-CD2 4.21Å; I233-L259 HydrophobicContact CD1-CD1 3.9Å; T254-L259 HydrophobicContact CG2-CD1 4.12Å; T254-L259 HydrophobicContact CG2-CD2 3.98Å; T254-L259 HydrophobicContact CG2-CG 3.94Å; S255-L259 WeakPolarHBondContact O-CG 3.37Å; S255-L259 PolarHBondContact O-N 3.03Å; Y256-L259 PolarHBondContact O-N 3.17Å; L259-L291 HydrophobicContact CD2-CD1 4.45Å; L259-L291 HydrophobicContact CD2-CD2 3.72Å; L259-F294 HydrophobicContact CB-CD2 3.78Å; L259-F294 HydrophobicContact CB-CE1 4.29Å; L259-F294 HydrophobicContact CB-CE2 3.49Å; L259-F294 VanDerWaalsContact CB-CE2 3.49Å; L259-F294 HydrophobicContact CB-CG 4.3Å; L259-F294 HydrophobicContact CB-CZ 3.77Å; L259-F294 HydrophobicContact CD1-CE2 3.95Å; L259-F294 HydrophobicContact CG-CE2 4.25Å; L259-F294 WeakPolarHBondContact O-CD1 3.28Å; L259-F294 WeakPolarHBondContact O-CG 3.4Å
260	C	85.8	Confident	82	Confident	62 Å²	62	67.8 Å²	67.8	42%	0.419	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-8	-179.6	82.3	0	0	0	0	115.1	Y256 K257 E258 G262 F294	Y256-C260 WeakPolarHBondContact O-CB 3.45Å; Y256-C260 PolarHBondContact O-N 3.06Å; K257-C260 PolarHBondContact O-SG 3.28Å; E258-C260 PolarHBondContact O-N 3.05Å; C260-G262 PolarHBondContact O-N 3.44Å; C260-F294 HydrophobicContact CB-CD1 4.36Å; C260-F294 HydrophobicContact CB-CE1 3.85Å
261	R	78.6	Confident	81.9	Confident	140 Å²	140	67.8 Å²	67.8	53%	0.528	35%	0.35	S	S	.	.	S	Bend	trans	-77.8	60.8	-177.3	-84.6	170.6	174.5	165.4	-0.3	112.9	K257 E258 H267	K257-R261 VanDerWaalsContact O-CG 3.29Å; K257-R261 WeakPolarHBondContact O-CG 3.39Å; E258-R261 PolarHBondContact O-N 3.28Å; E258-R261 VanDerWaalsContact O-N 3.07Å; R261-H267 PolarHBondContact O-CE1 3.17Å; R261-H267 VanDerWaalsContact O-CE1 3.25Å
262	G	54.8	Low	81.9	Confident	35 Å²	35	66.7 Å²	66.7	36%	0.361	35%	0.347	S	S	.	.			trans	75.2	134.8	158.2	0	0	0	0	0	117.2	C260 S264 H267	C260-G262 PolarHBondContact O-N 3.44Å; G262-S264 PolarHBondContact O-N 3.01Å; G262-H267 PolarHBondContact O-CE1 3.49Å
263	Q	51.2	Low	81.9	Confident	166 Å²	166	66.5 Å²	66.5	78%	0.776	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-4.6	174.6	-70.3	174	-12.1	0	0	114.7
264	S	49.9	Very low	81.8	Confident	116 Å²	116	64.8 Å²	64.8	81%	0.811	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-6.6	-172.8	42.5	0	0	0	0	114.9	G262	G262-S264 PolarHBondContact O-N 3.01Å
265	Q	55.1	Low	81.6	Confident	147 Å²	147	72 Å²	72	69%	0.687	37%	0.367	S	S	*	.	S	Bend	trans	-109.5	125.1	164.2	-64.7	-169	4.5	0	0	108.3	H267	Q265-H267 PolarHBondContact O-N 2.87Å; Q265-H267 PolarHBondContact O-ND1 3.29Å
266	L	58.9	Low	81.5	Confident	153 Å²	153	73.7 Å²	73.7	80%	0.801	37%	0.374	S	S	*	.			trans	-59.7	101.4	169.5	-81.9	159.6	0	0	0	107.7	L268	L266-L268 PolarHBondContact O-N 2.87Å
267	H	77.3	Confident	81.5	Confident	28 Å²	28	79.1 Å²	79.1	13%	0.13	40%	0.399	C	S	.	.			trans	-70	83.3	171.2	-70.9	98.7	0	0	0	108	E258 R261 G262 Q265 Y269 S290 L291	E258-H267 PolarHBondContact O-NE2 2.83Å; R261-H267 PolarHBondContact O-CE1 3.17Å; R261-H267 VanDerWaalsContact O-CE1 3.25Å; G262-H267 PolarHBondContact O-CE1 3.49Å; Q265-H267 PolarHBondContact O-N 2.87Å; Q265-H267 PolarHBondContact O-ND1 3.29Å; H267-Y269 HydrophobicContact CB-CE2 3.96Å; H267-S290 VanDerWaalsContact O-CA 3.31Å; H267-S290 WeakPolarHBondContact O-CA 3.22Å; H267-L291 HydrophobicContact CB-CB 3.87Å; H267-L291 HydrophobicContact CB-CD2 4.26Å; H267-L291 PolarHBondContact O-N 2.82Å; H267-L291 VanDerWaalsContact O-N 3.13Å
268	L	88.6	Confident	81.5	Confident	95 Å²	95	82.8 Å²	82.8	50%	0.497	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	118.8	-179.7	-175	141	0	0	0	109.2	L266 T288 V289	L266-L268 PolarHBondContact O-N 2.87Å; L268-T288 HydrophobicContact CD2-CG2 3.9Å; L268-T288 HydrophobicContact CG-CG2 4.41Å; L268-V289 CarbonylContact C-O 3.5Å; L268-V289 WeakPolarHBondContact CA-O 3.27Å
269	Y	93.5	Very high	81.5	Confident	25 Å²	25	87.6 Å²	87.6	10%	0.098	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.4	179.4	-55.3	-81.7	0	0	0	109.5	F168 F252 T254 H267 V271 T288 V289 L291	F168-Y269 HydrophobicContact CE1-CE2 4.31Å; F252-Y269 AromaticContact CD2-CD1 3.55Å; F252-Y269 HydrophobicContact CD2-CD1 3.55Å; F252-Y269 HydrophobicContact CD2-CD2 4.11Å; F252-Y269 HydrophobicContact CD2-CE1 4.25Å; F252-Y269 AromaticContact CD2-CG 3.46Å; F252-Y269 HydrophobicContact CD2-CG 3.46Å; F252-Y269 VanDerWaalsContact CD2-CG 3.46Å; F252-Y269 AromaticContact CE2-CD1 3.87Å; F252-Y269 HydrophobicContact CE2-CD1 3.87Å; F252-Y269 AromaticContact CE2-CD2 3.67Å; F252-Y269 HydrophobicContact CE2-CD2 3.67Å; F252-Y269 HydrophobicContact CE2-CE1 4.29Å; F252-Y269 HydrophobicContact CE2-CE2 4.11Å; F252-Y269 AromaticContact CE2-CG 3.53Å; F252-Y269 HydrophobicContact CE2-CG 3.53Å; F252-Y269 HydrophobicContact CG-CD1 4.41Å; F252-Y269 HydrophobicContact CG-CG 4.11Å; F252-Y269 HydrophobicContact CZ-CD2 4.11Å; F252-Y269 HydrophobicContact CZ-CG 4.22Å; T254-Y269 PolarHBondContact OG1-OH 2.84Å; T254-Y269 VanDerWaalsContact OG1-OH 3.08Å; H267-Y269 HydrophobicContact CB-CE2 3.96Å; Y269-V271 PolarHBondContact O-N 3.05Å; Y269-T288 CarbonylContact O-C 3.57Å; Y269-T288 VanDerWaalsContact O-CA 3.28Å; Y269-T288 WeakPolarHBondContact O-CA 3.24Å; Y269-V289 PolarHBondContact N-O 3.23Å; Y269-V289 PolarHBondContact O-N 3.16Å; Y269-L291 HydrophobicContact CE2-CB 4.48Å
270	E	94.9	Very high	81.5	Confident	101 Å²	101	93.2 Å²	93.2	47%	0.472	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	125.2	170.8	-62.4	-161.1	118.2	0	0	110	V272 N285	E270-V272 PolarHBondContact O-N 2.83Å; E270-N285 HydrophobicContact CB-CB 4.13Å; E270-N285 PolarHBondContact OE1-ND2 2.78Å
271	V	96.4	Very high	81.3	Confident	0 Å²	0	100.9 Å²	100.9	0%	0	49%	0.491	C	S	.	.			trans	-82	112.7	178.3	-178.8	0	0	0	0	108.7	L173 V237 I249 Y269 Y283 N285 S286 G287 V289	L173-V271 HydrophobicContact CD2-CG2 4.33Å; V237-V271 HydrophobicContact CB-CG1 4.38Å; V237-V271 HydrophobicContact CG2-CG1 4.06Å; V237-V271 HydrophobicContact CG2-CG2 4.25Å; I249-V271 HydrophobicContact CG2-CG1 4.45Å; Y269-V271 PolarHBondContact O-N 3.05Å; V271-Y283 PolarHBondContact O-OH 2.66Å; V271-N285 WeakPolarHBondContact O-CB 3.44Å; V271-S286 PolarHBondContact O-N 2.59Å; V271-G287 WeakPolarHBondContact CB-O 3.38Å; V271-G287 PolarHBondContact N-O 2.76Å; V271-V289 HydrophobicContact CG2-CB 4.32Å; V271-V289 HydrophobicContact CG2-CG2 3.59Å
272	V	96.4	Very high	81.7	Confident	35 Å²	35	105.8 Å²	105.8	21%	0.212	51%	0.509	C	S	.	.	B	Isolated β-bridge	trans	-106.6	127.5	-173.8	177.9	0	0	0	0	110.5	G250 E251 E270 P274 K277 Y283	G250-V272 CarbonylContact C-O 3.53Å; G250-V272 VanDerWaalsContact CA-O 3.27Å; G250-V272 WeakPolarHBondContact CA-O 3.45Å; E251-V272 PolarHBondContact N-O 2.82Å; E251-V272 PolarHBondContact O-N 3.29Å; E270-V272 PolarHBondContact O-N 2.83Å; V272-P274 WeakPolarHBondContact O-CD 3.23Å; V272-K277 HydrophobicContact CG1-CD 3.9Å; V272-Y283 WeakPolarHBondContact CA-OH 3.41Å; V272-Y283 HydrophobicContact CG1-CE1 4.28Å
273	N	96	Very high	83.4	Confident	8 Å²	8	106 Å²	106	4%	0.043	50%	0.5	C	S	.	.			trans	-98.9	108.7	169.1	-172.4	-59.8	0	0	0	109	I249 K275 K276 K277 Y283	I249-N273 VanDerWaalsContact O-CB 3.32Å; I249-N273 WeakPolarHBondContact O-CB 3.27Å; I249-N273 PolarHBondContact O-ND2 2.84Å; N273-K275 VanDerWaalsContact C-N 3.27Å; N273-K275 PolarHBondContact O-N 2.96Å; N273-K275 WeakPolarHBondContact OD1-CB 3.46Å; N273-K275 PolarHBondContact OD1-N 3.24Å; N273-K276 HydrophobicContact CB-CB 3.99Å; N273-K276 HydrophobicContact CB-CD 3.96Å; N273-K276 HydrophobicContact CB-CG 4.06Å; N273-K276 PolarHBondContact O-N 2.71Å; N273-K276 VanDerWaalsContact O-N 3.1Å; N273-K276 PolarHBondContact OD1-N 2.86Å; N273-K277 PolarHBondContact O-N 3.26Å; N273-Y283 PolarHBondContact N-OH 2.75Å
274	P	92.7	Very high	85.1	Confident	50 Å²	50	104.2 Å²	104.2	33%	0.325	49%	0.494	S	S	.	.	H	α-helix	trans	-58.7	-37.9	-175.4	-26.6	36	0	0	0	113	E251 V272 K277 L278	E251-P274 WeakPolarHBondContact OE1-CG 3.26Å; V272-P274 WeakPolarHBondContact O-CD 3.23Å; P274-K277 PolarHBondContact O-N 2.96Å; P274-L278 WeakPolarHBondContact O-CG 3.41Å; P274-L278 PolarHBondContact O-N 2.69Å; P274-L278 VanDerWaalsContact O-N 3.1Å
275	K	91.6	Very high	87.2	Confident	159 Å²	159	100.7 Å²	100.7	69%	0.691	47%	0.466	S	S	*	.	H	α-helix	trans	-65.6	-39.9	178.2	-64.1	179.3	-178.3	172.3	0	111.8	N273 K279	N273-K275 VanDerWaalsContact C-N 3.27Å; N273-K275 PolarHBondContact O-N 2.96Å; N273-K275 WeakPolarHBondContact OD1-CB 3.46Å; N273-K275 PolarHBondContact OD1-N 3.24Å; K275-K279 WeakPolarHBondContact O-CB 3.39Å; K275-K279 VanDerWaalsContact O-CG 3.31Å; K275-K279 WeakPolarHBondContact O-CG 3.16Å; K275-K279 PolarHBondContact O-N 3.27Å
276	K	90.5	Very high	89.2	Confident	41 Å²	41	93.7 Å²	93.7	18%	0.178	43%	0.433	C	S	.	.	H	α-helix	trans	-71.5	-40.3	175.9	-68.4	178	177.6	167.3	0	111.8	D174 N273 L278 K279 K280 Y283	D174-K276 IonicContact OD2-NZ 2.57Å; D174-K276 PolarHBondContact OD2-NZ 2.9Å; N273-K276 HydrophobicContact CB-CB 3.99Å; N273-K276 HydrophobicContact CB-CD 3.96Å; N273-K276 HydrophobicContact CB-CG 4.06Å; N273-K276 PolarHBondContact O-N 2.71Å; N273-K276 VanDerWaalsContact O-N 3.1Å; N273-K276 PolarHBondContact OD1-N 2.86Å; K276-L278 VanDerWaalsContact C-N 3.29Å; K276-L278 PolarHBondContact O-N 2.88Å; K276-K279 PolarHBondContact O-N 3.44Å; K276-K279 VanDerWaalsContact O-N 3.13Å; K276-K280 WeakPolarHBondContact O-CB 3.11Å; K276-K280 PolarHBondContact O-N 2.84Å; K276-Y283 HydrophobicContact CB-CD2 3.79Å; K276-Y283 HydrophobicContact CB-CE2 3.75Å; K276-Y283 HydrophobicContact CB-CG 4.39Å; K276-Y283 HydrophobicContact CD-CE2 4.09Å
277	K	90	Very high	90.9	Very high	137 Å²	137	86.5 Å²	86.5	60%	0.596	40%	0.397	S	S	*	.	H	α-helix	trans	-58.8	-39.9	177.8	-170.3	173.1	-177.8	175.5	0	112.1	V272 N273 P274 Y283	V272-K277 HydrophobicContact CG1-CD 3.9Å; N273-K277 PolarHBondContact O-N 3.26Å; P274-K277 PolarHBondContact O-N 2.96Å; K277-Y283 HydrophobicContact CB-CD1 3.81Å; K277-Y283 HydrophobicContact CB-CE1 4.08Å; K277-Y283 HydrophobicContact CG-CD1 4.15Å
278	L	89.4	Confident	91.8	Very high	156 Å²	156	86.2 Å²	86.2	82%	0.817	40%	0.397	S	S	*	.	H	α-helix	trans	-70.6	-34.3	175.5	-70.4	166.8	0	0	0	113.3	P274 K276	P274-L278 WeakPolarHBondContact O-CG 3.41Å; P274-L278 PolarHBondContact O-N 2.69Å; P274-L278 VanDerWaalsContact O-N 3.1Å; K276-L278 VanDerWaalsContact C-N 3.29Å; K276-L278 PolarHBondContact O-N 2.88Å
279	K	90.7	Very high	92.1	Very high	180 Å²	180	81.7 Å²	81.7	78%	0.783	37%	0.373	S	S	*	.	H	α-helix	trans	-89.6	-29.5	-173.1	-71.8	-179.7	179.9	-175.2	0	114.5	K275 K276	K275-K279 WeakPolarHBondContact O-CB 3.39Å; K275-K279 VanDerWaalsContact O-CG 3.31Å; K275-K279 WeakPolarHBondContact O-CG 3.16Å; K275-K279 PolarHBondContact O-N 3.27Å; K276-K279 PolarHBondContact O-N 3.44Å; K276-K279 VanDerWaalsContact O-N 3.13Å
280	K	88.6	Confident	92.2	Very high	123 Å²	123	81.3 Å²	81.3	54%	0.535	37%	0.374	S	S	.	.			trans	-114.3	112.8	-170.2	-70.8	-176.2	179.5	-175.2	0	111.3	K276 R282 Y283	K276-K280 WeakPolarHBondContact O-CB 3.11Å; K276-K280 PolarHBondContact O-N 2.84Å; K280-R282 PolarHBondContact O-N 3.42Å; K280-R282 VanDerWaalsContact O-N 3.13Å; K280-Y283 WeakPolarHBondContact O-CB 3.3Å; K280-Y283 PolarHBondContact O-N 3.28Å; K280-Y283 VanDerWaalsContact O-N 3.15Å
281	K	81.6	Confident	92	Very high	224 Å²	224	77.1 Å²	77.1	97%	0.974	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.1	179.7	-74.4	-172.6	176.4	-177.9	0	115.6
282	R	87.4	Confident	91.8	Very high	242 Å²	242	81.2 Å²	81.2	91%	0.913	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	25.6	179.5	-66.6	-173.7	177.7	177.5	-0.6	112.8	K280	K280-R282 PolarHBondContact O-N 3.42Å; K280-R282 VanDerWaalsContact O-N 3.13Å
283	Y	89.7	Confident	91.5	Very high	39 Å²	39	81.3 Å²	81.3	15%	0.153	38%	0.379	C	S	.	.			trans	-71.2	128.7	174.9	177.3	-97	0	0	0	110.4	V271 V272 N273 K276 K277 K280 N285 S286	V271-Y283 PolarHBondContact O-OH 2.66Å; V272-Y283 WeakPolarHBondContact CA-OH 3.41Å; V272-Y283 HydrophobicContact CG1-CE1 4.28Å; N273-Y283 PolarHBondContact N-OH 2.75Å; K276-Y283 HydrophobicContact CB-CD2 3.79Å; K276-Y283 HydrophobicContact CB-CE2 3.75Å; K276-Y283 HydrophobicContact CB-CG 4.39Å; K276-Y283 HydrophobicContact CD-CE2 4.09Å; K277-Y283 HydrophobicContact CB-CD1 3.81Å; K277-Y283 HydrophobicContact CB-CE1 4.08Å; K277-Y283 HydrophobicContact CG-CD1 4.15Å; K280-Y283 WeakPolarHBondContact O-CB 3.3Å; K280-Y283 PolarHBondContact O-N 3.28Å; K280-Y283 VanDerWaalsContact O-N 3.15Å; Y283-N285 WeakPolarHBondContact CE2-O 3.46Å; Y283-N285 VanDerWaalsContact CZ-C 3.46Å; Y283-N285 VanDerWaalsContact CZ-CA 3.49Å; Y283-N285 WeakPolarHBondContact OH-CA 3.39Å; Y283-S286 WeakPolarHBondContact CE2-OG 3.4Å; Y283-S286 PolarHBondContact OH-N 2.7Å; Y283-S286 PolarHBondContact OH-OG 2.97Å
284	I	88.3	Confident	91.2	Very high	130 Å²	130	82.1 Å²	82.1	67%	0.667	38%	0.382	S	S	*	.			trans	-100.8	-72.2	175	-56.4	174.7	0	0	0	107.6
285	N	93.8	Very high	91	Very high	41 Å²	41	83.2 Å²	83.2	22%	0.219	39%	0.385	C	S	.	.			trans	-152.6	177.9	176.1	58.4	47.7	0	0	0	110.1	E270 V271 Y283 G287	E270-N285 HydrophobicContact CB-CB 4.13Å; E270-N285 PolarHBondContact OE1-ND2 2.78Å; V271-N285 WeakPolarHBondContact O-CB 3.44Å; Y283-N285 WeakPolarHBondContact CE2-O 3.46Å; Y283-N285 VanDerWaalsContact CZ-C 3.46Å; Y283-N285 VanDerWaalsContact CZ-CA 3.49Å; Y283-N285 WeakPolarHBondContact OH-CA 3.39Å; N285-G287 PolarHBondContact OD1-N 2.81Å; N285-G287 VanDerWaalsContact OD1-N 3.09Å; N285-G287 PolarHBondContact OD1-O 3.26Å
286	S	95.9	Very high	90.8	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	37%	0.366	C	S	.	.	S	Bend	trans	-106.6	33.3	174.9	-58.8	0	0	0	0	110.2	L173 D174 I249 V271 Y283	L173-S286 WeakPolarHBondContact CA-O 3.4Å; D174-S286 PolarHBondContact N-O 3.11Å; D174-S286 PolarHBondContact OD2-OG 2.96Å; I249-S286 PolarHBondContact O-OG 3.42Å; V271-S286 PolarHBondContact O-N 2.59Å; Y283-S286 WeakPolarHBondContact CE2-OG 3.4Å; Y283-S286 PolarHBondContact OH-N 2.7Å; Y283-S286 PolarHBondContact OH-OG 2.97Å
287	G	95.8	Very high	90.4	Very high	3 Å²	3	80.8 Å²	80.8	3%	0.031	38%	0.38	C	S	.	.			trans	107.7	-177.8	-170.5	0	0	0	0	0	113.2	N171 K172 V271 N285	N171-G287 WeakPolarHBondContact O-CA 3.23Å; K172-G287 WeakPolarHBondContact O-CA 3.4Å; V271-G287 WeakPolarHBondContact CB-O 3.38Å; V271-G287 PolarHBondContact N-O 2.76Å; N285-G287 PolarHBondContact OD1-N 2.81Å; N285-G287 VanDerWaalsContact OD1-N 3.09Å; N285-G287 PolarHBondContact OD1-O 3.26Å
288	T	96.1	Very high	89.8	Confident	22 Å²	22	77.3 Å²	77.3	14%	0.135	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.9	179.8	57.5	0	0	0	0	110.6	A170 N171 L268 Y269	A170-T288 CarbonylContact C-O 3.5Å; A170-T288 WeakPolarHBondContact CA-O 3.44Å; A170-T288 WeakPolarHBondContact CB-O 3.49Å; N171-T288 PolarHBondContact N-O 3.34Å; N171-T288 PolarHBondContact O-N 3.15Å; L268-T288 HydrophobicContact CD2-CG2 3.9Å; L268-T288 HydrophobicContact CG-CG2 4.41Å; Y269-T288 CarbonylContact O-C 3.57Å; Y269-T288 VanDerWaalsContact O-CA 3.28Å; Y269-T288 WeakPolarHBondContact O-CA 3.24Å
289	V	95.8	Very high	89.2	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.6	171.7	168.6	0	0	0	0	108.8	F168 C169 A170 M186 V237 F252 L268 Y269 V271	F168-V289 HydrophobicContact CB-CG1 4.37Å; F168-V289 HydrophobicContact CD1-CG1 3.59Å; F168-V289 HydrophobicContact CE1-CG1 4.31Å; F168-V289 HydrophobicContact CG-CG1 4.35Å; C169-V289 CarbonylContact O-C 3.4Å; C169-V289 WeakPolarHBondContact O-CA 3.42Å; A170-V289 HydrophobicContact CB-CG2 3.85Å; M186-V289 HydrophobicContact CE-CG1 4.19Å; M186-V289 HydrophobicContact SD-CG1 4.27Å; M186-V289 HydrophobicContact SD-CG2 4.42Å; V237-V289 HydrophobicContact CG2-CG2 4.24Å; F252-V289 HydrophobicContact CD1-CB 4.48Å; F252-V289 HydrophobicContact CE1-CB 3.82Å; F252-V289 HydrophobicContact CE1-CG1 3.82Å; F252-V289 HydrophobicContact CE1-CG2 3.94Å; F252-V289 HydrophobicContact CZ-CB 4.25Å; F252-V289 HydrophobicContact CZ-CG1 3.82Å; L268-V289 CarbonylContact C-O 3.5Å; L268-V289 WeakPolarHBondContact CA-O 3.27Å; Y269-V289 PolarHBondContact N-O 3.23Å; Y269-V289 PolarHBondContact O-N 3.16Å; V271-V289 HydrophobicContact CG2-CB 4.32Å; V271-V289 HydrophobicContact CG2-CG2 3.59Å
290	S	93.6	Very high	88.9	Confident	16 Å²	16	67.3 Å²	67.3	11%	0.112	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.9	176.8	-61.4	0	0	0	0	110.6	F168 C169 H267 L292	F168-S290 WeakPolarHBondContact CA-O 3.28Å; C169-S290 PolarHBondContact N-O 3.21Å; C169-S290 PolarHBondContact O-N 2.92Å; H267-S290 VanDerWaalsContact O-CA 3.31Å; H267-S290 WeakPolarHBondContact O-CA 3.22Å; S290-L292 PolarHBondContact O-N 3.36Å
291	L	92.6	Very high	88.8	Confident	14 Å²	14	62.8 Å²	62.8	7%	0.073	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	113.1	170.4	179.8	68.7	0	0	0	108.4	M166 F168 L259 H267 Y269 S293 F294	M166-L291 HydrophobicContact CB-CD1 3.93Å; F168-L291 HydrophobicContact CD1-CB 4.1Å; F168-L291 HydrophobicContact CD1-CD1 4.14Å; F168-L291 HydrophobicContact CD2-CD1 4.27Å; F168-L291 HydrophobicContact CE1-CB 3.79Å; F168-L291 HydrophobicContact CE1-CD1 3.64Å; F168-L291 HydrophobicContact CE1-CG 4.29Å; F168-L291 HydrophobicContact CE2-CD1 3.78Å; F168-L291 HydrophobicContact CG-CD1 4.45Å; F168-L291 HydrophobicContact CZ-CB 4.44Å; F168-L291 HydrophobicContact CZ-CD1 3.45Å; F168-L291 VanDerWaalsContact CZ-CD1 3.45Å; F168-L291 HydrophobicContact CZ-CG 4.47Å; L259-L291 HydrophobicContact CD2-CD1 4.45Å; L259-L291 HydrophobicContact CD2-CD2 3.72Å; H267-L291 HydrophobicContact CB-CB 3.87Å; H267-L291 HydrophobicContact CB-CD2 4.26Å; H267-L291 PolarHBondContact O-N 2.82Å; H267-L291 VanDerWaalsContact O-N 3.13Å; Y269-L291 HydrophobicContact CE2-CB 4.48Å; L291-S293 VanDerWaalsContact CD1-O 3.3Å; L291-S293 WeakPolarHBondContact CD1-O 3.36Å; L291-F294 HydrophobicContact CD1-CB 4.32Å; L291-F294 HydrophobicContact CD2-CB 3.9Å; L291-F294 HydrophobicContact CD2-CD2 4.48Å; L291-F294 HydrophobicContact CD2-CG 4.48Å; L291-F294 HydrophobicContact CG-CB 4.32Å
292	L	91.2	Very high	89.1	Confident	85 Å²	85	52.7 Å²	52.7	45%	0.445	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-41.3	-179.7	-65.5	-178.7	0	0	0	111.7	Q167 C169 V213 S290	Q167-L292 HydrophobicContact CB-CB 4.28Å; Q167-L292 HydrophobicContact CG-CB 4.49Å; Q167-L292 HydrophobicContact CG-CD1 4.19Å; Q167-L292 WeakPolarHBondContact O-CB 3.18Å; Q167-L292 PolarHBondContact O-N 3.4Å; C169-L292 HydrophobicContact CB-CD1 3.97Å; C169-L292 HydrophobicContact CB-CG 4.28Å; V213-L292 HydrophobicContact CG1-CD1 4.1Å; S290-L292 PolarHBondContact O-N 3.36Å
293	S	90.1	Very high	89	Confident	38 Å²	38	41.3 Å²	41.3	27%	0.266	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	144.8	178.3	63.2	0	0	0	0	110.5	M166 Q167 L291	M166-S293 WeakPolarHBondContact CA-O 3.47Å; Q167-S293 WeakPolarHBondContact CB-OG 3.3Å; Q167-S293 PolarHBondContact N-O 2.84Å; Q167-S293 PolarHBondContact O-N 3.16Å; L291-S293 VanDerWaalsContact CD1-O 3.3Å; L291-S293 WeakPolarHBondContact CD1-O 3.36Å
294	F	89.9	Confident	88.9	Confident	24 Å²	24	41.3 Å²	41.3	11%	0.105	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	117.9	169.1	-172.9	-94	0	0	0	107.8	A164 T165 M166 Y256 L259 C260 L291 V296	A164-F294 HydrophobicContact CB-CE2 3.68Å; A164-F294 HydrophobicContact CB-CZ 3.72Å; T165-F294 WeakPolarHBondContact O-CA 3.15Å; M166-F294 HydrophobicContact CB-CD2 4.03Å; M166-F294 HydrophobicContact CE-CD2 4.16Å; M166-F294 HydrophobicContact CE-CE2 3.71Å; Y256-F294 AromaticContact CD2-CZ 3.96Å; Y256-F294 HydrophobicContact CD2-CZ 3.96Å; Y256-F294 HydrophobicContact CE2-CE1 4.27Å; Y256-F294 AromaticContact CE2-CZ 3.8Å; Y256-F294 HydrophobicContact CE2-CZ 3.8Å; L259-F294 HydrophobicContact CB-CD2 3.78Å; L259-F294 HydrophobicContact CB-CE1 4.29Å; L259-F294 HydrophobicContact CB-CE2 3.49Å; L259-F294 VanDerWaalsContact CB-CE2 3.49Å; L259-F294 HydrophobicContact CB-CG 4.3Å; L259-F294 HydrophobicContact CB-CZ 3.77Å; L259-F294 HydrophobicContact CD1-CE2 3.95Å; L259-F294 HydrophobicContact CG-CE2 4.25Å; L259-F294 WeakPolarHBondContact O-CD1 3.28Å; L259-F294 WeakPolarHBondContact O-CG 3.4Å; C260-F294 HydrophobicContact CB-CD1 4.36Å; C260-F294 HydrophobicContact CB-CE1 3.85Å; L291-F294 HydrophobicContact CD1-CB 4.32Å; L291-F294 HydrophobicContact CD2-CB 3.9Å; L291-F294 HydrophobicContact CD2-CD2 4.48Å; L291-F294 HydrophobicContact CD2-CG 4.48Å; L291-F294 HydrophobicContact CG-CB 4.32Å; F294-V296 HydrophobicContact CD1-CG2 4.07Å; F294-V296 HydrophobicContact CE1-CG2 3.33Å; F294-V296 HydrophobicContact CZ-CG2 3.89Å
295	N	89.2	Confident	88.9	Confident	73 Å²	73	35.3 Å²	35.3	39%	0.39	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.3	178.4	-171.7	34.5	0	0	0	108.4	A164 T165 E297	A164-N295 CarbonylContact C-O 3.58Å; A164-N295 WeakPolarHBondContact CA-O 3.49Å; T165-N295 PolarHBondContact N-O 3.43Å; T165-N295 PolarHBondContact O-N 3.15Å; N295-E297 VanDerWaalsContact ND2-CD 3.27Å; N295-E297 VanDerWaalsContact ND2-CG 3.34Å; N295-E297 WeakPolarHBondContact ND2-CG 3.36Å; N295-E297 PolarHBondContact ND2-OE1 3.25Å
296	V	86.9	Confident	88.7	Confident	48 Å²	48	34 Å²	34	29%	0.291	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.6	177.3	-178.3	0	0	0	0	107.1	D162 Y163 V221 Y256 F294	D162-V296 HydrophobicContact CB-CG1 3.75Å; Y163-V296 WeakPolarHBondContact O-CA 3.48Å; V221-V296 HydrophobicContact CG2-CG1 4.33Å; Y256-V296 HydrophobicContact CE2-CG2 4.09Å; Y256-V296 WeakPolarHBondContact OH-CG2 3.26Å; F294-V296 HydrophobicContact CD1-CG2 4.07Å; F294-V296 HydrophobicContact CE1-CG2 3.33Å; F294-V296 HydrophobicContact CZ-CG2 3.89Å
297	E	82.1	Confident	88.1	Confident	102 Å²	102	35.3 Å²	35.3	48%	0.477	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.7	178	-61.7	-172.8	157.9	0	0	108.5	D162 Y163 N295 E299	D162-E297 WeakPolarHBondContact CA-O 3.5Å; Y163-E297 PolarHBondContact N-O 3.32Å; Y163-E297 PolarHBondContact O-N 3.49Å; N295-E297 VanDerWaalsContact ND2-CD 3.27Å; N295-E297 VanDerWaalsContact ND2-CG 3.34Å; N295-E297 WeakPolarHBondContact ND2-CG 3.36Å; N295-E297 PolarHBondContact ND2-OE1 3.25Å; E297-E299 PolarHBondContact O-N 3.33Å
298	S	78	Confident	87.6	Confident	63 Å²	63	35.5 Å²	35.5	44%	0.441	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	124.6	168.8	-54.2	0	0	0	0	108.4	D162 H300	D162-S298 WeakPolarHBondContact OD1-CA 3.42Å; D162-S298 WeakPolarHBondContact OD1-CB 3.47Å; D162-S298 PolarHBondContact OD1-OG 3.33Å; S298-H300 PolarHBondContact O-N 3.21Å
299	E	77.1	Confident	87.2	Confident	75 Å²	75	36.5 Å²	36.5	35%	0.35	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-69.9	117.9	169.7	-178.1	161.3	-134.3	0	0	108.9	R161 Y163 E297 K544	R161-E299 WeakPolarHBondContact O-CB 3.45Å; R161-E299 PolarHBondContact O-N 3.07Å; Y163-E299 HydrophobicContact CD2-CB 3.9Å; Y163-E299 HydrophobicContact CE2-CB 3.87Å; Y163-E299 HydrophobicContact CE2-CG 4.49Å; Y163-E299 WeakPolarHBondContact CE2-OE2 3.03Å; Y163-E299 PolarHBondContact OH-OE2 3.16Å; E297-E299 PolarHBondContact O-N 3.33Å; E299-K544 IonicContact OE1-NZ 3.47Å; E299-K544 PolarHBondContact OE1-NZ 2.68Å
300	H	84.1	Confident	87	Confident	51 Å²	51	36.9 Å²	36.9	24%	0.236	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-81.3	127.9	178.5	-61.1	-52.3	0	0	0	110.3	S298 D304 Y305 P550	S298-H300 PolarHBondContact O-N 3.21Å; H300-D304 WeakPolarHBondContact CA-OD2 3.16Å; H300-Y305 HydrophobicContact CB-CE2 3.7Å; H300-P550 HydrophobicContact CB-CG 3.74Å; H300-P550 WeakPolarHBondContact CD2-CD 3.39Å
301	T	85.1	Confident	86.8	Confident	28 Å²	28	39.2 Å²	39.2	17%	0.172	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-87.5	167.1	176.2	71.6	0	0	0	0	110.6	E156 L303 D304 Y305	E156-T301 PolarHBondContact OE2-OG1 3.43Å; T301-L303 VanDerWaalsContact C-N 3.27Å; T301-L303 PolarHBondContact O-N 2.96Å; T301-L303 PolarHBondContact OG1-N 3.44Å; T301-D304 PolarHBondContact N-OD2 2.95Å; T301-D304 WeakPolarHBondContact O-CB 3.28Å; T301-D304 PolarHBondContact O-N 3.04Å; T301-D304 VanDerWaalsContact O-N 3.16Å; T301-D304 PolarHBondContact OG1-N 3.49Å; T301-D304 PolarHBondContact OG1-OD2 3.05Å; T301-Y305 VanDerWaalsContact O-CD2 3.24Å; T301-Y305 WeakPolarHBondContact O-CD2 3.07Å; T301-Y305 PolarHBondContact O-N 3.4Å
302	F	87.8	Confident	86.8	Confident	12 Å²	12	38.5 Å²	38.5	5%	0.053	22%	0.215	C	C	.	.	H	α-helix	trans	-53.2	-45.5	170.6	171	-102.2	0	0	0	111.9	F91 D304 Y305 I306 I312 Y358 P536 L539 I540	F91-F302 AromaticContact CD2-CE1 3.6Å; F91-F302 HydrophobicContact CD2-CE1 3.6Å; F91-F302 AromaticContact CD2-CZ 3.64Å; F91-F302 HydrophobicContact CD2-CZ 3.64Å; F91-F302 HydrophobicContact CE2-CE1 4.06Å; F91-F302 AromaticContact CE2-CZ 3.61Å; F91-F302 HydrophobicContact CE2-CZ 3.61Å; F91-F302 HydrophobicContact CG-CE1 4.37Å; F91-F302 HydrophobicContact CZ-CZ 4.46Å; F302-D304 VanDerWaalsContact C-N 3.29Å; F302-D304 PolarHBondContact O-N 3.45Å; F302-Y305 PolarHBondContact O-N 2.72Å; F302-Y305 VanDerWaalsContact O-N 3.15Å; F302-I306 HydrophobicContact CD1-CG1 4.17Å; F302-I306 HydrophobicContact CE1-CD1 4.34Å; F302-I306 HydrophobicContact CE1-CG1 3.72Å; F302-I306 HydrophobicContact CE2-CD1 4.06Å; F302-I306 HydrophobicContact CE2-CG1 4.15Å; F302-I306 HydrophobicContact CZ-CD1 3.81Å; F302-I306 HydrophobicContact CZ-CG1 3.72Å; F302-I306 PolarHBondContact O-N 2.93Å; F302-I306 VanDerWaalsContact O-N 3.16Å; F302-I312 HydrophobicContact CE2-CD1 3.75Å; F302-I312 HydrophobicContact CZ-CD1 3.64Å; F302-Y358 HydrophobicContact CE1-CE1 4.27Å; F302-Y358 HydrophobicContact CZ-CD1 4.47Å; F302-P536 HydrophobicContact CB-CB 3.92Å; F302-P536 HydrophobicContact CD1-CB 4.46Å; F302-P536 HydrophobicContact CD2-CB 3.89Å; F302-P536 HydrophobicContact CD2-CG 4.39Å; F302-P536 HydrophobicContact CG-CB 3.85Å; F302-P536 HydrophobicContact CG-CG 4.38Å; F302-L539 HydrophobicContact CD2-CD1 4.2Å; F302-L539 HydrophobicContact CD2-CD2 4.45Å; F302-L539 HydrophobicContact CE2-CD1 3.95Å; F302-I540 HydrophobicContact CB-CD1 4.05Å; F302-I540 HydrophobicContact CB-CG1 4.41Å
303	L	86.3	Confident	86.8	Confident	4 Å²	4	36 Å²	36	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-66.4	-28.2	-179.7	-69.6	-174.2	0	0	0	113.1	T28 V30 Y89 V128 E156 T301 Y305 I306 K307	T28-L303 HydrophobicContact CG2-CD1 3.79Å; V30-L303 HydrophobicContact CG2-CD1 4.05Å; Y89-L303 HydrophobicContact CD1-CD1 3.86Å; Y89-L303 HydrophobicContact CD1-CD2 4.4Å; Y89-L303 HydrophobicContact CD1-CG 4.35Å; Y89-L303 HydrophobicContact CE1-CD1 3.97Å; Y89-L303 HydrophobicContact CE1-CD2 3.67Å; Y89-L303 HydrophobicContact CE1-CG 3.98Å; V128-L303 HydrophobicContact CB-CD2 4.11Å; V128-L303 HydrophobicContact CG2-CD2 4.16Å; E156-L303 HydrophobicContact CB-CD1 4.27Å; E156-L303 HydrophobicContact CG-CD1 4Å; T301-L303 VanDerWaalsContact C-N 3.27Å; T301-L303 PolarHBondContact O-N 2.96Å; T301-L303 PolarHBondContact OG1-N 3.44Å; L303-Y305 VanDerWaalsContact C-N 3.31Å; L303-Y305 PolarHBondContact O-N 3.02Å; L303-I306 PolarHBondContact O-N 3.44Å; L303-K307 VanDerWaalsContact O-CB 3.25Å; L303-K307 WeakPolarHBondContact O-CB 3.42Å; L303-K307 VanDerWaalsContact O-CG 3.27Å; L303-K307 WeakPolarHBondContact O-CG 3.37Å; L303-K307 PolarHBondContact O-N 3.32Å
304	D	86.5	Confident	87	Confident	39 Å²	39	34.2 Å²	34.2	21%	0.209	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-41.6	173.7	-65.2	-33.4	0	0	0	110.9	R161 H300 T301 F302 G308 P550	R161-D304 IonicContact NH1-OD1 3.07Å; R161-D304 PolarHBondContact NH1-OD1 2.95Å; R161-D304 IonicContact NH1-OD2 2.97Å; R161-D304 PolarHBondContact NH1-OD2 3.41Å; H300-D304 WeakPolarHBondContact CA-OD2 3.16Å; T301-D304 PolarHBondContact N-OD2 2.95Å; T301-D304 WeakPolarHBondContact O-CB 3.28Å; T301-D304 PolarHBondContact O-N 3.04Å; T301-D304 VanDerWaalsContact O-N 3.16Å; T301-D304 PolarHBondContact OG1-N 3.49Å; T301-D304 PolarHBondContact OG1-OD2 3.05Å; F302-D304 VanDerWaalsContact C-N 3.29Å; F302-D304 PolarHBondContact O-N 3.45Å; D304-G308 PolarHBondContact O-N 2.74Å; D304-P550 HydrophobicContact CB-CB 4.2Å; D304-P550 HydrophobicContact CB-CG 3.78Å
305	Y	89.9	Confident	87.3	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-43.6	176.4	-71.7	-79.8	0	0	0	112.4	H300 T301 F302 L303 G308 G309 T310 L539 M543 I548 P550	H300-Y305 HydrophobicContact CB-CE2 3.7Å; T301-Y305 VanDerWaalsContact O-CD2 3.24Å; T301-Y305 WeakPolarHBondContact O-CD2 3.07Å; T301-Y305 PolarHBondContact O-N 3.4Å; F302-Y305 PolarHBondContact O-N 2.72Å; F302-Y305 VanDerWaalsContact O-N 3.15Å; L303-Y305 VanDerWaalsContact C-N 3.31Å; L303-Y305 PolarHBondContact O-N 3.02Å; Y305-G308 CarbonylContact O-C 3.48Å; Y305-G308 PolarHBondContact O-N 3.35Å; Y305-G309 PolarHBondContact O-N 3.04Å; Y305-T310 WeakPolarHBondContact O-CB 3.49Å; Y305-T310 PolarHBondContact O-N 3.24Å; Y305-T310 PolarHBondContact O-OG1 3.09Å; Y305-L539 HydrophobicContact CD2-CD2 4.14Å; Y305-L539 HydrophobicContact CG-CD2 4.17Å; Y305-M543 HydrophobicContact CD1-CB 4.49Å; Y305-M543 HydrophobicContact CD1-CE 4Å; Y305-M543 HydrophobicContact CD1-CG 3.86Å; Y305-M543 HydrophobicContact CD1-SD 4.11Å; Y305-M543 HydrophobicContact CD2-CG 4.42Å; Y305-M543 HydrophobicContact CE1-CB 3.65Å; Y305-M543 HydrophobicContact CE1-CE 4.42Å; Y305-M543 HydrophobicContact CE1-CG 3.49Å; Y305-M543 VanDerWaalsContact CE1-CG 3.49Å; Y305-M543 HydrophobicContact CE1-SD 3.91Å; Y305-M543 HydrophobicContact CE2-CB 4.06Å; Y305-M543 HydrophobicContact CE2-CG 4.12Å; Y305-M543 HydrophobicContact CG-CG 4.32Å; Y305-M543 VanDerWaalsContact CZ-CB 3.41Å; Y305-M543 VanDerWaalsContact OH-CB 3.3Å; Y305-M543 WeakPolarHBondContact OH-CB 3.49Å; Y305-I548 HydrophobicContact CE1-CG2 4.35Å; Y305-I548 PolarHBondContact OH-O 3.32Å; Y305-P550 HydrophobicContact CD1-CB 4.19Å; Y305-P550 HydrophobicContact CD1-CG 3.86Å; Y305-P550 HydrophobicContact CD2-CG 4.13Å; Y305-P550 HydrophobicContact CE1-CB 4.38Å; Y305-P550 HydrophobicContact CE1-CG 3.73Å; Y305-P550 HydrophobicContact CE2-CG 3.99Å; Y305-P550 HydrophobicContact CG-CB 4.49Å; Y305-P550 HydrophobicContact CG-CG 4.05Å
306	I	88.5	Confident	87.6	Confident	12 Å²	12	30 Å²	30	6%	0.062	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-44.8	176.2	-59.5	-55.5	0	0	0	110.7	F302 L303 G308 G309 I312 Y358	F302-I306 HydrophobicContact CD1-CG1 4.17Å; F302-I306 HydrophobicContact CE1-CD1 4.34Å; F302-I306 HydrophobicContact CE1-CG1 3.72Å; F302-I306 HydrophobicContact CE2-CD1 4.06Å; F302-I306 HydrophobicContact CE2-CG1 4.15Å; F302-I306 HydrophobicContact CZ-CD1 3.81Å; F302-I306 HydrophobicContact CZ-CG1 3.72Å; F302-I306 PolarHBondContact O-N 2.93Å; F302-I306 VanDerWaalsContact O-N 3.16Å; L303-I306 PolarHBondContact O-N 3.44Å; I306-G308 VanDerWaalsContact C-N 3.29Å; I306-G308 PolarHBondContact O-N 3.2Å; I306-G309 WeakPolarHBondContact O-CA 3.12Å; I306-G309 PolarHBondContact O-N 3.22Å; I306-I312 HydrophobicContact CD1-CD1 3.93Å; I306-I312 HydrophobicContact CD1-CG1 4.08Å; I306-Y358 HydrophobicContact CD1-CD1 4.49Å; I306-Y358 HydrophobicContact CG2-CD1 4.42Å
307	K	83.6	Confident	88.1	Confident	29 Å²	29	27.8 Å²	27.8	13%	0.126	15%	0.154	C	C	.	.	H	α-helix	trans	-61	-36.8	174.1	-80.5	173.4	176	-174.1	0	113.3	S133 A154 L303 G309	S133-K307 WeakPolarHBondContact OG-CE 3.47Å; S133-K307 WeakPolarHBondContact OG-CG 3.35Å; A154-K307 VanDerWaalsContact O-CE 3.28Å; A154-K307 WeakPolarHBondContact O-CE 3.04Å; A154-K307 PolarHBondContact O-NZ 2.77Å; L303-K307 VanDerWaalsContact O-CB 3.25Å; L303-K307 WeakPolarHBondContact O-CB 3.42Å; L303-K307 VanDerWaalsContact O-CG 3.27Å; L303-K307 WeakPolarHBondContact O-CG 3.37Å; L303-K307 PolarHBondContact O-N 3.32Å; K307-G309 PolarHBondContact O-N 3.35Å
308	G	85.8	Confident	88.9	Confident	6 Å²	6	22.9 Å²	22.9	6%	0.062	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-1.4	172.2	0	0	0	0	0	114	D304 Y305 I306 N551	D304-G308 PolarHBondContact O-N 2.74Å; Y305-G308 CarbonylContact O-C 3.48Å; Y305-G308 PolarHBondContact O-N 3.35Å; I306-G308 VanDerWaalsContact C-N 3.29Å; I306-G308 PolarHBondContact O-N 3.2Å; G308-N551 WeakPolarHBondContact CA-O 3.08Å; G308-N551 WeakPolarHBondContact O-CB 3.46Å; G308-N551 PolarHBondContact O-ND2 3.31Å
309	G	87.8	Confident	89.8	Confident	44 Å²	44	19.9 Å²	19.9	45%	0.454	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	18.2	177.3	0	0	0	0	0	114.6	Y305 I306 K307 Q311	Y305-G309 PolarHBondContact O-N 3.04Å; I306-G309 WeakPolarHBondContact O-CA 3.12Å; I306-G309 PolarHBondContact O-N 3.22Å; K307-G309 PolarHBondContact O-N 3.35Å; G309-Q311 PolarHBondContact O-N 2.74Å
310	T	91	Very high	90.7	Very high	7 Å²	7	16.3 Å²	16.3	4%	0.043	9%	0.093	C	C	.	.			trans	-64.9	123	169.3	-54.5	0	0	0	0	109.1	Y305 G436 S437 L539 M543	Y305-T310 WeakPolarHBondContact O-CB 3.49Å; Y305-T310 PolarHBondContact O-N 3.24Å; Y305-T310 PolarHBondContact O-OG1 3.09Å; T310-G436 VanDerWaalsContact CG2-O 3.31Å; T310-G436 WeakPolarHBondContact CG2-O 3.36Å; T310-G436 PolarHBondContact OG1-O 2.82Å; T310-S437 WeakPolarHBondContact CA-O 3.42Å; T310-L539 HydrophobicContact CG2-CD1 4.47Å; T310-M543 HydrophobicContact CG2-CE 3.89Å
311	Q	89.5	Confident	91.3	Very high	65 Å²	65	14 Å²	14	30%	0.304	8%	0.083	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	141	178	-60.7	-164.6	-15	0	0	111.2	G309 H313 S360 S437 Y439	G309-Q311 PolarHBondContact O-N 2.74Å; Q311-H313 PolarHBondContact OE1-CE1 3.22Å; Q311-S360 PolarHBondContact NE2-OG 2.88Å; Q311-S437 PolarHBondContact N-O 2.81Å; Q311-Y439 PolarHBondContact O-N 3.14Å
312	I	91.9	Very high	91.7	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	108.5	172.8	-58.6	-177.1	0	0	0	108.4	F91 F302 I306 I355 Y358 Y439 V441 L539	F91-I312 HydrophobicContact CE2-CD1 4.41Å; F302-I312 HydrophobicContact CE2-CD1 3.75Å; F302-I312 HydrophobicContact CZ-CD1 3.64Å; I306-I312 HydrophobicContact CD1-CD1 3.93Å; I306-I312 HydrophobicContact CD1-CG1 4.08Å; I312-I355 HydrophobicContact CG2-CD1 4.27Å; I312-I355 HydrophobicContact CG2-CG1 4.27Å; I312-Y358 HydrophobicContact CD1-CG 4.4Å; I312-Y358 PolarHBondContact N-O 3.19Å; I312-Y439 CarbonylContact C-O 3.57Å; I312-Y439 WeakPolarHBondContact CA-O 3.39Å; I312-V441 HydrophobicContact CG2-CB 4.47Å; I312-V441 HydrophobicContact CG2-CG2 3.69Å; I312-L539 HydrophobicContact CD1-CD1 4.5Å
313	H	92.5	Very high	92	Very high	32 Å²	32	18.4 Å²	18.4	15%	0.148	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	121	177.1	-65.1	-58.9	0	0	0	110.6	Q311 D359 Q438 Y439 F440 V441	Q311-H313 PolarHBondContact OE1-CE1 3.22Å; H313-D359 IonicContact ND1-OD2 3.57Å; H313-Q438 VanDerWaalsContact NE2-CD 3.31Å; H313-Q438 WeakPolarHBondContact NE2-CG 3.25Å; H313-Q438 PolarHBondContact NE2-OE1 3.45Å; H313-Y439 PolarHBondContact N-O 3.18Å; H313-F440 HydrophobicContact CB-CD1 3.73Å; H313-F440 HydrophobicContact CB-CE1 3.98Å; H313-F440 HydrophobicContact CB-CG 4.44Å; H313-F440 AromaticContact CD2-CE1 3.72Å; H313-F440 AromaticContact CD2-CZ 3.88Å; H313-V441 PolarHBondContact O-N 3.21Å
314	F	93.6	Very high	92.4	Very high	1 Å²	1	18.4 Å²	18.4	0%	0.004	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.4	-178.1	-176.1	-121.8	0	0	0	111.8	V316 V351 I355 F364 P365 M397 V441 L443	F314-V316 HydrophobicContact CD1-CG2 4.1Å; F314-V316 HydrophobicContact CE1-CG2 3.47Å; F314-V316 VanDerWaalsContact CE1-CG2 3.47Å; F314-V316 HydrophobicContact CZ-CG2 3.86Å; F314-V351 HydrophobicContact CE2-CG1 4.19Å; F314-V351 HydrophobicContact CZ-CG1 4.02Å; F314-I355 HydrophobicContact CB-CG2 4.1Å; F314-I355 HydrophobicContact CD1-CG2 3.58Å; F314-I355 HydrophobicContact CD2-CD1 3.67Å; F314-I355 HydrophobicContact CD2-CG1 4.32Å; F314-I355 HydrophobicContact CD2-CG2 3.72Å; F314-I355 HydrophobicContact CE1-CG2 3.78Å; F314-I355 HydrophobicContact CE2-CD1 4.12Å; F314-I355 HydrophobicContact CE2-CG2 3.89Å; F314-I355 HydrophobicContact CG-CD1 4.31Å; F314-I355 HydrophobicContact CG-CG2 3.53Å; F314-I355 HydrophobicContact CZ-CG2 3.92Å; F314-F364 HydrophobicContact CB-CD1 3.78Å; F314-F364 HydrophobicContact CB-CE1 3.89Å; F314-F364 HydrophobicContact CD1-CD1 4.13Å; F314-F364 HydrophobicContact CD1-CE1 4.44Å; F314-F364 HydrophobicContact CD1-CG 4.5Å; F314-F364 HydrophobicContact CG-CD1 4.47Å; F314-F364 WeakPolarHBondContact O-CD1 3.48Å; F314-P365 WeakPolarHBondContact O-CD 3.44Å; F314-M397 HydrophobicContact CE1-SD 4.48Å; F314-V441 HydrophobicContact CD2-CB 4.23Å; F314-V441 HydrophobicContact CD2-CG1 4.1Å; F314-V441 HydrophobicContact CE2-CG1 4.35Å; F314-L443 HydrophobicContact CE2-CB 3.59Å; F314-L443 HydrophobicContact CE2-CD2 4.38Å; F314-L443 HydrophobicContact CZ-CB 3.68Å; F314-L443 HydrophobicContact CZ-CD2 3.67Å; F314-L443 HydrophobicContact CZ-CG 4.32Å
315	T	95.6	Very high	92.7	Very high	9 Å²	9	17.9 Å²	17.9	6%	0.055	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.3	175.2	-63.8	0	0	0	0	109.9	P365 L367 V426 V441 L442 L443	T315-P365 HydrophobicContact CG2-CB 4.1Å; T315-L367 HydrophobicContact CG2-CD1 4.17Å; T315-V426 HydrophobicContact CG2-CG2 3.81Å; T315-V441 PolarHBondContact N-O 2.74Å; T315-L442 HydrophobicContact CG2-CD1 3.97Å; T315-L442 CarbonylContact O-C 3.59Å; T315-L442 WeakPolarHBondContact O-CA 3.36Å; T315-L443 PolarHBondContact O-N 3.17Å
316	V	96.6	Very high	92.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.9	177.9	176.7	0	0	0	0	109.7	F314 I318 L348 P365 L367 I400 L443	F314-V316 HydrophobicContact CD1-CG2 4.1Å; F314-V316 HydrophobicContact CE1-CG2 3.47Å; F314-V316 VanDerWaalsContact CE1-CG2 3.47Å; F314-V316 HydrophobicContact CZ-CG2 3.86Å; V316-I318 HydrophobicContact CG1-CD1 4.23Å; V316-I318 HydrophobicContact CG1-CG1 3.76Å; V316-L348 HydrophobicContact CB-CD2 4.38Å; V316-L348 HydrophobicContact CG1-CD2 3.28Å; V316-L348 HydrophobicContact CG2-CD2 4.18Å; V316-P365 PolarHBondContact N-O 3.39Å; V316-L367 PolarHBondContact O-N 3.44Å; V316-I400 HydrophobicContact CG2-CD1 4.07Å; V316-L443 CarbonylContact C-O 3.51Å
317	A	97.5	Very high	93	Very high	0 Å²	0	22 Å²	22	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	117.4	170.7	0	0	0	0	0	110.1	L367 F369 V422 L442 L443 I444 I445	A317-L367 CarbonylContact C-O 3.56Å; A317-L367 VanDerWaalsContact CA-O 3.31Å; A317-L367 WeakPolarHBondContact CA-O 3.49Å; A317-F369 HydrophobicContact CB-CD1 4.17Å; A317-F369 HydrophobicContact CB-CE1 4.12Å; A317-V422 HydrophobicContact CB-CB 4.09Å; A317-V422 HydrophobicContact CB-CG1 4.08Å; A317-V422 HydrophobicContact CB-CG2 4.11Å; A317-L442 HydrophobicContact CB-CD1 3.93Å; A317-L443 PolarHBondContact N-O 2.58Å; A317-I444 HydrophobicContact CB-CG1 4.3Å; A317-I444 WeakPolarHBondContact O-CA 3.5Å; A317-I445 PolarHBondContact O-N 3.35Å
318	I	97.7	Very high	93.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.2	-177.4	-56.5	-178.4	0	0	0	109.8	V316 F320 Y344 L348 L367 G368 F369 L385 Y404	V316-I318 HydrophobicContact CG1-CD1 4.23Å; V316-I318 HydrophobicContact CG1-CG1 3.76Å; I318-F320 HydrophobicContact CB-CD2 4.15Å; I318-F320 HydrophobicContact CB-CE2 3.79Å; I318-F320 HydrophobicContact CG2-CD2 3.84Å; I318-F320 HydrophobicContact CG2-CE2 3.55Å; I318-F320 WeakPolarHBondContact O-CD2 3.37Å; I318-F320 PolarHBondContact O-N 3.22Å; I318-Y344 HydrophobicContact CG2-CD1 3.7Å; I318-Y344 HydrophobicContact CG2-CE1 3.94Å; I318-L348 HydrophobicContact CD1-CD1 3.73Å; I318-L348 HydrophobicContact CD1-CD2 4.22Å; I318-L348 HydrophobicContact CD1-CG 4.47Å; I318-L348 HydrophobicContact CG1-CD2 4.48Å; I318-L367 PolarHBondContact N-O 2.93Å; I318-G368 CarbonylContact O-C 3.48Å; I318-G368 VanDerWaalsContact O-CA 3.28Å; I318-G368 WeakPolarHBondContact O-CA 3.31Å; I318-F369 VanDerWaalsContact O-CD1 3.27Å; I318-F369 WeakPolarHBondContact O-CD1 3.38Å; I318-F369 PolarHBondContact O-N 3.08Å; I318-L385 HydrophobicContact CD1-CD1 3.58Å; I318-L385 HydrophobicContact CG1-CD1 4.13Å; I318-Y404 HydrophobicContact CD1-CD2 3.53Å; I318-Y404 HydrophobicContact CD1-CE2 4.21Å; I318-Y404 HydrophobicContact CD1-CG 3.94Å; I318-Y404 HydrophobicContact CG2-CD2 4.1Å; I318-Y404 HydrophobicContact CG2-CE2 3.91Å
319	D	97.1	Very high	93.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	124	172.1	-167.4	-21.5	0	0	0	110.7	T321 H334 Y344 F369 T417 I445 T446	D319-T321 WeakPolarHBondContact OD1-CB 3.18Å; D319-T321 WeakPolarHBondContact OD1-CG2 3.21Å; D319-T321 PolarHBondContact OD1-N 3.09Å; D319-T321 PolarHBondContact OD1-OG1 3.47Å; D319-H334 PolarHBondContact O-CE1 2.78Å; D319-H334 PolarHBondContact O-NE2 2.89Å; D319-Y344 HydrophobicContact CB-CE1 4.22Å; D319-F369 VanDerWaalsContact CA-CZ 3.49Å; D319-F369 HydrophobicContact CB-CE1 4.15Å; D319-F369 HydrophobicContact CB-CE2 3.76Å; D319-F369 HydrophobicContact CB-CZ 3.48Å; D319-F369 VanDerWaalsContact CB-CZ 3.48Å; D319-T417 WeakPolarHBondContact OD2-CG2 3.31Å; D319-I445 WeakPolarHBondContact CB-O 3.4Å; D319-I445 PolarHBondContact N-O 3.4Å; D319-T446 WeakPolarHBondContact OD2-CB 3.33Å; D319-T446 PolarHBondContact OD2-OG1 3.32Å
320	F	96.9	Very high	93.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	21%	0.206	C	C	.	.			trans	-117.3	31.2	174.7	-82.7	-110.5	0	0	0	110.9	I318 F369 A371 F383 L385 Y404 L408 V411 L413 Y414	I318-F320 HydrophobicContact CB-CD2 4.15Å; I318-F320 HydrophobicContact CB-CE2 3.79Å; I318-F320 HydrophobicContact CG2-CD2 3.84Å; I318-F320 HydrophobicContact CG2-CE2 3.55Å; I318-F320 WeakPolarHBondContact O-CD2 3.37Å; I318-F320 PolarHBondContact O-N 3.22Å; F320-F369 PolarHBondContact N-O 3.44Å; F320-A371 HydrophobicContact CB-CB 3.85Å; F320-F383 HydrophobicContact CB-CZ 4.32Å; F320-F383 HydrophobicContact CD1-CZ 4.39Å; F320-F383 HydrophobicContact CD2-CZ 4.11Å; F320-F383 HydrophobicContact CG-CZ 4.05Å; F320-L385 HydrophobicContact CD2-CD2 4.47Å; F320-L385 HydrophobicContact CE2-CD2 3.58Å; F320-L385 HydrophobicContact CZ-CD2 3.87Å; F320-Y404 HydrophobicContact CE2-CD2 4.09Å; F320-Y404 HydrophobicContact CE2-CE2 4.35Å; F320-Y404 AromaticContact CZ-CD2 3.75Å; F320-Y404 HydrophobicContact CZ-CD2 3.75Å; F320-Y404 HydrophobicContact CZ-CE2 4.07Å; F320-L408 HydrophobicContact CD1-CD2 3.81Å; F320-L408 HydrophobicContact CE1-CB 4.32Å; F320-L408 HydrophobicContact CE1-CD2 3.4Å; F320-L408 HydrophobicContact CE1-CG 3.64Å; F320-L408 HydrophobicContact CZ-CD2 4.13Å; F320-L408 HydrophobicContact CZ-CG 4.08Å; F320-V411 HydrophobicContact CD1-CG2 3.44Å; F320-V411 VanDerWaalsContact CD1-CG2 3.44Å; F320-V411 HydrophobicContact CE1-CG2 3.85Å; F320-V411 HydrophobicContact CG-CG2 4.36Å; F320-L413 HydrophobicContact CB-CD2 3.77Å; F320-L413 HydrophobicContact CD1-CD2 3.63Å; F320-L413 HydrophobicContact CG-CD2 4.1Å; F320-L413 WeakPolarHBondContact O-CA 3.47Å; F320-L413 WeakPolarHBondContact O-CB 3.24Å; F320-L413 VanDerWaalsContact O-CD2 3.23Å; F320-L413 WeakPolarHBondContact O-CD2 3.45Å; F320-Y414 PolarHBondContact O-N 3.11Å
321	T	95.9	Very high	93.9	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.012	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-77.7	157.2	179	60.1	0	0	0	0	112.4	D319 S323 N324 Y414 T417	D319-T321 WeakPolarHBondContact OD1-CB 3.18Å; D319-T321 WeakPolarHBondContact OD1-CG2 3.21Å; D319-T321 PolarHBondContact OD1-N 3.09Å; D319-T321 PolarHBondContact OD1-OG1 3.47Å; T321-S323 PolarHBondContact O-N 3.16Å; T321-S323 PolarHBondContact OG1-OG 3.38Å; T321-N324 WeakPolarHBondContact O-CB 3.35Å; T321-N324 PolarHBondContact O-N 3.18Å; T321-N324 PolarHBondContact O-ND2 3.37Å; T321-N324 VanDerWaalsContact O-ND2 3.17Å; T321-N324 PolarHBondContact OG1-ND2 3.41Å; T321-Y414 CarbonylContact C-O 3.58Å; T321-Y414 WeakPolarHBondContact CA-O 3.48Å; T321-Y414 VanDerWaalsContact CB-O 3.28Å; T321-Y414 WeakPolarHBondContact CB-O 3.49Å; T321-T417 HydrophobicContact CG2-CG2 4.36Å; T321-T417 WeakPolarHBondContact CG2-OG1 3.26Å
322	A	94.5	Very high	94.1	Very high	57 Å²	57	35.2 Å²	35.2	47%	0.471	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-69.6	-16.4	-173.9	0	0	0	0	0	113.6	N324 G325 L413 Y414	A322-N324 PolarHBondContact O-N 3.02Å; A322-G325 PolarHBondContact O-N 2.94Å; A322-L413 HydrophobicContact CB-CB 4.5Å; A322-Y414 PolarHBondContact N-O 3Å
323	S	93.6	Very high	94.3	Very high	76 Å²	76	37.5 Å²	37.5	53%	0.531	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-58.6	-27.5	172.5	45.5	0	0	0	0	112.1	T321 G325 D447	T321-S323 PolarHBondContact O-N 3.16Å; T321-S323 PolarHBondContact OG1-OG 3.38Å; S323-G325 PolarHBondContact O-N 3.43Å; S323-G325 VanDerWaalsContact O-N 3.14Å; S323-D447 WeakPolarHBondContact CB-OD2 3.48Å; S323-D447 VanDerWaalsContact OG-CG 3.29Å; S323-D447 PolarHBondContact OG-OD1 2.91Å; S323-D447 PolarHBondContact OG-OD2 2.8Å
324	N	94.4	Very high	94.4	Very high	3 Å²	3	36 Å²	36	2%	0.016	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-66.6	-11.3	175	-73.2	-76.6	0	0	0	114.9	T321 A322 S332 L333 H334 Y344 L413 D447	T321-N324 WeakPolarHBondContact O-CB 3.35Å; T321-N324 PolarHBondContact O-N 3.18Å; T321-N324 PolarHBondContact O-ND2 3.37Å; T321-N324 VanDerWaalsContact O-ND2 3.17Å; T321-N324 PolarHBondContact OG1-ND2 3.41Å; A322-N324 PolarHBondContact O-N 3.02Å; N324-S332 CarbonylContact O-C 3.48Å; N324-S332 WeakPolarHBondContact O-CA 3.26Å; N324-S332 WeakPolarHBondContact O-CB 3.43Å; N324-S332 PolarHBondContact O-OG 3.28Å; N324-L333 HydrophobicContact CB-CB 4.45Å; N324-L333 PolarHBondContact O-N 3.14Å; N324-L333 WeakPolarHBondContact OD1-CB 3.42Å; N324-L333 WeakPolarHBondContact OD1-CD1 3.41Å; N324-H334 VanDerWaalsContact CB-CD2 3.43Å; N324-H334 WeakPolarHBondContact CB-CD2 3.45Å; N324-Y344 PolarHBondContact ND2-OH 2.95Å; N324-Y344 VanDerWaalsContact OD1-CE2 3.26Å; N324-Y344 WeakPolarHBondContact OD1-CE2 3.41Å; N324-Y344 PolarHBondContact OD1-OH 3.46Å; N324-L413 HydrophobicContact CB-CD1 4.37Å; N324-D447 PolarHBondContact N-OD2 2.94Å; N324-D447 PolarHBondContact ND2-OD1 2.87Å; N324-D447 VanDerWaalsContact OD1-CB 3.3Å; N324-D447 WeakPolarHBondContact OD1-CB 3.36Å
325	G	93.3	Very high	94.5	Very high	28 Å²	28	39.7 Å²	39.7	29%	0.289	25%	0.246	S	C	.	.			trans	73.8	170.6	-176.6	0	0	0	0	0	113.5	A322 S323 P327 S332 L413	A322-G325 PolarHBondContact O-N 2.94Å; S323-G325 PolarHBondContact O-N 3.43Å; S323-G325 VanDerWaalsContact O-N 3.14Å; G325-P327 WeakPolarHBondContact O-CD 3.49Å; G325-S332 PolarHBondContact O-OG 3.26Å; G325-S332 VanDerWaalsContact O-OG 3.06Å; G325-L413 WeakPolarHBondContact O-CD1 3.49Å
326	N	91.9	Very high	94.1	Very high	83 Å²	83	42.3 Å²	42.3	44%	0.444	26%	0.258	S	S	.	.			trans	-69.3	122.6	-176.2	-176.8	-33.7	0	0	0	111.2	S328 Q329 S332	N326-S328 PolarHBondContact O-N 3.43Å; N326-S328 VanDerWaalsContact OD1-CB 3.31Å; N326-S328 WeakPolarHBondContact OD1-CB 3.25Å; N326-S328 PolarHBondContact OD1-N 2.87Å; N326-S328 PolarHBondContact OD1-OG 3.12Å; N326-Q329 HydrophobicContact CB-CG 4.15Å; N326-Q329 WeakPolarHBondContact O-CB 3.27Å; N326-Q329 PolarHBondContact O-N 3.47Å; N326-S332 WeakPolarHBondContact O-CB 3.25Å
327	P	93.1	Very high	93.6	Very high	20 Å²	20	44.9 Å²	44.9	13%	0.13	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-17.8	-177.6	-25.9	34.8	0	0	0	115.2	G325 Q329 H334 Y335 L408 L413	G325-P327 WeakPolarHBondContact O-CD 3.49Å; P327-Q329 VanDerWaalsContact C-N 3.3Å; P327-H334 HydrophobicContact CB-CB 4.18Å; P327-H334 HydrophobicContact CG-CB 4.11Å; P327-Y335 WeakPolarHBondContact O-CD2 3.05Å; P327-L408 HydrophobicContact CB-CD2 4.5Å; P327-L408 HydrophobicContact CG-CD2 3.99Å; P327-L413 HydrophobicContact CG-CD1 3.85Å; P327-L413 HydrophobicContact CG-CG 4.33Å
328	S	89.9	Confident	92.9	Very high	103 Å²	103	50.1 Å²	50.1	72%	0.72	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-12.3	175.3	-53.3	0	0	0	0	113.3	N326	N326-S328 PolarHBondContact O-N 3.43Å; N326-S328 VanDerWaalsContact OD1-CB 3.31Å; N326-S328 WeakPolarHBondContact OD1-CB 3.25Å; N326-S328 PolarHBondContact OD1-N 2.87Å; N326-S328 PolarHBondContact OD1-OG 3.12Å
329	Q	92.9	Very high	92.2	Very high	106 Å²	106	60.4 Å²	60.4	50%	0.495	35%	0.346	S	S	.	.	S	Bend	trans	-100.9	138.1	-178.7	-64.6	-179.3	-13.8	0	0	110.5	N326 P327 T331 S332 Y335	N326-Q329 HydrophobicContact CB-CG 4.15Å; N326-Q329 WeakPolarHBondContact O-CB 3.27Å; N326-Q329 PolarHBondContact O-N 3.47Å; P327-Q329 VanDerWaalsContact C-N 3.3Å; Q329-T331 PolarHBondContact O-N 3.33Å; Q329-T331 VanDerWaalsContact O-N 3.1Å; Q329-S332 WeakPolarHBondContact O-CB 3.36Å; Q329-S332 PolarHBondContact O-N 2.87Å; Q329-Y335 VanDerWaalsContact C-CD2 3.46Å; Q329-Y335 WeakPolarHBondContact O-CB 3.07Å; Q329-Y335 VanDerWaalsContact O-CD2 3.24Å; Q329-Y335 WeakPolarHBondContact O-CD2 3.28Å
330	S	91.7	Very high	91.6	Very high	94 Å²	94	65 Å²	65	66%	0.657	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.7	179.7	55.3	0	0	0	0	114.5
331	T	91.8	Very high	91.2	Very high	116 Å²	116	68.7 Å²	68.7	71%	0.712	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-10.5	175.3	51.9	0	0	0	0	113.3	Q329	Q329-T331 PolarHBondContact O-N 3.33Å; Q329-T331 VanDerWaalsContact O-N 3.1Å
332	S	94.8	Very high	91	Very high	9 Å²	9	69.5 Å²	69.5	6%	0.063	39%	0.39	C	S	.	.	S	Bend	trans	-75	142.8	178.9	174.4	0	0	0	0	111.6	N324 G325 N326 Q329 H334 Y335	N324-S332 CarbonylContact O-C 3.48Å; N324-S332 WeakPolarHBondContact O-CA 3.26Å; N324-S332 WeakPolarHBondContact O-CB 3.43Å; N324-S332 PolarHBondContact O-OG 3.28Å; G325-S332 PolarHBondContact O-OG 3.26Å; G325-S332 VanDerWaalsContact O-OG 3.06Å; N326-S332 WeakPolarHBondContact O-CB 3.25Å; Q329-S332 WeakPolarHBondContact O-CB 3.36Å; Q329-S332 PolarHBondContact O-N 2.87Å; S332-H334 PolarHBondContact O-N 3.28Å; S332-H334 PolarHBondContact OG-N 3.2Å; S332-H334 VanDerWaalsContact OG-N 3.08Å; S332-Y335 VanDerWaalsContact O-CB 3.25Å; S332-Y335 WeakPolarHBondContact O-CB 3.37Å; S332-Y335 PolarHBondContact O-N 3.25Å; S332-Y335 VanDerWaalsContact O-N 3.11Å
333	L	94.6	Very high	90.9	Very high	49 Å²	49	67.5 Å²	67.5	26%	0.257	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-19.6	172.5	-61.6	176	0	0	0	112.4	N324 N342 Y344 D447 V475	N324-L333 HydrophobicContact CB-CB 4.45Å; N324-L333 PolarHBondContact O-N 3.14Å; N324-L333 WeakPolarHBondContact OD1-CB 3.42Å; N324-L333 WeakPolarHBondContact OD1-CD1 3.41Å; L333-N342 WeakPolarHBondContact O-CB 3.38Å; L333-Y344 HydrophobicContact CB-CD2 4.45Å; L333-Y344 HydrophobicContact CB-CE2 3.92Å; L333-D447 HydrophobicContact CD1-CB 3.35Å; L333-V475 HydrophobicContact CD1-CG2 4.48Å
334	H	96	Very high	90.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	7.7	172.1	-69.3	-54.5	0	0	0	113.9	D319 N324 P327 S332 M336 N342 Y344 Y404 L408	D319-H334 PolarHBondContact O-CE1 2.78Å; D319-H334 PolarHBondContact O-NE2 2.89Å; N324-H334 VanDerWaalsContact CB-CD2 3.43Å; N324-H334 WeakPolarHBondContact CB-CD2 3.45Å; P327-H334 HydrophobicContact CB-CB 4.18Å; P327-H334 HydrophobicContact CG-CB 4.11Å; S332-H334 PolarHBondContact O-N 3.28Å; S332-H334 PolarHBondContact OG-N 3.2Å; S332-H334 VanDerWaalsContact OG-N 3.08Å; H334-M336 PolarHBondContact O-N 3.07Å; H334-M336 VanDerWaalsContact O-N 3.16Å; H334-N342 PolarHBondContact O-ND2 2.83Å; H334-Y344 AromaticContact CE1-CD1 3.95Å; H334-Y344 AromaticContact CE1-CD2 3.58Å; H334-Y344 AromaticContact CE1-CE1 3.78Å; H334-Y344 AromaticContact CE1-CE2 3.41Å; H334-Y344 VanDerWaalsContact CE1-CE2 3.41Å; H334-Y344 WeakPolarHBondContact CE1-CE2 3.4Å; H334-Y344 AromaticContact CE1-CG 3.86Å; H334-Y344 AromaticContact CE1-CZ 3.54Å; H334-Y344 AromaticContact ND1-CD2 3.49Å; H334-Y344 WeakPolarHBondContact ND1-CD2 3.24Å; H334-Y344 AromaticContact ND1-CE2 3.7Å; H334-Y344 AromaticContact ND1-CG 3.91Å; H334-Y404 AromaticContact ND1-CE2 3.73Å; H334-Y404 AromaticContact ND1-CZ 3.7Å; H334-Y404 PolarHBondContact ND1-OH 2.77Å; H334-L408 HydrophobicContact CB-CD1 4.02Å; H334-L408 HydrophobicContact CB-CD2 3.74Å
335	Y	94.6	Very high	90.9	Very high	78 Å²	78	63.8 Å²	63.8	31%	0.306	35%	0.348	S	S	.	.			trans	-55.1	125.7	-177.5	-179.2	-118.1	0	0	0	111.5	P327 Q329 S332 N337 N342	P327-Y335 WeakPolarHBondContact O-CD2 3.05Å; Q329-Y335 VanDerWaalsContact C-CD2 3.46Å; Q329-Y335 WeakPolarHBondContact O-CB 3.07Å; Q329-Y335 VanDerWaalsContact O-CD2 3.24Å; Q329-Y335 WeakPolarHBondContact O-CD2 3.28Å; S332-Y335 VanDerWaalsContact O-CB 3.25Å; S332-Y335 WeakPolarHBondContact O-CB 3.37Å; S332-Y335 PolarHBondContact O-N 3.25Å; S332-Y335 VanDerWaalsContact O-N 3.11Å; Y335-N337 HydrophobicContact CD1-CB 3.96Å; Y335-N337 HydrophobicContact CE1-CB 3.75Å; Y335-N337 PolarHBondContact O-N 2.98Å; Y335-N342 PolarHBondContact O-ND2 3.12Å; Y335-N342 VanDerWaalsContact O-ND2 3.14Å
336	M	88.4	Confident	90.8	Very high	64 Å²	64	63 Å²	63	32%	0.315	34%	0.337	S	S	.	.			trans	-91	85.3	179.5	-72.1	-176	-75.4	0	0	110	H334 H405 L408 K409	H334-M336 PolarHBondContact O-N 3.07Å; H334-M336 VanDerWaalsContact O-N 3.16Å; M336-H405 HydrophobicContact SD-CB 4.16Å; M336-L408 HydrophobicContact CE-CB 4.37Å; M336-L408 HydrophobicContact CG-CD1 4.38Å; M336-L408 HydrophobicContact SD-CD1 4.41Å; M336-K409 HydrophobicContact CE-CG 4.12Å
337	N	85.2	Confident	90.8	Very high	55 Å²	55	59.1 Å²	59.1	29%	0.294	32%	0.316	S	S	.	.			trans	-78.4	130.4	173.4	-175.7	-27.2	0	0	0	110.2	Y335 Y339 Q340	Y335-N337 HydrophobicContact CD1-CB 3.96Å; Y335-N337 HydrophobicContact CE1-CB 3.75Å; Y335-N337 PolarHBondContact O-N 2.98Å; N337-Y339 PolarHBondContact O-N 3.04Å; N337-Y339 PolarHBondContact OD1-N 3.47Å; N337-Q340 HydrophobicContact CB-CB 4.46Å; N337-Q340 WeakPolarHBondContact CB-O 3.24Å; N337-Q340 VanDerWaalsContact O-O 3.14Å
338	P	83.6	Confident	90.8	Very high	109 Å²	109	58.2 Å²	58.2	71%	0.708	31%	0.31	S	S	*	.	S	Bend	trans	-65.5	-17.3	178.5	25	-34.2	0	0	0	114.7
339	Y	82.7	Confident	90.8	Very high	217 Å²	217	56.3 Å²	56.3	85%	0.851	29%	0.289	S	S	*	.	S	Bend	trans	-109.9	-16.2	-176.2	-57.2	-71.9	0	0	0	114.1	N337	N337-Y339 PolarHBondContact O-N 3.04Å; N337-Y339 PolarHBondContact OD1-N 3.47Å
340	Q	84	Confident	90.7	Very high	95 Å²	95	51.5 Å²	51.5	44%	0.444	27%	0.267	S	S	.	.	S	Bend	trans	-142.9	137.5	-172.3	-165.3	178.8	14.9	0	0	111.2	N337 H520	N337-Q340 HydrophobicContact CB-CB 4.46Å; N337-Q340 WeakPolarHBondContact CB-O 3.24Å; N337-Q340 VanDerWaalsContact O-O 3.14Å; Q340-H520 PolarHBondContact NE2-CE1 3.17Å; Q340-H520 PolarHBondContact NE2-NE2 3.37Å
341	M	87.8	Confident	90.6	Very high	78 Å²	78	47 Å²	47	38%	0.384	24%	0.236	S	C	.	.			trans	-71.8	141.5	173.3	-70.2	177.9	176.2	0	0	110.5	A345 M346 K349	M341-A345 HydrophobicContact CB-CB 3.97Å; M341-A345 HydrophobicContact CG-CB 4.24Å; M341-M346 HydrophobicContact CB-CG 3.69Å; M341-K349 HydrophobicContact CE-CD 3.96Å; M341-K349 HydrophobicContact SD-CD 3.83Å
342	N	92.1	Very high	90.5	Very high	20 Å²	20	41.5 Å²	41.5	11%	0.107	20%	0.202	C	C	.	.			trans	-76.4	172.3	169.1	60.7	43.3	0	0	0	111.5	L333 H334 Y335 Y344 A345 M346 Y404	L333-N342 WeakPolarHBondContact O-CB 3.38Å; H334-N342 PolarHBondContact O-ND2 2.83Å; Y335-N342 PolarHBondContact O-ND2 3.12Å; Y335-N342 VanDerWaalsContact O-ND2 3.14Å; N342-Y344 VanDerWaalsContact C-N 3.3Å; N342-Y344 PolarHBondContact O-N 2.82Å; N342-Y344 WeakPolarHBondContact OD1-CB 3.49Å; N342-Y344 PolarHBondContact OD1-N 2.75Å; N342-A345 PolarHBondContact O-N 3Å; N342-A345 WeakPolarHBondContact OD1-CB 3.26Å; N342-A345 PolarHBondContact OD1-N 2.83Å; N342-M346 WeakPolarHBondContact O-CG 3.3Å; N342-M346 PolarHBondContact O-N 2.62Å; N342-Y404 PolarHBondContact ND2-OH 3.2Å; N342-Y404 PolarHBondContact OD1-OH 3.16Å
343	A	91.8	Very high	90.2	Very high	14 Å²	14	43.2 Å²	43.2	12%	0.116	21%	0.209	C	C	.	.	H	α-helix	trans	-58	-41	-175.7	0	0	0	0	0	112.7	M346 A347 V475 F510	A343-M346 PolarHBondContact O-N 2.95Å; A343-A347 WeakPolarHBondContact O-CB 3.44Å; A343-A347 PolarHBondContact O-N 2.98Å; A343-V475 HydrophobicContact CB-CB 3.86Å; A343-V475 HydrophobicContact CB-CG1 3.79Å; A343-F510 HydrophobicContact CB-CD1 4.03Å; A343-F510 HydrophobicContact CB-CE1 4.04Å
344	Y	95.1	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.9	-52.1	174.7	-73.9	-90.7	0	0	0	112	I318 D319 N324 L333 H334 N342 M346 A347 L348 Y404 I445 D447 V475	I318-Y344 HydrophobicContact CG2-CD1 3.7Å; I318-Y344 HydrophobicContact CG2-CE1 3.94Å; D319-Y344 HydrophobicContact CB-CE1 4.22Å; N324-Y344 PolarHBondContact ND2-OH 2.95Å; N324-Y344 VanDerWaalsContact OD1-CE2 3.26Å; N324-Y344 WeakPolarHBondContact OD1-CE2 3.41Å; N324-Y344 PolarHBondContact OD1-OH 3.46Å; L333-Y344 HydrophobicContact CB-CD2 4.45Å; L333-Y344 HydrophobicContact CB-CE2 3.92Å; H334-Y344 AromaticContact CE1-CD1 3.95Å; H334-Y344 AromaticContact CE1-CD2 3.58Å; H334-Y344 AromaticContact CE1-CE1 3.78Å; H334-Y344 AromaticContact CE1-CE2 3.41Å; H334-Y344 VanDerWaalsContact CE1-CE2 3.41Å; H334-Y344 WeakPolarHBondContact CE1-CE2 3.4Å; H334-Y344 AromaticContact CE1-CG 3.86Å; H334-Y344 AromaticContact CE1-CZ 3.54Å; H334-Y344 AromaticContact ND1-CD2 3.49Å; H334-Y344 WeakPolarHBondContact ND1-CD2 3.24Å; H334-Y344 AromaticContact ND1-CE2 3.7Å; H334-Y344 AromaticContact ND1-CG 3.91Å; N342-Y344 VanDerWaalsContact C-N 3.3Å; N342-Y344 PolarHBondContact O-N 2.82Å; N342-Y344 WeakPolarHBondContact OD1-CB 3.49Å; N342-Y344 PolarHBondContact OD1-N 2.75Å; Y344-M346 VanDerWaalsContact C-N 3.32Å; Y344-M346 PolarHBondContact O-N 2.94Å; Y344-A347 PolarHBondContact O-N 2.81Å; Y344-L348 WeakPolarHBondContact O-CB 3.26Å; Y344-L348 VanDerWaalsContact O-CG 3.26Å; Y344-L348 WeakPolarHBondContact O-CG 3.41Å; Y344-L348 PolarHBondContact O-N 2.84Å; Y344-Y404 WeakPolarHBondContact CB-OH 3.35Å; Y344-I445 HydrophobicContact CD1-CB 3.82Å; Y344-I445 HydrophobicContact CD1-CG2 3.35Å; Y344-I445 HydrophobicContact CE1-CB 3.98Å; Y344-I445 HydrophobicContact CE1-CG2 3.57Å; Y344-I445 WeakPolarHBondContact CE1-O 3.39Å; Y344-I445 HydrophobicContact CG-CG2 4.15Å; Y344-D447 PolarHBondContact OH-N 3.29Å; Y344-V475 HydrophobicContact CD2-CG2 4.04Å; Y344-V475 HydrophobicContact CE1-CG2 4.15Å; Y344-V475 HydrophobicContact CE2-CG2 3.45Å; Y344-V475 VanDerWaalsContact CE2-CG2 3.45Å
345	A	93.4	Very high	89.5	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-37.1	179.4	0	0	0	0	0	112.5	M341 N342 K349 L401	M341-A345 HydrophobicContact CB-CB 3.97Å; M341-A345 HydrophobicContact CG-CB 4.24Å; N342-A345 PolarHBondContact O-N 3Å; N342-A345 WeakPolarHBondContact OD1-CB 3.26Å; N342-A345 PolarHBondContact OD1-N 2.83Å; A345-K349 VanDerWaalsContact O-CB 3.31Å; A345-K349 WeakPolarHBondContact O-CB 3.36Å; A345-K349 PolarHBondContact O-N 3.47Å; A345-L401 HydrophobicContact CB-CD2 3.98Å
346	M	91.3	Very high	89.1	Confident	13 Å²	13	39.3 Å²	39.3	6%	0.064	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-45.8	174.6	-73	-169.3	-74.8	0	0	112	M341 N342 A343 Y344 K349 A350 F510	M341-M346 HydrophobicContact CB-CG 3.69Å; N342-M346 WeakPolarHBondContact O-CG 3.3Å; N342-M346 PolarHBondContact O-N 2.62Å; A343-M346 PolarHBondContact O-N 2.95Å; Y344-M346 VanDerWaalsContact C-N 3.32Å; Y344-M346 PolarHBondContact O-N 2.94Å; M346-K349 PolarHBondContact O-N 3.01Å; M346-A350 VanDerWaalsContact O-CB 3.3Å; M346-A350 WeakPolarHBondContact O-CB 3.15Å; M346-A350 PolarHBondContact O-N 2.86Å; M346-F510 HydrophobicContact CB-CE2 4.19Å; M346-F510 HydrophobicContact CB-CZ 3.66Å; M346-F510 HydrophobicContact CE-CE1 3.79Å; M346-F510 HydrophobicContact CE-CZ 3.87Å; M346-F510 HydrophobicContact SD-CZ 4.17Å
347	A	92.4	Very high	89.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.6	-44.9	177.7	0	0	0	0	0	112	A343 Y344 K349 A350 V351 I445 V473 F510 L527	A343-A347 WeakPolarHBondContact O-CB 3.44Å; A343-A347 PolarHBondContact O-N 2.98Å; Y344-A347 PolarHBondContact O-N 2.81Å; A347-K349 VanDerWaalsContact C-N 3.31Å; A347-K349 PolarHBondContact O-N 2.86Å; A347-A350 PolarHBondContact O-N 3.2Å; A347-V351 PolarHBondContact O-N 2.79Å; A347-V351 VanDerWaalsContact O-N 3.11Å; A347-I445 HydrophobicContact CB-CD1 3.98Å; A347-I445 HydrophobicContact CB-CG2 4.47Å; A347-V473 HydrophobicContact CB-CG1 3.91Å; A347-F510 HydrophobicContact CB-CD2 4.34Å; A347-L527 HydrophobicContact CB-CD2 4.27Å
348	L	93.1	Very high	89.1	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-54.5	-49.2	173.4	-73.3	171.6	0	0	0	111.4	V316 I318 Y344 G352 M397 I400 L401 L443 I445	V316-L348 HydrophobicContact CB-CD2 4.38Å; V316-L348 HydrophobicContact CG1-CD2 3.28Å; V316-L348 HydrophobicContact CG2-CD2 4.18Å; I318-L348 HydrophobicContact CD1-CD1 3.73Å; I318-L348 HydrophobicContact CD1-CD2 4.22Å; I318-L348 HydrophobicContact CD1-CG 4.47Å; I318-L348 HydrophobicContact CG1-CD2 4.48Å; Y344-L348 WeakPolarHBondContact O-CB 3.26Å; Y344-L348 VanDerWaalsContact O-CG 3.26Å; Y344-L348 WeakPolarHBondContact O-CG 3.41Å; Y344-L348 PolarHBondContact O-N 2.84Å; L348-G352 VanDerWaalsContact O-CA 3.3Å; L348-G352 WeakPolarHBondContact O-CA 3.39Å; L348-G352 PolarHBondContact O-N 3.42Å; L348-M397 HydrophobicContact CB-CE 4.29Å; L348-M397 VanDerWaalsContact O-CE 3.26Å; L348-M397 WeakPolarHBondContact O-CE 3.31Å; L348-I400 HydrophobicContact CD1-CG2 4.43Å; L348-I400 HydrophobicContact CD2-CG2 4.36Å; L348-L401 HydrophobicContact CB-CD2 4.36Å; L348-L401 HydrophobicContact CD1-CD2 3.98Å; L348-L443 HydrophobicContact CD2-CD2 4.37Å; L348-I445 HydrophobicContact CD2-CD1 3.52Å; L348-I445 HydrophobicContact CG-CD1 3.57Å
349	K	90.7	Very high	89.2	Confident	64 Å²	64	30.3 Å²	30.3	28%	0.278	14%	0.139	S	C	.	.	H	α-helix	trans	-67.3	-41.6	-178.1	-169.6	173	-176.8	175.6	0	112	M341 A345 M346 A347 E353 M524	M341-K349 HydrophobicContact CE-CD 3.96Å; M341-K349 HydrophobicContact SD-CD 3.83Å; A345-K349 VanDerWaalsContact O-CB 3.31Å; A345-K349 WeakPolarHBondContact O-CB 3.36Å; A345-K349 PolarHBondContact O-N 3.47Å; M346-K349 PolarHBondContact O-N 3.01Å; A347-K349 VanDerWaalsContact C-N 3.31Å; A347-K349 PolarHBondContact O-N 2.86Å; K349-E353 WeakPolarHBondContact CE-OE1 3.49Å; K349-E353 HydrophobicContact CG-CG 4.01Å; K349-E353 WeakPolarHBondContact CG-OE1 3.49Å; K349-E353 IonicContact NZ-OE1 2.73Å; K349-E353 WeakPolarHBondContact O-CB 3.21Å; K349-E353 VanDerWaalsContact O-CG 3.25Å; K349-E353 WeakPolarHBondContact O-CG 3.46Å; K349-E353 PolarHBondContact O-N 3.3Å; K349-E353 VanDerWaalsContact O-N 3.08Å; K349-M524 HydrophobicContact CB-CE 4.36Å; K349-M524 HydrophobicContact CD-CE 4.14Å; K349-M524 HydrophobicContact CG-CE 3.96Å
350	A	89.3	Confident	89	Confident	5 Å²	5	23.8 Å²	23.8	4%	0.041	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-50.8	-179.6	0	0	0	0	0	112.3	M346 A347 M524 L527 A528	M346-A350 VanDerWaalsContact O-CB 3.3Å; M346-A350 WeakPolarHBondContact O-CB 3.15Å; M346-A350 PolarHBondContact O-N 2.86Å; A347-A350 PolarHBondContact O-N 3.2Å; A350-M524 HydrophobicContact CB-CB 3.84Å; A350-M524 HydrophobicContact CB-CG 4.03Å; A350-L527 HydrophobicContact CB-CD2 3.83Å; A350-A528 HydrophobicContact CB-CB 4.44Å; A350-A528 WeakPolarHBondContact O-CB 3.19Å
351	V	90.4	Very high	89.1	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-78.3	-47.7	-177.5	-178	0	0	0	0	110.8	F314 A347 E353 I354 I355 L443 I471 V531 L532	F314-V351 HydrophobicContact CE2-CG1 4.19Å; F314-V351 HydrophobicContact CZ-CG1 4.02Å; A347-V351 PolarHBondContact O-N 2.79Å; A347-V351 VanDerWaalsContact O-N 3.11Å; V351-E353 VanDerWaalsContact C-N 3.33Å; V351-E353 PolarHBondContact O-N 2.8Å; V351-I354 PolarHBondContact O-N 2.86Å; V351-I355 PolarHBondContact O-N 2.93Å; V351-L443 HydrophobicContact CB-CD2 4.08Å; V351-L443 HydrophobicContact CG1-CD2 4.18Å; V351-L443 HydrophobicContact CG2-CD2 4.4Å; V351-I471 HydrophobicContact CG1-CD1 4.47Å; V351-V531 HydrophobicContact CG1-CG1 4.12Å; V351-V531 HydrophobicContact CG2-CB 4.32Å; V351-V531 HydrophobicContact CG2-CG1 3.65Å; V351-L532 HydrophobicContact CG1-CD2 3.97Å; V351-L532 HydrophobicContact CG1-CG 4.41Å
352	G	89.6	Confident	89.2	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.7	-34.4	-174.8	0	0	0	0	0	114	L348 I354 Q356 M397	L348-G352 VanDerWaalsContact O-CA 3.3Å; L348-G352 WeakPolarHBondContact O-CA 3.39Å; L348-G352 PolarHBondContact O-N 3.42Å; G352-I354 PolarHBondContact O-N 3.48Å; G352-Q356 VanDerWaalsContact O-CB 3.3Å; G352-Q356 WeakPolarHBondContact O-CB 3.41Å; G352-Q356 VanDerWaalsContact O-CG 3.26Å; G352-Q356 WeakPolarHBondContact O-CG 3.45Å; G352-Q356 PolarHBondContact O-N 3.38Å; G352-M397 WeakPolarHBondContact CA-SD 3.28Å
353	E	88.3	Confident	89.2	Confident	45 Å²	45	24.7 Å²	24.7	21%	0.21	13%	0.13	C	C	.	.	H	α-helix	trans	-65.9	-23.7	-179.8	-83.1	-167.7	-174.2	0	0	114.2	K94 K349 V351 Q356	K94-E353 IonicContact NZ-OE2 2.74Å; K94-E353 PolarHBondContact NZ-OE2 3.21Å; K349-E353 WeakPolarHBondContact CE-OE1 3.49Å; K349-E353 HydrophobicContact CG-CG 4.01Å; K349-E353 WeakPolarHBondContact CG-OE1 3.49Å; K349-E353 IonicContact NZ-OE1 2.73Å; K349-E353 WeakPolarHBondContact O-CB 3.21Å; K349-E353 VanDerWaalsContact O-CG 3.25Å; K349-E353 WeakPolarHBondContact O-CG 3.46Å; K349-E353 PolarHBondContact O-N 3.3Å; K349-E353 VanDerWaalsContact O-N 3.08Å; V351-E353 VanDerWaalsContact C-N 3.33Å; V351-E353 PolarHBondContact O-N 2.8Å; E353-Q356 VanDerWaalsContact CA-NE2 3.35Å; E353-Q356 PolarHBondContact O-NE2 3.11Å; E353-Q356 VanDerWaalsContact O-NE2 3.17Å
354	I	88.8	Confident	89.3	Confident	11 Å²	11	24 Å²	24	6%	0.056	12%	0.124	C	C	.	.	H	α-helix	trans	-93.3	-52	-178.7	-56.5	-172.3	0	0	0	109.8	F91 E92 K94 V351 G352 Q356 D357 A528 L532	F91-I354 WeakPolarHBondContact O-CG2 3.41Å; E92-I354 WeakPolarHBondContact O-CD1 3.44Å; K94-I354 HydrophobicContact CB-CD1 4.5Å; K94-I354 HydrophobicContact CB-CG1 4.18Å; V351-I354 PolarHBondContact O-N 2.86Å; G352-I354 PolarHBondContact O-N 3.48Å; I354-Q356 VanDerWaalsContact C-N 3.27Å; I354-Q356 PolarHBondContact O-N 3.1Å; I354-D357 PolarHBondContact O-N 3Å; I354-A528 HydrophobicContact CD1-CB 3.54Å; I354-L532 HydrophobicContact CB-CD1 3.68Å; I354-L532 HydrophobicContact CD1-CD1 4.07Å; I354-L532 HydrophobicContact CG1-CD1 4.37Å; I354-L532 HydrophobicContact CG2-CD1 3.66Å
355	I	86.6	Confident	89.3	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-67.9	-26.5	-173.4	-159.6	159.8	0	0	0	113.2	I312 F314 V351 D357 Y358 V441 L532	I312-I355 HydrophobicContact CG2-CD1 4.27Å; I312-I355 HydrophobicContact CG2-CG1 4.27Å; F314-I355 HydrophobicContact CB-CG2 4.1Å; F314-I355 HydrophobicContact CD1-CG2 3.58Å; F314-I355 HydrophobicContact CD2-CD1 3.67Å; F314-I355 HydrophobicContact CD2-CG1 4.32Å; F314-I355 HydrophobicContact CD2-CG2 3.72Å; F314-I355 HydrophobicContact CE1-CG2 3.78Å; F314-I355 HydrophobicContact CE2-CD1 4.12Å; F314-I355 HydrophobicContact CE2-CG2 3.89Å; F314-I355 HydrophobicContact CG-CD1 4.31Å; F314-I355 HydrophobicContact CG-CG2 3.53Å; F314-I355 HydrophobicContact CZ-CG2 3.92Å; V351-I355 PolarHBondContact O-N 2.93Å; I355-D357 PolarHBondContact O-N 3.32Å; I355-D357 VanDerWaalsContact O-N 3.11Å; I355-Y358 PolarHBondContact O-N 3.41Å; I355-V441 HydrophobicContact CD1-CB 3.9Å; I355-V441 HydrophobicContact CD1-CG1 3.73Å; I355-V441 HydrophobicContact CD1-CG2 4.08Å; I355-L532 HydrophobicContact CD1-CD2 4.16Å
356	Q	87.8	Confident	89.4	Confident	33 Å²	33	24.6 Å²	24.6	15%	0.154	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-62	-17.8	178	69.4	177.6	-34.9	0	0	114.2	G352 E353 I354 Y358 K362 F364	G352-Q356 VanDerWaalsContact O-CB 3.3Å; G352-Q356 WeakPolarHBondContact O-CB 3.41Å; G352-Q356 VanDerWaalsContact O-CG 3.26Å; G352-Q356 WeakPolarHBondContact O-CG 3.45Å; G352-Q356 PolarHBondContact O-N 3.38Å; E353-Q356 VanDerWaalsContact CA-NE2 3.35Å; E353-Q356 PolarHBondContact O-NE2 3.11Å; E353-Q356 VanDerWaalsContact O-NE2 3.17Å; I354-Q356 VanDerWaalsContact C-N 3.27Å; I354-Q356 PolarHBondContact O-N 3.1Å; Q356-Y358 PolarHBondContact O-N 2.92Å; Q356-K362 WeakPolarHBondContact O-CE 3.21Å; Q356-F364 HydrophobicContact CB-CE2 3.93Å; Q356-F364 HydrophobicContact CB-CZ 3.54Å
357	D	87.7	Confident	89.7	Confident	22 Å²	22	24.1 Å²	24.1	12%	0.118	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-75.1	-11.8	177.5	-74	-15.6	0	0	0	112.2	T123 I354 I355 K362	T123-D357 PolarHBondContact OG1-OD2 3.4Å; I354-D357 PolarHBondContact O-N 3Å; I355-D357 PolarHBondContact O-N 3.32Å; I355-D357 VanDerWaalsContact O-N 3.11Å; D357-K362 IonicContact OD1-NZ 2.66Å
358	Y	85.3	Confident	90	Very high	13 Å²	13	24.1 Å²	24.1	5%	0.051	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-107.2	1.5	179.5	-56.2	-84.5	0	0	0	113.5	Y89 F91 G125 V128 F302 I306 I312 I355 Q356	Y89-Y358 WeakPolarHBondContact CE2-OH 3.3Å; Y89-Y358 VanDerWaalsContact OH-CZ 3.3Å; Y89-Y358 PolarHBondContact OH-OH 2.9Å; F91-Y358 HydrophobicContact CD2-CD2 4.3Å; F91-Y358 HydrophobicContact CD2-CE1 4.21Å; F91-Y358 AromaticContact CD2-CE2 3.76Å; F91-Y358 HydrophobicContact CD2-CE2 3.76Å; F91-Y358 AromaticContact CD2-CZ 3.74Å; F91-Y358 HydrophobicContact CE2-CD1 4.4Å; F91-Y358 AromaticContact CE2-CD2 3.68Å; F91-Y358 HydrophobicContact CE2-CD2 3.68Å; F91-Y358 HydrophobicContact CE2-CE1 4.33Å; F91-Y358 AromaticContact CE2-CE2 3.59Å; F91-Y358 HydrophobicContact CE2-CE2 3.59Å; F91-Y358 HydrophobicContact CE2-CG 4.12Å; F91-Y358 AromaticContact CE2-CZ 3.97Å; G125-Y358 WeakPolarHBondContact CA-OH 2.98Å; V128-Y358 HydrophobicContact CG2-CE1 4.01Å; F302-Y358 HydrophobicContact CE1-CE1 4.27Å; F302-Y358 HydrophobicContact CZ-CD1 4.47Å; I306-Y358 HydrophobicContact CD1-CD1 4.49Å; I306-Y358 HydrophobicContact CG2-CD1 4.42Å; I312-Y358 HydrophobicContact CD1-CG 4.4Å; I312-Y358 PolarHBondContact N-O 3.19Å; I355-Y358 PolarHBondContact O-N 3.41Å; Q356-Y358 PolarHBondContact O-N 2.92Å
359	D	85.2	Confident	90.2	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.021	13%	0.126	C	C	.	.			trans	-105.3	123.1	170.8	-168.5	-55.3	0	0	0	109	H313 D361 K362 F364	H313-D359 IonicContact ND1-OD2 3.57Å; D359-D361 PolarHBondContact OD1-N 2.91Å; D359-D361 VanDerWaalsContact OD1-N 3.12Å; D359-K362 PolarHBondContact OD1-N 3.11Å; D359-F364 HydrophobicContact CB-CE1 3.57Å; D359-F364 HydrophobicContact CB-CZ 3.99Å
360	S	79.6	Confident	90.4	Very high	80 Å²	80	21 Å²	21	56%	0.559	11%	0.112	S	C	*	.	S	Bend	trans	-74.3	-31.9	-170.8	66.9	0	0	0	0	114.4	Q311	Q311-S360 PolarHBondContact NE2-OG 2.88Å
361	D	84.9	Confident	90.7	Very high	87 Å²	87	20.8 Å²	20.8	47%	0.465	11%	0.11	S	C	.	.	S	Bend	trans	-100.2	-15.1	-177.5	68.7	17.8	0	0	0	112.2	D359 M363	D359-D361 PolarHBondContact OD1-N 2.91Å; D359-D361 VanDerWaalsContact OD1-N 3.12Å; D361-M363 HydrophobicContact CB-CG 4.35Å; D361-M363 PolarHBondContact O-N 3.39Å; D361-M363 WeakPolarHBondContact OD1-CB 3.48Å; D361-M363 PolarHBondContact OD1-N 3.28Å
362	K	89.9	Confident	91	Very high	69 Å²	69	23.3 Å²	23.3	30%	0.3	12%	0.121	S	C	.	.			trans	57.5	28.3	-179.4	-54.3	-169.1	172	-156.3	0	111.9	Q356 D357 D359 F364 G396	Q356-K362 WeakPolarHBondContact O-CE 3.21Å; D357-K362 IonicContact OD1-NZ 2.66Å; D359-K362 PolarHBondContact OD1-N 3.11Å; K362-F364 HydrophobicContact CB-CE2 4.13Å; K362-F364 HydrophobicContact CB-CZ 4.18Å; K362-F364 WeakPolarHBondContact O-CD2 3.4Å; K362-F364 WeakPolarHBondContact O-CE2 3.15Å; K362-G396 WeakPolarHBondContact O-CA 3.35Å; K362-G396 PolarHBondContact O-N 3.31Å
363	M	92.2	Very high	91.2	Very high	57 Å²	57	25.4 Å²	25.4	28%	0.281	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	111.7	175.2	-66.8	-62.3	-71.6	0	0	108.3	D361 Y393 C394 N395	D361-M363 HydrophobicContact CB-CG 4.35Å; D361-M363 PolarHBondContact O-N 3.39Å; D361-M363 WeakPolarHBondContact OD1-CB 3.48Å; D361-M363 PolarHBondContact OD1-N 3.28Å; M363-Y393 HydrophobicContact CB-CD1 3.81Å; M363-Y393 HydrophobicContact CB-CG 4.46Å; M363-Y393 VanDerWaalsContact O-CD1 3.28Å; M363-Y393 WeakPolarHBondContact O-CD1 3.37Å; M363-C394 WeakPolarHBondContact CA-O 3.42Å; M363-N395 HydrophobicContact SD-CB 4.01Å
364	F	93.8	Very high	91.2	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.3	-171.7	-57.1	-61.7	0	0	0	111.5	F314 Q356 D359 K362 A366 Y393 C394 I400	F314-F364 HydrophobicContact CB-CD1 3.78Å; F314-F364 HydrophobicContact CB-CE1 3.89Å; F314-F364 HydrophobicContact CD1-CD1 4.13Å; F314-F364 HydrophobicContact CD1-CE1 4.44Å; F314-F364 HydrophobicContact CD1-CG 4.5Å; F314-F364 HydrophobicContact CG-CD1 4.47Å; F314-F364 WeakPolarHBondContact O-CD1 3.48Å; Q356-F364 HydrophobicContact CB-CE2 3.93Å; Q356-F364 HydrophobicContact CB-CZ 3.54Å; D359-F364 HydrophobicContact CB-CE1 3.57Å; D359-F364 HydrophobicContact CB-CZ 3.99Å; K362-F364 HydrophobicContact CB-CE2 4.13Å; K362-F364 HydrophobicContact CB-CZ 4.18Å; K362-F364 WeakPolarHBondContact O-CD2 3.4Å; K362-F364 WeakPolarHBondContact O-CE2 3.15Å; F364-A366 PolarHBondContact O-N 3.36Å; F364-Y393 CarbonylContact O-C 3.54Å; F364-Y393 WeakPolarHBondContact O-CA 3.46Å; F364-C394 PolarHBondContact N-O 3.18Å; F364-C394 PolarHBondContact O-N 3.27Å; F364-I400 HydrophobicContact CB-CD1 3.5Å; F364-I400 HydrophobicContact CB-CG1 4.15Å; F364-I400 HydrophobicContact CD2-CD1 3.88Å; F364-I400 HydrophobicContact CG-CD1 3.97Å
365	P	95.3	Very high	91.2	Very high	13 Å²	13	33 Å²	33	8%	0.084	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	124.5	167.8	-21	32.7	0	0	0	110.4	F314 T315 V316 P392 Y393	F314-P365 WeakPolarHBondContact O-CD 3.44Å; T315-P365 HydrophobicContact CG2-CB 4.1Å; V316-P365 PolarHBondContact N-O 3.39Å; P365-P392 HydrophobicContact CB-CG 4.33Å; P365-Y393 HydrophobicContact CG-CD1 3.83Å; P365-Y393 HydrophobicContact CG-CE1 3.5Å; P365-Y393 VanDerWaalsContact CG-CE1 3.5Å; P365-Y393 HydrophobicContact CG-CE2 4.24Å; P365-Y393 HydrophobicContact CG-CG 4.35Å
366	A	96.4	Very high	91.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	114.9	178.6	0	0	0	0	0	109.8	F364 L385 P392 I400	F364-A366 PolarHBondContact O-N 3.36Å; A366-L385 HydrophobicContact CB-CB 4.16Å; A366-L385 HydrophobicContact CB-CD1 3.99Å; A366-L385 HydrophobicContact CB-CG 4.22Å; A366-L385 PolarHBondContact O-N 2.8Å; A366-P392 PolarHBondContact N-O 2.63Å; A366-P392 VanDerWaalsContact N-O 3.14Å; A366-I400 HydrophobicContact CB-CG1 4.26Å; A366-I400 HydrophobicContact CB-CG2 4.28Å
367	L	97.5	Very high	91.4	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	147.6	-175.1	-56.1	176.8	0	0	0	110.8	T315 V316 A317 I318 E382 F383 P392 V422	T315-L367 HydrophobicContact CG2-CD1 4.17Å; V316-L367 PolarHBondContact O-N 3.44Å; A317-L367 CarbonylContact C-O 3.56Å; A317-L367 VanDerWaalsContact CA-O 3.31Å; A317-L367 WeakPolarHBondContact CA-O 3.49Å; I318-L367 PolarHBondContact N-O 2.93Å; L367-E382 HydrophobicContact CD1-CG 4.39Å; L367-F383 CarbonylContact C-O 3.56Å; L367-F383 VanDerWaalsContact CA-O 3.28Å; L367-F383 WeakPolarHBondContact CA-O 3.27Å; L367-P392 HydrophobicContact CD2-CB 4.3Å; L367-V422 HydrophobicContact CD1-CG1 4.49Å
368	G	97.2	Very high	91.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	156.5	166.3	0	0	0	0	0	110.8	I318 E382 F383	I318-G368 CarbonylContact O-C 3.48Å; I318-G368 VanDerWaalsContact O-CA 3.28Å; I318-G368 WeakPolarHBondContact O-CA 3.31Å; G368-E382 CarbonylContact O-C 3.51Å; G368-E382 VanDerWaalsContact O-CA 3.3Å; G368-E382 WeakPolarHBondContact O-CA 3.33Å; G368-F383 VanDerWaalsContact C-CD1 3.47Å; G368-F383 PolarHBondContact N-O 2.77Å; G368-F383 WeakPolarHBondContact O-CD1 3.38Å; G368-F383 WeakPolarHBondContact O-CE1 3.24Å; G368-F383 PolarHBondContact O-N 2.87Å
369	F	96.9	Very high	92.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	152.1	174.2	63.1	-89.8	0	0	0	112.3	A317 I318 D319 F320 H381 T417 F419 V422 I444	A317-F369 HydrophobicContact CB-CD1 4.17Å; A317-F369 HydrophobicContact CB-CE1 4.12Å; I318-F369 VanDerWaalsContact O-CD1 3.27Å; I318-F369 WeakPolarHBondContact O-CD1 3.38Å; I318-F369 PolarHBondContact O-N 3.08Å; D319-F369 VanDerWaalsContact CA-CZ 3.49Å; D319-F369 HydrophobicContact CB-CE1 4.15Å; D319-F369 HydrophobicContact CB-CE2 3.76Å; D319-F369 HydrophobicContact CB-CZ 3.48Å; D319-F369 VanDerWaalsContact CB-CZ 3.48Å; F320-F369 PolarHBondContact N-O 3.44Å; F369-H381 WeakPolarHBondContact CB-O 3.37Å; F369-T417 HydrophobicContact CE2-CG2 3.94Å; F369-F419 AromaticContact CE2-CD1 3.81Å; F369-F419 HydrophobicContact CE2-CD1 3.81Å; F369-F419 AromaticContact CE2-CE1 3.64Å; F369-F419 HydrophobicContact CE2-CE1 3.64Å; F369-F419 AromaticContact CZ-CD1 3.85Å; F369-F419 HydrophobicContact CZ-CD1 3.85Å; F369-F419 AromaticContact CZ-CE1 3.58Å; F369-F419 HydrophobicContact CZ-CE1 3.58Å; F369-V422 HydrophobicContact CB-CG1 4.37Å; F369-V422 HydrophobicContact CD1-CG1 4.3Å; F369-I444 HydrophobicContact CE1-CG2 4.07Å; F369-I444 HydrophobicContact CZ-CG2 3.99Å
370	G	95.6	Very high	92.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	85.2	23	174.8	0	0	0	0	0	115	S380 Y414 G415	G370-S380 PolarHBondContact N-O 3.46Å; G370-Y414 CarbonylContact O-C 3.59Å; G370-Y414 VanDerWaalsContact O-CA 3.3Å; G370-Y414 WeakPolarHBondContact O-CA 3.49Å; G370-Y414 PolarHBondContact O-N 2.84Å; G370-G415 PolarHBondContact O-N 2.81Å
371	A	96.3	Very high	93.2	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	160.3	-179.3	0	0	0	0	0	112.6	F320 V379 S380 F383 V411 Q412	F320-A371 HydrophobicContact CB-CB 3.85Å; A371-V379 WeakPolarHBondContact O-CA 3.27Å; A371-S380 PolarHBondContact N-O 2.99Å; A371-S380 PolarHBondContact O-N 3.11Å; A371-F383 HydrophobicContact CB-CE1 3.64Å; A371-F383 HydrophobicContact CB-CZ 3.88Å; A371-V411 HydrophobicContact CB-CB 4Å; A371-V411 HydrophobicContact CB-CG2 3.82Å; A371-Q412 CarbonylContact C-O 3.47Å; A371-Q412 WeakPolarHBondContact CA-O 3.26Å
372	K	96.3	Very high	93.7	Very high	52 Å²	52	45.8 Å²	45.8	23%	0.226	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.5	163.5	-72.9	179.1	176.7	175.8	0	109.7	G377 R378 V379 Q412 Y414	K372-G377 WeakPolarHBondContact CD-O 3.3Å; K372-G377 VanDerWaalsContact CG-O 3.29Å; K372-G377 WeakPolarHBondContact CG-O 3.09Å; K372-R378 WeakPolarHBondContact CA-O 3.1Å; K372-V379 HydrophobicContact CG-CG2 3.89Å; K372-Q412 HydrophobicContact CB-CB 4.17Å; K372-Q412 PolarHBondContact N-O 2.96Å; K372-Q412 PolarHBondContact O-N 3.49Å; K372-Y414 HydrophobicContact CD-CD1 4.42Å; K372-Y414 HydrophobicContact CD-CD2 4.15Å; K372-Y414 HydrophobicContact CD-CG 4.07Å; K372-Y414 HydrophobicContact CG-CD1 4.09Å; K372-Y414 HydrophobicContact CG-CD2 4.47Å; K372-Y414 HydrophobicContact CG-CG 3.9Å
373	L	93.4	Very high	94	Very high	44 Å²	44	42.9 Å²	42.9	23%	0.23	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	143.8	-179	-56.1	-178.4	0	0	0	111.3	G377 R378 F383 V411	L373-G377 WeakPolarHBondContact O-CA 3.34Å; L373-G377 PolarHBondContact O-N 3.46Å; L373-R378 PolarHBondContact N-O 2.91Å; L373-F383 HydrophobicContact CD1-CB 3.73Å; L373-F383 HydrophobicContact CD1-CG 4.22Å; L373-F383 HydrophobicContact CD2-CB 4.09Å; L373-F383 HydrophobicContact CD2-CD1 3.83Å; L373-F383 HydrophobicContact CD2-CD2 3.81Å; L373-F383 HydrophobicContact CD2-CE1 4.16Å; L373-F383 HydrophobicContact CD2-CE2 4.14Å; L373-F383 HydrophobicContact CD2-CG 3.64Å; L373-F383 HydrophobicContact CD2-CZ 4.31Å; L373-F383 HydrophobicContact CG-CG 4.49Å; L373-V411 HydrophobicContact CD2-CB 4.36Å; L373-V411 HydrophobicContact CD2-CG1 3.66Å
374	P	89.5	Confident	94.2	Very high	79 Å²	79	41.1 Å²	41.1	51%	0.513	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	158.3	167.7	31.2	-34.3	0	0	0	111.1
375	P	88.6	Confident	94.3	Very high	138 Å²	138	41.2 Å²	41.2	90%	0.896	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	cis	-89.4	-14.3	-2.9	35.1	-34.8	0	0	0	113.9
376	D	88.8	Confident	94.2	Very high	118 Å²	118	42.8 Å²	42.8	63%	0.631	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-8.9	-170	64.8	-11.7	0	0	0	113.8	R378	D376-R378 PolarHBondContact O-N 3.2Å; D376-R378 WeakPolarHBondContact OD1-CB 3.4Å; D376-R378 PolarHBondContact OD1-N 2.83Å; D376-R378 VanDerWaalsContact OD1-N 3.15Å
377	G	89.3	Confident	94	Very high	31 Å²	31	45.7 Å²	45.7	32%	0.32	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	22.8	-178.6	0	0	0	0	0	112.5	K372 L373 V379	K372-G377 WeakPolarHBondContact CD-O 3.3Å; K372-G377 VanDerWaalsContact CG-O 3.29Å; K372-G377 WeakPolarHBondContact CG-O 3.09Å; L373-G377 WeakPolarHBondContact O-CA 3.34Å; L373-G377 PolarHBondContact O-N 3.46Å; G377-V379 PolarHBondContact O-N 3.07Å
378	R	92.9	Very high	93.7	Very high	181 Å²	181	48.8 Å²	48.8	68%	0.683	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	131.3	177.7	178.5	177.8	175	-170.8	-1.7	110.1	K372 L373 D376 S380	K372-R378 WeakPolarHBondContact CA-O 3.1Å; L373-R378 PolarHBondContact N-O 2.91Å; D376-R378 PolarHBondContact O-N 3.2Å; D376-R378 WeakPolarHBondContact OD1-CB 3.4Å; D376-R378 PolarHBondContact OD1-N 2.83Å; D376-R378 VanDerWaalsContact OD1-N 3.15Å; R378-S380 PolarHBondContact O-N 3.29Å
379	V	93.9	Very high	93.2	Very high	49 Å²	49	54.8 Å²	54.8	30%	0.297	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	125.8	172.5	-175.1	0	0	0	0	108.9	A371 K372 G377 Y414	A371-V379 WeakPolarHBondContact O-CA 3.27Å; K372-V379 HydrophobicContact CG-CG2 3.89Å; G377-V379 PolarHBondContact O-N 3.07Å; V379-Y414 HydrophobicContact CB-CD1 4.33Å; V379-Y414 HydrophobicContact CG1-CD1 3.94Å; V379-Y414 HydrophobicContact CG1-CE1 4.46Å; V379-Y414 HydrophobicContact CG2-CD1 3.42Å; V379-Y414 VanDerWaalsContact CG2-CD1 3.42Å; V379-Y414 HydrophobicContact CG2-CE1 3.5Å
380	S	94.6	Very high	92.9	Very high	24 Å²	24	63.9 Å²	63.9	17%	0.168	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.3	173.1	-165.4	0	0	0	0	111.2	G370 A371 R378 E382	G370-S380 PolarHBondContact N-O 3.46Å; A371-S380 PolarHBondContact N-O 2.99Å; A371-S380 PolarHBondContact O-N 3.11Å; R378-S380 PolarHBondContact O-N 3.29Å; S380-E382 PolarHBondContact OG-N 2.88Å; S380-E382 PolarHBondContact OG-O 3.27Å
381	H	94.1	Very high	92.7	Very high	42 Å²	42	67.2 Å²	67.2	19%	0.194	38%	0.376	C	S	.	.	S	Bend	trans	-103.7	12.1	171.5	-60.3	-70.3	0	0	0	112	F369 P416 N418 P421	F369-H381 WeakPolarHBondContact CB-O 3.37Å; H381-P416 PolarHBondContact CE1-O 3.34Å; H381-P416 PolarHBondContact ND1-O 2.9Å; H381-N418 HydrophobicContact CB-CB 4.29Å; H381-N418 PolarHBondContact CE1-ND2 3.34Å; H381-N418 PolarHBondContact NE2-ND2 3.06Å; H381-P421 HydrophobicContact CB-CB 4.27Å; H381-P421 HydrophobicContact CB-CG 3.78Å
382	E	94.9	Very high	92.5	Very high	62 Å²	62	68 Å²	68	29%	0.29	38%	0.381	S	S	.	.	S	Bend	trans	-165.7	117.1	174	-178.4	-170.9	119.2	0	0	108.6	L367 G368 S380 P421 V422 H425	L367-E382 HydrophobicContact CD1-CG 4.39Å; G368-E382 CarbonylContact O-C 3.51Å; G368-E382 VanDerWaalsContact O-CA 3.3Å; G368-E382 WeakPolarHBondContact O-CA 3.33Å; S380-E382 PolarHBondContact OG-N 2.88Å; S380-E382 PolarHBondContact OG-O 3.27Å; E382-P421 HydrophobicContact CB-CB 4.4Å; E382-V422 HydrophobicContact CB-CG1 4.45Å; E382-V422 HydrophobicContact CG-CG1 4.41Å; E382-H425 IonicContact OE1-CE1 2.96Å; E382-H425 PolarHBondContact OE1-CE1 3.3Å; E382-H425 IonicContact OE1-CG 3.98Å; E382-H425 IonicContact OE1-ND1 2.83Å; E382-H425 PolarHBondContact OE1-ND1 3.41Å; E382-H425 WeakPolarHBondContact OE2-CB 3.4Å; E382-H425 IonicContact OE2-CG 3.4Å; E382-H425 IonicContact OE2-ND1 2.75Å; E382-H425 PolarHBondContact OE2-ND1 2.82Å
383	F	95.8	Very high	92.4	Very high	7 Å²	7	69.8 Å²	69.8	3%	0.031	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	146.6	174.6	62.9	-89.6	0	0	0	111.5	F320 L367 G368 A371 L373 L385 V411	F320-F383 HydrophobicContact CB-CZ 4.32Å; F320-F383 HydrophobicContact CD1-CZ 4.39Å; F320-F383 HydrophobicContact CD2-CZ 4.11Å; F320-F383 HydrophobicContact CG-CZ 4.05Å; L367-F383 CarbonylContact C-O 3.56Å; L367-F383 VanDerWaalsContact CA-O 3.28Å; L367-F383 WeakPolarHBondContact CA-O 3.27Å; G368-F383 VanDerWaalsContact C-CD1 3.47Å; G368-F383 PolarHBondContact N-O 2.77Å; G368-F383 WeakPolarHBondContact O-CD1 3.38Å; G368-F383 WeakPolarHBondContact O-CE1 3.24Å; G368-F383 PolarHBondContact O-N 2.87Å; A371-F383 HydrophobicContact CB-CE1 3.64Å; A371-F383 HydrophobicContact CB-CZ 3.88Å; L373-F383 HydrophobicContact CD1-CB 3.73Å; L373-F383 HydrophobicContact CD1-CG 4.22Å; L373-F383 HydrophobicContact CD2-CB 4.09Å; L373-F383 HydrophobicContact CD2-CD1 3.83Å; L373-F383 HydrophobicContact CD2-CD2 3.81Å; L373-F383 HydrophobicContact CD2-CE1 4.16Å; L373-F383 HydrophobicContact CD2-CE2 4.14Å; L373-F383 HydrophobicContact CD2-CG 3.64Å; L373-F383 HydrophobicContact CD2-CZ 4.31Å; L373-F383 HydrophobicContact CG-CG 4.49Å; F383-L385 HydrophobicContact CD2-CD2 4.44Å; F383-L385 HydrophobicContact CE2-CD2 3.83Å; F383-L385 HydrophobicContact CZ-CD2 4.4Å; F383-L385 PolarHBondContact O-N 2.86Å; F383-V411 HydrophobicContact CE2-CG1 3.93Å; F383-V411 HydrophobicContact CZ-CG1 4.2Å; F383-V411 HydrophobicContact CZ-CG2 4.35Å
384	P	96.3	Very high	92.4	Very high	20 Å²	20	68.1 Å²	68.1	13%	0.13	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	128.6	177.3	30.5	-37.3	0	0	0	110.7	N386 G387 N388 V389 P392	P384-N386 PolarHBondContact O-N 3.36Å; P384-G387 PolarHBondContact O-N 3.48Å; P384-N388 WeakPolarHBondContact CB-O 3.16Å; P384-N388 WeakPolarHBondContact CG-O 3.32Å; P384-V389 HydrophobicContact CG-CG2 4.19Å; P384-P392 HydrophobicContact CB-CB 3.94Å
385	L	96.4	Very high	92.6	Very high	2 Å²	2	70 Å²	70	1%	0.01	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-29.1	-179.4	-64.5	-173.6	0	0	0	112.7	I318 F320 A366 F383 G387 A403 S407	I318-L385 HydrophobicContact CD1-CD1 3.58Å; I318-L385 HydrophobicContact CG1-CD1 4.13Å; F320-L385 HydrophobicContact CD2-CD2 4.47Å; F320-L385 HydrophobicContact CE2-CD2 3.58Å; F320-L385 HydrophobicContact CZ-CD2 3.87Å; A366-L385 HydrophobicContact CB-CB 4.16Å; A366-L385 HydrophobicContact CB-CD1 3.99Å; A366-L385 HydrophobicContact CB-CG 4.22Å; A366-L385 PolarHBondContact O-N 2.8Å; F383-L385 HydrophobicContact CD2-CD2 4.44Å; F383-L385 HydrophobicContact CE2-CD2 3.83Å; F383-L385 HydrophobicContact CZ-CD2 4.4Å; F383-L385 PolarHBondContact O-N 2.86Å; L385-G387 PolarHBondContact O-N 3.3Å; L385-A403 HydrophobicContact CB-CB 3.94Å; L385-S407 WeakPolarHBondContact CA-OG 3.44Å; L385-S407 PolarHBondContact O-OG 3.44Å
386	N	93.9	Very high	92.8	Very high	46 Å²	46	63.9 Å²	63.9	25%	0.246	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-2.1	176.1	71.7	2.5	0	0	0	113.1	P384 N388 N391 Y393 A403	P384-N386 PolarHBondContact O-N 3.36Å; N386-N388 PolarHBondContact O-N 2.96Å; N386-N388 PolarHBondContact OD1-N 3.09Å; N386-N391 PolarHBondContact ND2-O 3.19Å; N386-Y393 PolarHBondContact ND2-O 3.4Å; N386-A403 HydrophobicContact CB-CB 4.24Å
387	G	91.6	Very high	92.9	Very high	62 Å²	62	58.8 Å²	58.8	64%	0.639	32%	0.319	S	S	*	.	S	Bend	trans	75.8	1.1	-179.6	0	0	0	0	0	115.4	P384 L385	P384-G387 PolarHBondContact O-N 3.48Å; L385-G387 PolarHBondContact O-N 3.3Å
388	N	91	Very high	93.1	Very high	68 Å²	68	65.4 Å²	65.4	36%	0.364	34%	0.342	S	S	.	.			trans	-101.9	106.7	179.9	-173.3	-14	0	0	0	111.3	P384 N386 E390 N391	P384-N388 WeakPolarHBondContact CB-O 3.16Å; P384-N388 WeakPolarHBondContact CG-O 3.32Å; N386-N388 PolarHBondContact O-N 2.96Å; N386-N388 PolarHBondContact OD1-N 3.09Å; N388-E390 VanDerWaalsContact C-N 3.3Å; N388-E390 PolarHBondContact O-N 3.03Å; N388-E390 PolarHBondContact OD1-N 2.85Å; N388-N391 WeakPolarHBondContact CB-O 3.15Å; N388-N391 CarbonylContact O-C 3.51Å; N388-N391 VanDerWaalsContact O-C 3.26Å; N388-N391 PolarHBondContact O-N 3.42Å; N388-N391 PolarHBondContact OD1-N 2.86Å; N388-N391 VanDerWaalsContact OD1-N 3.16Å
389	V	87.4	Confident	93.2	Very high	126 Å²	126	57.4 Å²	57.4	76%	0.764	32%	0.316	S	S	*	.	S	Bend	trans	-68.5	-28.5	-179	-177.1	0	0	0	0	112.6	P384	P384-V389 HydrophobicContact CG-CG2 4.19Å
390	E	90.1	Very high	93.2	Very high	191 Å²	191	55.1 Å²	55.1	89%	0.893	30%	0.302	S	S	*	.	S	Bend	trans	-80.9	-26.3	178.5	-61.2	-174.2	164.6	0	0	112.1	N388	N388-E390 VanDerWaalsContact C-N 3.3Å; N388-E390 PolarHBondContact O-N 3.03Å; N388-E390 PolarHBondContact OD1-N 2.85Å
391	N	90.8	Very high	93.2	Very high	70 Å²	70	55.1 Å²	55.1	37%	0.374	30%	0.3	S	S	.	.			trans	-142.7	91	-177.5	-176.5	8.2	0	0	0	111.5	N386 N388 Y393	N386-N391 PolarHBondContact ND2-O 3.19Å; N388-N391 WeakPolarHBondContact CB-O 3.15Å; N388-N391 CarbonylContact O-C 3.51Å; N388-N391 VanDerWaalsContact O-C 3.26Å; N388-N391 PolarHBondContact O-N 3.42Å; N388-N391 PolarHBondContact OD1-N 2.86Å; N388-N391 VanDerWaalsContact OD1-N 3.16Å; N391-Y393 PolarHBondContact O-N 2.78Å; N391-Y393 WeakPolarHBondContact OD1-CB 3.23Å; N391-Y393 WeakPolarHBondContact OD1-CD2 3.37Å; N391-Y393 PolarHBondContact OD1-N 2.9Å
392	P	92.8	Very high	93.3	Very high	17 Å²	17	59.7 Å²	59.7	11%	0.11	32%	0.321	C	S	.	.			trans	-76.6	1.6	180	32.5	-37.5	0	0	0	114.1	P365 A366 L367 P384	P365-P392 HydrophobicContact CB-CG 4.33Å; A366-P392 PolarHBondContact N-O 2.63Å; A366-P392 VanDerWaalsContact N-O 3.14Å; L367-P392 HydrophobicContact CD2-CB 4.3Å; P384-P392 HydrophobicContact CB-CB 3.94Å
393	Y	93.9	Very high	93.4	Very high	89 Å²	89	57 Å²	57	35%	0.349	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	137	-170.7	-67.1	-104.3	0	0	0	112.2	M363 F364 P365 N386 N391	M363-Y393 HydrophobicContact CB-CD1 3.81Å; M363-Y393 HydrophobicContact CB-CG 4.46Å; M363-Y393 VanDerWaalsContact O-CD1 3.28Å; M363-Y393 WeakPolarHBondContact O-CD1 3.37Å; F364-Y393 CarbonylContact O-C 3.54Å; F364-Y393 WeakPolarHBondContact O-CA 3.46Å; P365-Y393 HydrophobicContact CG-CD1 3.83Å; P365-Y393 HydrophobicContact CG-CE1 3.5Å; P365-Y393 VanDerWaalsContact CG-CE1 3.5Å; P365-Y393 HydrophobicContact CG-CE2 4.24Å; P365-Y393 HydrophobicContact CG-CG 4.35Å; N386-Y393 PolarHBondContact ND2-O 3.4Å; N391-Y393 PolarHBondContact O-N 2.78Å; N391-Y393 WeakPolarHBondContact OD1-CB 3.23Å; N391-Y393 WeakPolarHBondContact OD1-CD2 3.37Å; N391-Y393 PolarHBondContact OD1-N 2.9Å
394	C	94.7	Very high	93.4	Very high	8 Å²	8	56.6 Å²	56.6	5%	0.054	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	141.4	175.1	-67.2	0	0	0	0	110.1	M363 F364 G396 I400	M363-C394 WeakPolarHBondContact CA-O 3.42Å; F364-C394 PolarHBondContact N-O 3.18Å; F364-C394 PolarHBondContact O-N 3.27Å; C394-G396 PolarHBondContact O-N 3.45Å; C394-I400 HydrophobicContact CB-CG1 3.81Å
395	N	93.8	Very high	93.3	Very high	119 Å²	119	58.8 Å²	58.8	64%	0.636	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	106.3	177.9	-177.8	17.8	0	0	0	110.6	M363 G399	M363-N395 HydrophobicContact SD-CB 4.01Å; N395-G399 WeakPolarHBondContact O-CA 3.46Å; N395-G399 PolarHBondContact O-N 3.34Å; N395-G399 VanDerWaalsContact O-N 3.11Å
396	G	92.3	Very high	93.2	Very high	9 Å²	9	63.9 Å²	63.9	9%	0.093	34%	0.34	C	S	.	.	H	α-helix	trans	64.2	-177.9	179	0	0	0	0	0	114.3	K362 C394 E398 G399 I400	K362-G396 WeakPolarHBondContact O-CA 3.35Å; K362-G396 PolarHBondContact O-N 3.31Å; C394-G396 PolarHBondContact O-N 3.45Å; G396-E398 VanDerWaalsContact C-N 3.27Å; G396-E398 PolarHBondContact O-N 2.97Å; G396-G399 PolarHBondContact O-N 2.92Å; G396-I400 PolarHBondContact O-N 2.98Å
397	M	91	Very high	93.3	Very high	12 Å²	12	61.9 Å²	61.9	6%	0.059	33%	0.33	C	S	.	.	H	α-helix	trans	-65.8	-30.6	177.1	-68.1	-50.3	-52.6	0	0	113.4	F314 L348 G352 I400 L401	F314-M397 HydrophobicContact CE1-SD 4.48Å; L348-M397 HydrophobicContact CB-CE 4.29Å; L348-M397 VanDerWaalsContact O-CE 3.26Å; L348-M397 WeakPolarHBondContact O-CE 3.31Å; G352-M397 WeakPolarHBondContact CA-SD 3.28Å; M397-I400 HydrophobicContact CE-CD1 3.96Å; M397-I400 PolarHBondContact O-N 2.8Å; M397-I400 HydrophobicContact SD-CD1 3.7Å; M397-L401 WeakPolarHBondContact O-CG 3.44Å; M397-L401 PolarHBondContact O-N 3.41Å
398	E	92.2	Very high	93.4	Very high	169 Å²	169	59.5 Å²	59.5	79%	0.79	30%	0.302	S	S	*	.	H	α-helix	trans	-64.2	-42.9	176.1	-71.6	152.9	177.6	0	0	110.9	G396 L401 E402	G396-E398 VanDerWaalsContact C-N 3.27Å; G396-E398 PolarHBondContact O-N 2.97Å; E398-L401 PolarHBondContact O-N 3.24Å; E398-E402 PolarHBondContact O-N 2.89Å
399	G	95.1	Very high	93.5	Very high	14 Å²	14	63.5 Å²	63.5	14%	0.144	32%	0.317	C	S	.	.	H	α-helix	trans	-63.7	-39.8	174.7	0	0	0	0	0	113.1	N395 G396 E402 A403	N395-G399 WeakPolarHBondContact O-CA 3.46Å; N395-G399 PolarHBondContact O-N 3.34Å; N395-G399 VanDerWaalsContact O-N 3.11Å; G396-G399 PolarHBondContact O-N 2.92Å; G399-E402 PolarHBondContact O-N 3Å; G399-A403 WeakPolarHBondContact O-CB 3.34Å; G399-A403 PolarHBondContact O-N 3.23Å
400	I	95.4	Very high	93.7	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.1	-46.4	175.4	-64.7	168.9	0	0	0	110.6	V316 L348 F364 A366 C394 G396 M397 E402 A403 Y404	V316-I400 HydrophobicContact CG2-CD1 4.07Å; L348-I400 HydrophobicContact CD1-CG2 4.43Å; L348-I400 HydrophobicContact CD2-CG2 4.36Å; F364-I400 HydrophobicContact CB-CD1 3.5Å; F364-I400 HydrophobicContact CB-CG1 4.15Å; F364-I400 HydrophobicContact CD2-CD1 3.88Å; F364-I400 HydrophobicContact CG-CD1 3.97Å; A366-I400 HydrophobicContact CB-CG1 4.26Å; A366-I400 HydrophobicContact CB-CG2 4.28Å; C394-I400 HydrophobicContact CB-CG1 3.81Å; G396-I400 PolarHBondContact O-N 2.98Å; M397-I400 HydrophobicContact CE-CD1 3.96Å; M397-I400 PolarHBondContact O-N 2.8Å; M397-I400 HydrophobicContact SD-CD1 3.7Å; I400-E402 VanDerWaalsContact C-N 3.35Å; I400-E402 PolarHBondContact O-N 3.42Å; I400-A403 PolarHBondContact O-N 2.72Å; I400-Y404 VanDerWaalsContact O-CB 3.32Å; I400-Y404 WeakPolarHBondContact O-CB 3.44Å; I400-Y404 PolarHBondContact O-N 3.39Å
401	L	94.6	Very high	93.9	Very high	25 Å²	25	53 Å²	53	13%	0.131	27%	0.266	C	S	.	.	H	α-helix	trans	-63.9	-39.9	179.5	-73.5	171.5	0	0	0	111.9	A345 L348 M397 E398 H405	A345-L401 HydrophobicContact CB-CD2 3.98Å; L348-L401 HydrophobicContact CB-CD2 4.36Å; L348-L401 HydrophobicContact CD1-CD2 3.98Å; M397-L401 WeakPolarHBondContact O-CG 3.44Å; M397-L401 PolarHBondContact O-N 3.41Å; E398-L401 PolarHBondContact O-N 3.24Å; L401-H405 VanDerWaalsContact O-CG 3.22Å; L401-H405 PolarHBondContact O-N 3.12Å; L401-H405 PolarHBondContact O-ND1 3.25Å; L401-H405 VanDerWaalsContact O-ND1 3.08Å
402	E	94.8	Very high	94.1	Very high	137 Å²	137	55.5 Å²	55.5	64%	0.64	28%	0.275	S	S	*	.	H	α-helix	trans	-62.6	-49.4	174.4	-175.2	173.5	-164.9	0	0	111.5	E398 G399 I400 Y404 H405 Q406	E398-E402 PolarHBondContact O-N 2.89Å; G399-E402 PolarHBondContact O-N 3Å; I400-E402 VanDerWaalsContact C-N 3.35Å; I400-E402 PolarHBondContact O-N 3.42Å; E402-Y404 VanDerWaalsContact C-N 3.34Å; E402-Y404 PolarHBondContact O-N 2.86Å; E402-H405 PolarHBondContact O-N 2.99Å; E402-Q406 WeakPolarHBondContact O-CB 3.08Å; E402-Q406 PolarHBondContact O-N 2.98Å
403	A	96.6	Very high	94.3	Very high	5 Å²	5	55.9 Å²	55.9	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-41.5	178.3	0	0	0	0	0	112.1	L385 N386 G399 I400 Q406 S407	L385-A403 HydrophobicContact CB-CB 3.94Å; N386-A403 HydrophobicContact CB-CB 4.24Å; G399-A403 WeakPolarHBondContact O-CB 3.34Å; G399-A403 PolarHBondContact O-N 3.23Å; I400-A403 PolarHBondContact O-N 2.72Å; A403-Q406 PolarHBondContact O-N 3.36Å; A403-S407 WeakPolarHBondContact O-CB 3.34Å; A403-S407 PolarHBondContact O-N 3.26Å
404	Y	96.8	Very high	94.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.6	-51.1	173.8	165.3	-116.4	0	0	0	112	I318 F320 H334 N342 Y344 I400 E402 Q406 S407 L408	I318-Y404 HydrophobicContact CD1-CD2 3.53Å; I318-Y404 HydrophobicContact CD1-CE2 4.21Å; I318-Y404 HydrophobicContact CD1-CG 3.94Å; I318-Y404 HydrophobicContact CG2-CD2 4.1Å; I318-Y404 HydrophobicContact CG2-CE2 3.91Å; F320-Y404 HydrophobicContact CE2-CD2 4.09Å; F320-Y404 HydrophobicContact CE2-CE2 4.35Å; F320-Y404 AromaticContact CZ-CD2 3.75Å; F320-Y404 HydrophobicContact CZ-CD2 3.75Å; F320-Y404 HydrophobicContact CZ-CE2 4.07Å; H334-Y404 AromaticContact ND1-CE2 3.73Å; H334-Y404 AromaticContact ND1-CZ 3.7Å; H334-Y404 PolarHBondContact ND1-OH 2.77Å; N342-Y404 PolarHBondContact ND2-OH 3.2Å; N342-Y404 PolarHBondContact OD1-OH 3.16Å; Y344-Y404 WeakPolarHBondContact CB-OH 3.35Å; I400-Y404 VanDerWaalsContact O-CB 3.32Å; I400-Y404 WeakPolarHBondContact O-CB 3.44Å; I400-Y404 PolarHBondContact O-N 3.39Å; E402-Y404 VanDerWaalsContact C-N 3.34Å; E402-Y404 PolarHBondContact O-N 2.86Å; Y404-Q406 VanDerWaalsContact C-N 3.3Å; Y404-Q406 PolarHBondContact O-N 3.33Å; Y404-S407 PolarHBondContact O-N 3.05Å; Y404-L408 HydrophobicContact CD2-CD1 4.24Å; Y404-L408 HydrophobicContact CD2-CG 4.34Å; Y404-L408 HydrophobicContact CE1-CD1 3.97Å; Y404-L408 HydrophobicContact CE2-CD1 3.62Å; Y404-L408 HydrophobicContact CE2-CD2 4.39Å; Y404-L408 HydrophobicContact CE2-CG 3.95Å; Y404-L408 VanDerWaalsContact CZ-CD1 3.49Å; Y404-L408 PolarHBondContact O-N 3.34Å
405	H	94.1	Very high	94.2	Very high	65 Å²	65	57 Å²	57	30%	0.301	29%	0.285	S	S	.	.	H	α-helix	trans	-64.1	-34.6	178.4	-66	146.7	0	0	0	112.9	M336 L401 E402	M336-H405 HydrophobicContact SD-CB 4.16Å; L401-H405 VanDerWaalsContact O-CG 3.22Å; L401-H405 PolarHBondContact O-N 3.12Å; L401-H405 PolarHBondContact O-ND1 3.25Å; L401-H405 VanDerWaalsContact O-ND1 3.08Å; E402-H405 PolarHBondContact O-N 2.99Å
406	Q	94.3	Very high	94.2	Very high	109 Å²	109	54.3 Å²	54.3	51%	0.509	27%	0.273	S	S	.	.	H	α-helix	trans	-68.9	-47.1	175.6	-174.5	175.1	-1.4	0	0	111.1	E402 A403 Y404 L408 K409 T410	E402-Q406 WeakPolarHBondContact O-CB 3.08Å; E402-Q406 PolarHBondContact O-N 2.98Å; A403-Q406 PolarHBondContact O-N 3.36Å; Y404-Q406 VanDerWaalsContact C-N 3.3Å; Y404-Q406 PolarHBondContact O-N 3.33Å; Q406-L408 VanDerWaalsContact C-N 3.31Å; Q406-L408 PolarHBondContact O-N 3.03Å; Q406-K409 WeakPolarHBondContact O-CB 3.43Å; Q406-K409 PolarHBondContact O-N 3.32Å; Q406-T410 PolarHBondContact O-N 2.84Å; Q406-T410 PolarHBondContact O-OG1 2.87Å
407	S	95.2	Very high	94.2	Very high	5 Å²	5	54.4 Å²	54.4	4%	0.035	27%	0.272	C	S	.	.	H	α-helix	trans	-58.3	-40.7	177.5	-95.1	0	0	0	0	112.4	L385 A403 Y404 K409 T410 V411	L385-S407 WeakPolarHBondContact CA-OG 3.44Å; L385-S407 PolarHBondContact O-OG 3.44Å; A403-S407 WeakPolarHBondContact O-CB 3.34Å; A403-S407 PolarHBondContact O-N 3.26Å; Y404-S407 PolarHBondContact O-N 3.05Å; S407-K409 PolarHBondContact O-N 2.71Å; S407-K409 VanDerWaalsContact O-N 3.08Å; S407-T410 WeakPolarHBondContact CA-OG1 3.36Å; S407-T410 PolarHBondContact O-N 2.99Å; S407-T410 PolarHBondContact O-OG1 2.61Å; S407-T410 VanDerWaalsContact O-OG1 3.09Å; S407-V411 WeakPolarHBondContact O-CG2 3.49Å; S407-V411 PolarHBondContact O-N 2.91Å
408	L	94.3	Very high	94.4	Very high	11 Å²	11	55 Å²	55	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-23	176.9	-80	174.9	0	0	0	114.2	F320 P327 H334 M336 Y404 Q406 L413	F320-L408 HydrophobicContact CD1-CD2 3.81Å; F320-L408 HydrophobicContact CE1-CB 4.32Å; F320-L408 HydrophobicContact CE1-CD2 3.4Å; F320-L408 HydrophobicContact CE1-CG 3.64Å; F320-L408 HydrophobicContact CZ-CD2 4.13Å; F320-L408 HydrophobicContact CZ-CG 4.08Å; P327-L408 HydrophobicContact CB-CD2 4.5Å; P327-L408 HydrophobicContact CG-CD2 3.99Å; H334-L408 HydrophobicContact CB-CD1 4.02Å; H334-L408 HydrophobicContact CB-CD2 3.74Å; M336-L408 HydrophobicContact CE-CB 4.37Å; M336-L408 HydrophobicContact CG-CD1 4.38Å; M336-L408 HydrophobicContact SD-CD1 4.41Å; Y404-L408 HydrophobicContact CD2-CD1 4.24Å; Y404-L408 HydrophobicContact CD2-CG 4.34Å; Y404-L408 HydrophobicContact CE1-CD1 3.97Å; Y404-L408 HydrophobicContact CE2-CD1 3.62Å; Y404-L408 HydrophobicContact CE2-CD2 4.39Å; Y404-L408 HydrophobicContact CE2-CG 3.95Å; Y404-L408 VanDerWaalsContact CZ-CD1 3.49Å; Y404-L408 PolarHBondContact O-N 3.34Å; Q406-L408 VanDerWaalsContact C-N 3.31Å; Q406-L408 PolarHBondContact O-N 3.03Å; L408-L413 HydrophobicContact CD2-CD2 4.33Å
409	K	92.8	Very high	94.6	Very high	153 Å²	153	47 Å²	47	67%	0.665	24%	0.238	S	C	*	.	H	α-helix	trans	-89.3	-17.9	178.6	-63.4	171.1	-173.1	171.9	0	112.9	M336 Q406 S407	M336-K409 HydrophobicContact CE-CG 4.12Å; Q406-K409 WeakPolarHBondContact O-CB 3.43Å; Q406-K409 PolarHBondContact O-N 3.32Å; S407-K409 PolarHBondContact O-N 2.71Å; S407-K409 VanDerWaalsContact O-N 3.08Å
410	T	92.3	Very high	94.7	Very high	78 Å²	78	46.8 Å²	46.8	48%	0.479	24%	0.235	S	C	.	.	H	α-helix	trans	-109.3	-34.1	-170.5	57.7	0	0	0	0	113	Q406 S407	Q406-T410 PolarHBondContact O-N 2.84Å; Q406-T410 PolarHBondContact O-OG1 2.87Å; S407-T410 WeakPolarHBondContact CA-OG1 3.36Å; S407-T410 PolarHBondContact O-N 2.99Å; S407-T410 PolarHBondContact O-OG1 2.61Å; S407-T410 VanDerWaalsContact O-OG1 3.09Å
411	V	94.4	Very high	94.8	Very high	19 Å²	19	48.7 Å²	48.7	12%	0.115	25%	0.247	C	C	.	.	S	Bend	trans	-91.8	156.1	-179.1	-48.5	0	0	0	0	111.6	F320 A371 L373 F383 S407	F320-V411 HydrophobicContact CD1-CG2 3.44Å; F320-V411 VanDerWaalsContact CD1-CG2 3.44Å; F320-V411 HydrophobicContact CE1-CG2 3.85Å; F320-V411 HydrophobicContact CG-CG2 4.36Å; A371-V411 HydrophobicContact CB-CB 4Å; A371-V411 HydrophobicContact CB-CG2 3.82Å; L373-V411 HydrophobicContact CD2-CB 4.36Å; L373-V411 HydrophobicContact CD2-CG1 3.66Å; F383-V411 HydrophobicContact CE2-CG1 3.93Å; F383-V411 HydrophobicContact CZ-CG1 4.2Å; F383-V411 HydrophobicContact CZ-CG2 4.35Å; S407-V411 WeakPolarHBondContact O-CG2 3.49Å; S407-V411 PolarHBondContact O-N 2.91Å
412	Q	95.7	Very high	94.9	Very high	121 Å²	121	47.5 Å²	47.5	57%	0.565	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.4	171.6	175.7	-178.6	26	0	0	109.6	A371 K372 Y414	A371-Q412 CarbonylContact C-O 3.47Å; A371-Q412 WeakPolarHBondContact CA-O 3.26Å; K372-Q412 HydrophobicContact CB-CB 4.17Å; K372-Q412 PolarHBondContact N-O 2.96Å; K372-Q412 PolarHBondContact O-N 3.49Å; Q412-Y414 PolarHBondContact O-N 2.76Å
413	L	95.4	Very high	95.1	Very high	26 Å²	26	41 Å²	41	14%	0.136	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	134.6	177.4	-52.3	-174.1	0	0	0	111.3	F320 A322 N324 G325 P327 L408	F320-L413 HydrophobicContact CB-CD2 3.77Å; F320-L413 HydrophobicContact CD1-CD2 3.63Å; F320-L413 HydrophobicContact CG-CD2 4.1Å; F320-L413 WeakPolarHBondContact O-CA 3.47Å; F320-L413 WeakPolarHBondContact O-CB 3.24Å; F320-L413 VanDerWaalsContact O-CD2 3.23Å; F320-L413 WeakPolarHBondContact O-CD2 3.45Å; A322-L413 HydrophobicContact CB-CB 4.5Å; N324-L413 HydrophobicContact CB-CD1 4.37Å; G325-L413 WeakPolarHBondContact O-CD1 3.49Å; P327-L413 HydrophobicContact CG-CD1 3.85Å; P327-L413 HydrophobicContact CG-CG 4.33Å; L408-L413 HydrophobicContact CD2-CD2 4.33Å
414	Y	94.8	Very high	95.2	Very high	105 Å²	105	44.2 Å²	44.2	41%	0.412	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-149.7	-138.5	-173.4	-163.3	-112.5	0	0	0	112.7	F320 T321 A322 G370 K372 V379 Q412	F320-Y414 PolarHBondContact O-N 3.11Å; T321-Y414 CarbonylContact C-O 3.58Å; T321-Y414 WeakPolarHBondContact CA-O 3.48Å; T321-Y414 VanDerWaalsContact CB-O 3.28Å; T321-Y414 WeakPolarHBondContact CB-O 3.49Å; A322-Y414 PolarHBondContact N-O 3Å; G370-Y414 CarbonylContact O-C 3.59Å; G370-Y414 VanDerWaalsContact O-CA 3.3Å; G370-Y414 WeakPolarHBondContact O-CA 3.49Å; G370-Y414 PolarHBondContact O-N 2.84Å; K372-Y414 HydrophobicContact CD-CD1 4.42Å; K372-Y414 HydrophobicContact CD-CD2 4.15Å; K372-Y414 HydrophobicContact CD-CG 4.07Å; K372-Y414 HydrophobicContact CG-CD1 4.09Å; K372-Y414 HydrophobicContact CG-CD2 4.47Å; K372-Y414 HydrophobicContact CG-CG 3.9Å; V379-Y414 HydrophobicContact CB-CD1 4.33Å; V379-Y414 HydrophobicContact CG1-CD1 3.94Å; V379-Y414 HydrophobicContact CG1-CE1 4.46Å; V379-Y414 HydrophobicContact CG2-CD1 3.42Å; V379-Y414 VanDerWaalsContact CG2-CD1 3.42Å; V379-Y414 HydrophobicContact CG2-CE1 3.5Å; Q412-Y414 PolarHBondContact O-N 2.76Å
415	G	91.6	Very high	95.1	Very high	16 Å²	16	45.1 Å²	45.1	17%	0.165	23%	0.231	C	C	.	.			trans	-179.9	-178	178.4	0	0	0	0	0	111.5	G370	G370-G415 PolarHBondContact O-N 2.81Å
416	P	94	Very high	95.3	Very high	62 Å²	62	42.1 Å²	42.1	40%	0.403	22%	0.217	S	C	.	.			cis	-73.3	174.7	-0.8	29.8	-37.2	0	0	0	115	H381 N418 S451	H381-P416 PolarHBondContact CE1-O 3.34Å; H381-P416 PolarHBondContact ND1-O 2.9Å; P416-N418 PolarHBondContact O-N 2.97Å; P416-S451 WeakPolarHBondContact CB-OG 3.35Å
417	T	93.3	Very high	95.4	Very high	10 Å²	10	37.4 Å²	37.4	6%	0.061	20%	0.197	C	C	.	.			trans	-84.9	102.7	175	-43.8	0	0	0	0	109.9	D319 T321 F369 F419 V449 S451	D319-T417 WeakPolarHBondContact OD2-CG2 3.31Å; T321-T417 HydrophobicContact CG2-CG2 4.36Å; T321-T417 WeakPolarHBondContact CG2-OG1 3.26Å; F369-T417 HydrophobicContact CE2-CG2 3.94Å; T417-F419 HydrophobicContact CG2-CE1 3.77Å; T417-F419 HydrophobicContact CG2-CZ 4.43Å; T417-V449 WeakPolarHBondContact CB-O 3.48Å; T417-V449 WeakPolarHBondContact CG2-O 3.31Å; T417-V449 PolarHBondContact OG1-O 2.9Å; T417-S451 PolarHBondContact N-OG 2.99Å; T417-S451 WeakPolarHBondContact O-CB 3Å; T417-S451 PolarHBondContact O-N 2.8Å
418	N	95.3	Very high	95.5	Very high	26 Å²	26	44.6 Å²	44.6	14%	0.139	22%	0.224	C	C	.	.			trans	-122.5	120.6	-174.1	-70.2	-11.3	0	0	0	111	H381 P416 P421 D452	H381-N418 HydrophobicContact CB-CB 4.29Å; H381-N418 PolarHBondContact CE1-ND2 3.34Å; H381-N418 PolarHBondContact NE2-ND2 3.06Å; P416-N418 PolarHBondContact O-N 2.97Å; N418-P421 HydrophobicContact CB-CG 4.48Å; N418-D452 VanDerWaalsContact CA-CG 3.42Å; N418-D452 WeakPolarHBondContact CA-OD1 3.42Å; N418-D452 WeakPolarHBondContact CA-OD2 3.41Å; N418-D452 HydrophobicContact CB-CB 4.25Å; N418-D452 VanDerWaalsContact CB-OD2 3.28Å; N418-D452 WeakPolarHBondContact CB-OD2 3.45Å; N418-D452 WeakPolarHBondContact OD1-CB 3.42Å
419	F	96.8	Very high	95.5	Very high	1 Å²	1	49.2 Å²	49.2	0%	0.004	24%	0.241	C	C	.	.			trans	-94.8	-25.5	179.6	-63.2	-8.7	0	0	0	112.9	F369 T417 P421 V422 V423 I444 T446 I450 D452 T456 I472 M483	F369-F419 AromaticContact CE2-CD1 3.81Å; F369-F419 HydrophobicContact CE2-CD1 3.81Å; F369-F419 AromaticContact CE2-CE1 3.64Å; F369-F419 HydrophobicContact CE2-CE1 3.64Å; F369-F419 AromaticContact CZ-CD1 3.85Å; F369-F419 HydrophobicContact CZ-CD1 3.85Å; F369-F419 AromaticContact CZ-CE1 3.58Å; F369-F419 HydrophobicContact CZ-CE1 3.58Å; T417-F419 HydrophobicContact CG2-CE1 3.77Å; T417-F419 HydrophobicContact CG2-CZ 4.43Å; F419-P421 VanDerWaalsContact C-N 3.28Å; F419-P421 VanDerWaalsContact O-N 3.16Å; F419-V422 WeakPolarHBondContact O-CG2 3.42Å; F419-V422 PolarHBondContact O-N 3.08Å; F419-V423 HydrophobicContact CB-CG2 4.46Å; F419-V423 WeakPolarHBondContact O-CG2 3.3Å; F419-V423 PolarHBondContact O-N 2.94Å; F419-I444 HydrophobicContact CB-CD1 4.3Å; F419-I444 HydrophobicContact CD1-CG2 4.15Å; F419-I444 HydrophobicContact CD2-CD1 4.23Å; F419-I444 HydrophobicContact CD2-CG2 4.48Å; F419-I444 HydrophobicContact CE1-CG2 3.94Å; F419-I444 HydrophobicContact CE2-CG2 4.28Å; F419-I444 HydrophobicContact CG-CD1 4.19Å; F419-I444 HydrophobicContact CG-CG2 4.46Å; F419-I444 HydrophobicContact CZ-CG2 4.04Å; F419-T446 HydrophobicContact CZ-CG2 3.76Å; F419-I450 HydrophobicContact CB-CD1 4.2Å; F419-I450 HydrophobicContact CD2-CD1 3.54Å; F419-I450 HydrophobicContact CD2-CG1 4.22Å; F419-I450 HydrophobicContact CE2-CD1 3.99Å; F419-I450 HydrophobicContact CE2-CG1 4.39Å; F419-I450 HydrophobicContact CG-CD1 3.95Å; F419-I450 HydrophobicContact CG-CG1 4.38Å; F419-D452 PolarHBondContact N-OD1 2.68Å; F419-D452 PolarHBondContact N-OD2 2.97Å; F419-D452 VanDerWaalsContact N-OD2 3.16Å; F419-T456 HydrophobicContact CB-CG2 4Å; F419-T456 HydrophobicContact CD2-CG2 4.43Å; F419-I472 HydrophobicContact CE2-CD1 4.39Å; F419-I472 HydrophobicContact CE2-CG2 4.46Å; F419-M483 HydrophobicContact CE2-CE 4.2Å; F419-M483 HydrophobicContact CZ-CE 4.03Å
420	A	97.3	Very high	95.7	Very high	8 Å²	8	42 Å²	42	7%	0.066	21%	0.21	C	C	.	.	H	α-helix	trans	-54.5	-38	-175.7	0	0	0	0	0	113.4	N424 D452 Q455 T456 A459	A420-N424 VanDerWaalsContact O-CB 3.27Å; A420-N424 WeakPolarHBondContact O-CB 3.3Å; A420-N424 VanDerWaalsContact O-CG 3.29Å; A420-N424 PolarHBondContact O-N 3.42Å; A420-N424 PolarHBondContact O-ND2 2.93Å; A420-D452 WeakPolarHBondContact CB-OD2 3.29Å; A420-D452 PolarHBondContact N-OD2 3.07Å; A420-Q455 HydrophobicContact CB-CB 3.76Å; A420-T456 PolarHBondContact N-OG1 2.77Å; A420-T456 VanDerWaalsContact N-OG1 3.17Å; A420-A459 HydrophobicContact CB-CB 4.44Å
421	P	97.4	Very high	96	Very high	41 Å²	41	40.4 Å²	40.4	27%	0.266	20%	0.204	S	C	.	.	H	α-helix	trans	-59.7	-52.7	176.8	-26.8	38.5	0	0	0	113	H381 E382 N418 F419 V423 N424 H425	H381-P421 HydrophobicContact CB-CB 4.27Å; H381-P421 HydrophobicContact CB-CG 3.78Å; E382-P421 HydrophobicContact CB-CB 4.4Å; N418-P421 HydrophobicContact CB-CG 4.48Å; F419-P421 VanDerWaalsContact C-N 3.28Å; F419-P421 VanDerWaalsContact O-N 3.16Å; P421-V423 PolarHBondContact O-N 2.84Å; P421-N424 PolarHBondContact O-N 3.3Å; P421-H425 PolarHBondContact O-N 3.22Å
422	V	97.1	Very high	96	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.9	-35.6	-178.4	-65.2	0	0	0	0	112.5	A317 L367 F369 E382 F419 H425 V426 I444	A317-V422 HydrophobicContact CB-CB 4.09Å; A317-V422 HydrophobicContact CB-CG1 4.08Å; A317-V422 HydrophobicContact CB-CG2 4.11Å; L367-V422 HydrophobicContact CD1-CG1 4.49Å; F369-V422 HydrophobicContact CB-CG1 4.37Å; F369-V422 HydrophobicContact CD1-CG1 4.3Å; E382-V422 HydrophobicContact CB-CG1 4.45Å; E382-V422 HydrophobicContact CG-CG1 4.41Å; F419-V422 WeakPolarHBondContact O-CG2 3.42Å; F419-V422 PolarHBondContact O-N 3.08Å; V422-H425 WeakPolarHBondContact O-CB 3.42Å; V422-H425 PolarHBondContact O-N 3.14Å; V422-V426 PolarHBondContact O-N 3.16Å; V422-I444 HydrophobicContact CG2-CD1 4.25Å
423	V	98.1	Very high	95.9	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-48	173.4	175.2	0	0	0	0	110.5	F419 P421 H425 V426 A427 L442 I444 A459 I470	F419-V423 HydrophobicContact CB-CG2 4.46Å; F419-V423 WeakPolarHBondContact O-CG2 3.3Å; F419-V423 PolarHBondContact O-N 2.94Å; P421-V423 PolarHBondContact O-N 2.84Å; V423-H425 VanDerWaalsContact C-N 3.27Å; V423-H425 PolarHBondContact O-N 2.83Å; V423-V426 PolarHBondContact O-N 3.34Å; V423-A427 VanDerWaalsContact O-CB 3.28Å; V423-A427 WeakPolarHBondContact O-CB 3.26Å; V423-A427 PolarHBondContact O-N 3.32Å; V423-L442 HydrophobicContact CG2-CD2 4.08Å; V423-I444 HydrophobicContact CG2-CD1 4.15Å; V423-A459 HydrophobicContact CB-CB 4.15Å; V423-A459 HydrophobicContact CG1-CB 3.74Å; V423-I470 HydrophobicContact CG1-CD1 3.85Å; V423-I470 HydrophobicContact CG2-CD1 4.15Å
424	N	98.1	Very high	95.8	Very high	72 Å²	72	42.2 Å²	42.2	39%	0.385	23%	0.227	S	C	.	.	H	α-helix	trans	-65.6	-30.3	177.7	-76.3	-54.7	0	0	0	112.5	A420 P421 R428	A420-N424 VanDerWaalsContact O-CB 3.27Å; A420-N424 WeakPolarHBondContact O-CB 3.3Å; A420-N424 VanDerWaalsContact O-CG 3.29Å; A420-N424 PolarHBondContact O-N 3.42Å; A420-N424 PolarHBondContact O-ND2 2.93Å; P421-N424 PolarHBondContact O-N 3.3Å; N424-R428 WeakPolarHBondContact O-CG 3.47Å; N424-R428 PolarHBondContact O-N 3.39Å; N424-R428 VanDerWaalsContact O-N 3.12Å
425	H	95.8	Very high	95.7	Very high	19 Å²	19	42.3 Å²	42.3	9%	0.088	24%	0.235	C	C	.	.	H	α-helix	trans	-58.2	-59	173.9	-173.3	113.2	0	0	0	110.7	E382 P421 V422 V423 A427 R428 Y429	E382-H425 IonicContact OE1-CE1 2.96Å; E382-H425 PolarHBondContact OE1-CE1 3.3Å; E382-H425 IonicContact OE1-CG 3.98Å; E382-H425 IonicContact OE1-ND1 2.83Å; E382-H425 PolarHBondContact OE1-ND1 3.41Å; E382-H425 WeakPolarHBondContact OE2-CB 3.4Å; E382-H425 IonicContact OE2-CG 3.4Å; E382-H425 IonicContact OE2-ND1 2.75Å; E382-H425 PolarHBondContact OE2-ND1 2.82Å; P421-H425 PolarHBondContact O-N 3.22Å; V422-H425 WeakPolarHBondContact O-CB 3.42Å; V422-H425 PolarHBondContact O-N 3.14Å; V423-H425 VanDerWaalsContact C-N 3.27Å; V423-H425 PolarHBondContact O-N 2.83Å; H425-A427 VanDerWaalsContact C-N 3.32Å; H425-A427 PolarHBondContact O-N 3.04Å; H425-R428 WeakPolarHBondContact O-CB 3.42Å; H425-R428 PolarHBondContact O-N 2.85Å; H425-R428 VanDerWaalsContact O-N 3.16Å; H425-Y429 AromaticContact CD2-CD2 3.95Å; H425-Y429 AromaticContact CD2-CE2 3.49Å; H425-Y429 VanDerWaalsContact CD2-CE2 3.49Å; H425-Y429 WeakPolarHBondContact CD2-CE2 3.28Å; H425-Y429 AromaticContact NE2-CE2 3.33Å; H425-Y429 VanDerWaalsContact NE2-CE2 3.33Å; H425-Y429 WeakPolarHBondContact NE2-CE2 2.74Å; H425-Y429 VanDerWaalsContact O-CD2 3.24Å; H425-Y429 WeakPolarHBondContact O-CD2 3.25Å
426	V	97	Very high	95.7	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-39	-178.9	-179.8	0	0	0	0	111.2	T315 V422 V423 R428 Y429 A430 F440 L442 M468	T315-V426 HydrophobicContact CG2-CG2 3.81Å; V422-V426 PolarHBondContact O-N 3.16Å; V423-V426 PolarHBondContact O-N 3.34Å; V426-R428 PolarHBondContact O-N 3.23Å; V426-Y429 PolarHBondContact O-N 3.27Å; V426-A430 PolarHBondContact O-N 2.95Å; V426-F440 HydrophobicContact CG1-CB 3.77Å; V426-F440 HydrophobicContact CG1-CD1 4.48Å; V426-F440 HydrophobicContact CG1-CG 4.41Å; V426-L442 HydrophobicContact CB-CD2 4.46Å; V426-L442 HydrophobicContact CG1-CB 4.43Å; V426-L442 HydrophobicContact CG2-CB 4.16Å; V426-L442 HydrophobicContact CG2-CD1 3.98Å; V426-L442 HydrophobicContact CG2-CD2 4.11Å; V426-L442 HydrophobicContact CG2-CG 4.29Å; V426-M468 HydrophobicContact CB-CE 4.1Å; V426-M468 HydrophobicContact CG1-CE 3.93Å
427	A	97.9	Very high	95.6	Very high	11 Å²	11	40.3 Å²	40.3	9%	0.091	22%	0.221	C	C	.	.	H	α-helix	trans	-58.2	-31.8	176.1	0	0	0	0	0	113.3	V423 H425 A431 A463 L466 M468	V423-A427 VanDerWaalsContact O-CB 3.28Å; V423-A427 WeakPolarHBondContact O-CB 3.26Å; V423-A427 PolarHBondContact O-N 3.32Å; H425-A427 VanDerWaalsContact C-N 3.32Å; H425-A427 PolarHBondContact O-N 3.04Å; A427-A431 VanDerWaalsContact O-CB 3.22Å; A427-A431 WeakPolarHBondContact O-CB 3.27Å; A427-A431 PolarHBondContact O-N 3.34Å; A427-A463 HydrophobicContact CB-CB 4.36Å; A427-L466 HydrophobicContact CB-CD1 3.9Å; A427-L466 VanDerWaalsContact O-CD1 3.26Å; A427-L466 WeakPolarHBondContact O-CD1 3.5Å; A427-M468 VanDerWaalsContact CA-SD 3.54Å; A427-M468 HydrophobicContact CB-SD 3.75Å
428	R	96.9	Very high	95.7	Very high	155 Å²	155	42.5 Å²	42.5	59%	0.585	23%	0.23	S	C	*	.	H	α-helix	trans	-65.7	-39.4	175.2	-76.2	-179	-64.5	163.8	-0.5	112.5	N424 H425 V426 A432	N424-R428 WeakPolarHBondContact O-CG 3.47Å; N424-R428 PolarHBondContact O-N 3.39Å; N424-R428 VanDerWaalsContact O-N 3.12Å; H425-R428 WeakPolarHBondContact O-CB 3.42Å; H425-R428 PolarHBondContact O-N 2.85Å; H425-R428 VanDerWaalsContact O-N 3.16Å; V426-R428 PolarHBondContact O-N 3.23Å; R428-A432 PolarHBondContact O-N 3.43Å
429	Y	94.6	Very high	95.7	Very high	109 Å²	109	41.3 Å²	41.3	43%	0.427	22%	0.224	S	C	.	.	H	α-helix	trans	-69.9	-46	176	-67.3	-87.3	0	0	0	110.8	H425 V426 A431 A432	H425-Y429 AromaticContact CD2-CD2 3.95Å; H425-Y429 AromaticContact CD2-CE2 3.49Å; H425-Y429 VanDerWaalsContact CD2-CE2 3.49Å; H425-Y429 WeakPolarHBondContact CD2-CE2 3.28Å; H425-Y429 AromaticContact NE2-CE2 3.33Å; H425-Y429 VanDerWaalsContact NE2-CE2 3.33Å; H425-Y429 WeakPolarHBondContact NE2-CE2 2.74Å; H425-Y429 VanDerWaalsContact O-CD2 3.24Å; H425-Y429 WeakPolarHBondContact O-CD2 3.25Å; V426-Y429 PolarHBondContact O-N 3.27Å; Y429-A431 PolarHBondContact O-N 3.08Å; Y429-A432 WeakPolarHBondContact O-CB 3.37Å; Y429-A432 PolarHBondContact O-N 3.05Å
430	A	96.8	Very high	95.7	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-33.1	175	0	0	0	0	0	112.8	V426 A432 V433 Q434 F440 L466 P467 M468	V426-A430 PolarHBondContact O-N 2.95Å; A430-A432 VanDerWaalsContact C-N 3.3Å; A430-A432 PolarHBondContact O-N 3.25Å; A430-V433 VanDerWaalsContact O-O 3.1Å; A430-Q434 WeakPolarHBondContact O-CG 3.38Å; A430-F440 VanDerWaalsContact CA-CE2 3.5Å; A430-F440 HydrophobicContact CB-CB 4.44Å; A430-F440 HydrophobicContact CB-CD2 3.59Å; A430-F440 HydrophobicContact CB-CE2 4.11Å; A430-F440 HydrophobicContact CB-CG 4.14Å; A430-L466 HydrophobicContact CB-CB 4.04Å; A430-L466 HydrophobicContact CB-CD1 4.39Å; A430-P467 HydrophobicContact CB-CG 4.2Å; A430-P467 WeakPolarHBondContact O-CD 3.19Å; A430-P467 WeakPolarHBondContact O-CG 3.25Å; A430-M468 HydrophobicContact CB-CB 4.09Å; A430-M468 HydrophobicContact CB-CG 4.38Å; A430-M468 HydrophobicContact CB-SD 4.24Å
431	A	97.2	Very high	95.6	Very high	45 Å²	45	41.6 Å²	41.6	37%	0.372	22%	0.223	S	C	.	.	H	α-helix	trans	-70.9	-23.9	175.2	0	0	0	0	0	113.8	A427 Y429 Q434 L466	A427-A431 VanDerWaalsContact O-CB 3.22Å; A427-A431 WeakPolarHBondContact O-CB 3.27Å; A427-A431 PolarHBondContact O-N 3.34Å; Y429-A431 PolarHBondContact O-N 3.08Å; A431-Q434 PolarHBondContact O-NE2 3.27Å; A431-L466 HydrophobicContact CB-CD1 4.03Å; A431-L466 HydrophobicContact CB-CD2 3.97Å
432	A	96.1	Very high	95.6	Very high	82 Å²	82	39.6 Å²	39.6	68%	0.678	21%	0.211	S	C	*	.	H	α-helix	trans	-78.3	-27.6	-178.9	0	0	0	0	0	113.1	R428 Y429 A430	R428-A432 PolarHBondContact O-N 3.43Å; Y429-A432 WeakPolarHBondContact O-CB 3.37Å; Y429-A432 PolarHBondContact O-N 3.05Å; A430-A432 VanDerWaalsContact C-N 3.3Å; A430-A432 PolarHBondContact O-N 3.25Å
433	V	92.9	Very high	95.6	Very high	37 Å²	37	39.6 Å²	39.6	22%	0.224	21%	0.211	C	C	.	.			trans	-130.7	104.7	-178.3	-174.2	0	0	0	0	109.2	A430 D435 S437 Q438 P467	A430-V433 VanDerWaalsContact O-O 3.1Å; V433-D435 WeakPolarHBondContact CG1-OD1 3.25Å; V433-S437 WeakPolarHBondContact CG1-OG 3.43Å; V433-Q438 HydrophobicContact CB-CB 4.41Å; V433-Q438 HydrophobicContact CG1-CB 4.02Å; V433-Q438 HydrophobicContact CG1-CG 4.03Å; V433-P467 WeakPolarHBondContact O-CG 3.5Å
434	Q	93.5	Very high	95.5	Very high	85 Å²	85	39.6 Å²	39.6	40%	0.397	21%	0.211	S	C	.	.			trans	-123	8.4	-175.3	-66.1	-178.7	48.8	0	0	113.3	A430 A431 G436 Y542 I548	A430-Q434 WeakPolarHBondContact O-CG 3.38Å; A431-Q434 PolarHBondContact O-NE2 3.27Å; Q434-G436 PolarHBondContact O-N 3.11Å; Q434-Y542 PolarHBondContact O-OH 2.71Å; Q434-Y542 VanDerWaalsContact O-OH 3.12Å; Q434-I548 WeakPolarHBondContact O-CD1 3.36Å
435	D	93.1	Very high	95.5	Very high	108 Å²	108	36.2 Å²	36.2	58%	0.578	19%	0.192	S	C	*	.	S	Bend	trans	-76.2	-4.2	179.7	64.1	-0.2	0	0	0	113.8	V433 S437	V433-D435 WeakPolarHBondContact CG1-OD1 3.25Å; D435-S437 VanDerWaalsContact OD1-CB 3.27Å; D435-S437 WeakPolarHBondContact OD1-CB 3.37Å; D435-S437 PolarHBondContact OD1-N 2.8Å; D435-S437 PolarHBondContact OD1-OG 3.28Å
436	G	91.8	Very high	95.5	Very high	3 Å²	3	35.3 Å²	35.3	3%	0.031	19%	0.188	C	C	.	.	S	Bend	trans	87.8	3.9	-178.6	0	0	0	0	0	114.5	T310 Q434 Q438 M543	T310-G436 VanDerWaalsContact CG2-O 3.31Å; T310-G436 WeakPolarHBondContact CG2-O 3.36Å; T310-G436 PolarHBondContact OG1-O 2.82Å; Q434-G436 PolarHBondContact O-N 3.11Å; G436-Q438 VanDerWaalsContact C-N 3.28Å; G436-M543 WeakPolarHBondContact O-CE 3.48Å
437	S	92	Very high	95.2	Very high	33 Å²	33	35.8 Å²	35.8	23%	0.231	19%	0.191	C	C	.	.	S	Bend	trans	-71.8	-23.8	173.1	62.2	0	0	0	0	113.2	T310 Q311 V433 D435	T310-S437 WeakPolarHBondContact CA-O 3.42Å; Q311-S437 PolarHBondContact N-O 2.81Å; V433-S437 WeakPolarHBondContact CG1-OG 3.43Å; D435-S437 VanDerWaalsContact OD1-CB 3.27Å; D435-S437 WeakPolarHBondContact OD1-CB 3.37Å; D435-S437 PolarHBondContact OD1-N 2.8Å; D435-S437 PolarHBondContact OD1-OG 3.28Å
438	Q	93.7	Very high	94	Very high	56 Å²	56	35.5 Å²	35.5	26%	0.262	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.6	-176.4	-64.3	-176.4	13.4	0	0	110.6	H313 V433 G436 F440	H313-Q438 VanDerWaalsContact NE2-CD 3.31Å; H313-Q438 WeakPolarHBondContact NE2-CG 3.25Å; H313-Q438 PolarHBondContact NE2-OE1 3.45Å; V433-Q438 HydrophobicContact CB-CB 4.41Å; V433-Q438 HydrophobicContact CG1-CB 4.02Å; V433-Q438 HydrophobicContact CG1-CG 4.03Å; G436-Q438 VanDerWaalsContact C-N 3.28Å; Q438-F440 HydrophobicContact CB-CE2 3.88Å; Q438-F440 HydrophobicContact CB-CZ 4.15Å
439	Y	95.6	Very high	93	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	134.7	172.8	-164.7	-90.4	0	0	0	109.5	Q311 I312 H313 V441 P467 M468 S469 L539 Y542	Q311-Y439 PolarHBondContact O-N 3.14Å; I312-Y439 CarbonylContact C-O 3.57Å; I312-Y439 WeakPolarHBondContact CA-O 3.39Å; H313-Y439 PolarHBondContact N-O 3.18Å; Y439-V441 HydrophobicContact CD1-CG2 4.19Å; Y439-V441 HydrophobicContact CE1-CG2 4.31Å; Y439-P467 HydrophobicContact CD2-CB 3.85Å; Y439-P467 HydrophobicContact CE2-CB 4.32Å; Y439-M468 PolarHBondContact OH-O 3.29Å; Y439-S469 WeakPolarHBondContact CE1-OG 3.01Å; Y439-S469 PolarHBondContact OH-OG 3.43Å; Y439-L539 HydrophobicContact CD1-CD1 4.12Å; Y439-L539 HydrophobicContact CD1-CG 4.49Å; Y439-L539 HydrophobicContact CD2-CB 4.23Å; Y439-L539 HydrophobicContact CD2-CD1 4.09Å; Y439-L539 HydrophobicContact CD2-CG 3.82Å; Y439-L539 HydrophobicContact CE1-CB 4.32Å; Y439-L539 HydrophobicContact CE2-CB 4.03Å; Y439-L539 HydrophobicContact CE2-CG 4.11Å; Y439-L539 HydrophobicContact CG-CB 4.46Å; Y439-L539 HydrophobicContact CG-CD1 3.77Å; Y439-L539 HydrophobicContact CG-CG 4.03Å; Y439-Y542 HydrophobicContact CE2-CD1 4.47Å; Y439-Y542 HydrophobicContact CE2-CG 4.34Å
440	F	96.4	Very high	92.8	Very high	15 Å²	15	28.1 Å²	28.1	7%	0.066	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	131.1	-170.8	-63.1	-96.1	0	0	0	111.3	H313 V426 A430 Q438 P467 M468 S469	H313-F440 HydrophobicContact CB-CD1 3.73Å; H313-F440 HydrophobicContact CB-CE1 3.98Å; H313-F440 HydrophobicContact CB-CG 4.44Å; H313-F440 AromaticContact CD2-CE1 3.72Å; H313-F440 AromaticContact CD2-CZ 3.88Å; V426-F440 HydrophobicContact CG1-CB 3.77Å; V426-F440 HydrophobicContact CG1-CD1 4.48Å; V426-F440 HydrophobicContact CG1-CG 4.41Å; A430-F440 VanDerWaalsContact CA-CE2 3.5Å; A430-F440 HydrophobicContact CB-CB 4.44Å; A430-F440 HydrophobicContact CB-CD2 3.59Å; A430-F440 HydrophobicContact CB-CE2 4.11Å; A430-F440 HydrophobicContact CB-CG 4.14Å; Q438-F440 HydrophobicContact CB-CE2 3.88Å; Q438-F440 HydrophobicContact CB-CZ 4.15Å; F440-P467 PolarHBondContact N-O 2.84Å; F440-M468 HydrophobicContact CB-CB 3.96Å; F440-M468 CarbonylContact O-C 3.54Å; F440-M468 WeakPolarHBondContact O-CA 3.42Å; F440-M468 WeakPolarHBondContact O-CB 3.12Å; F440-S469 PolarHBondContact O-N 3.14Å
441	V	95.9	Very high	92.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	117.9	176.4	-179.3	0	0	0	0	108.9	I312 H313 F314 T315 I355 Y439 S469 I471 I535	I312-V441 HydrophobicContact CG2-CB 4.47Å; I312-V441 HydrophobicContact CG2-CG2 3.69Å; H313-V441 PolarHBondContact O-N 3.21Å; F314-V441 HydrophobicContact CD2-CB 4.23Å; F314-V441 HydrophobicContact CD2-CG1 4.1Å; F314-V441 HydrophobicContact CE2-CG1 4.35Å; T315-V441 PolarHBondContact N-O 2.74Å; I355-V441 HydrophobicContact CD1-CB 3.9Å; I355-V441 HydrophobicContact CD1-CG1 3.73Å; I355-V441 HydrophobicContact CD1-CG2 4.08Å; Y439-V441 HydrophobicContact CD1-CG2 4.19Å; Y439-V441 HydrophobicContact CE1-CG2 4.31Å; V441-S469 WeakPolarHBondContact CA-O 3.34Å; V441-I471 HydrophobicContact CG1-CD1 3.68Å; V441-I471 HydrophobicContact CG1-CG1 4.34Å; V441-I535 HydrophobicContact CG1-CD1 4.17Å; V441-I535 HydrophobicContact CG2-CD1 4.32Å; V441-I535 HydrophobicContact CG2-CG2 4.17Å
442	L	97.2	Very high	92.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	114	176.2	171.6	58.4	0	0	0	110	T315 A317 V423 V426 I444 S469 I470 I471	T315-L442 HydrophobicContact CG2-CD1 3.97Å; T315-L442 CarbonylContact O-C 3.59Å; T315-L442 WeakPolarHBondContact O-CA 3.36Å; A317-L442 HydrophobicContact CB-CD1 3.93Å; V423-L442 HydrophobicContact CG2-CD2 4.08Å; V426-L442 HydrophobicContact CB-CD2 4.46Å; V426-L442 HydrophobicContact CG1-CB 4.43Å; V426-L442 HydrophobicContact CG2-CB 4.16Å; V426-L442 HydrophobicContact CG2-CD1 3.98Å; V426-L442 HydrophobicContact CG2-CD2 4.11Å; V426-L442 HydrophobicContact CG2-CG 4.29Å; L442-I444 HydrophobicContact CD1-CG1 4.3Å; L442-I444 HydrophobicContact CD2-CD1 4.09Å; L442-I444 HydrophobicContact CD2-CG1 4.15Å; L442-I444 HydrophobicContact CG-CD1 4.4Å; L442-I444 HydrophobicContact CG-CG1 3.93Å; L442-S469 PolarHBondContact N-O 2.82Å; L442-I470 CarbonylContact O-C 3.32Å; L442-I470 WeakPolarHBondContact O-CA 3.47Å; L442-I471 PolarHBondContact O-N 2.91Å
443	L	96.8	Very high	92.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117.9	168.7	171.8	63.8	0	0	0	110.5	F314 T315 V316 A317 L348 V351 I445 I471 V473	F314-L443 HydrophobicContact CE2-CB 3.59Å; F314-L443 HydrophobicContact CE2-CD2 4.38Å; F314-L443 HydrophobicContact CZ-CB 3.68Å; F314-L443 HydrophobicContact CZ-CD2 3.67Å; F314-L443 HydrophobicContact CZ-CG 4.32Å; T315-L443 PolarHBondContact O-N 3.17Å; V316-L443 CarbonylContact C-O 3.51Å; A317-L443 PolarHBondContact N-O 2.58Å; L348-L443 HydrophobicContact CD2-CD2 4.37Å; V351-L443 HydrophobicContact CB-CD2 4.08Å; V351-L443 HydrophobicContact CG1-CD2 4.18Å; V351-L443 HydrophobicContact CG2-CD2 4.4Å; L443-I445 HydrophobicContact CD1-CG1 4.16Å; L443-I445 HydrophobicContact CD2-CD1 4.1Å; L443-I445 HydrophobicContact CD2-CG1 4.2Å; L443-I445 HydrophobicContact CG-CD1 4.42Å; L443-I445 HydrophobicContact CG-CG1 3.98Å; L443-I471 CarbonylContact C-O 3.5Å; L443-I471 WeakPolarHBondContact CA-O 3.44Å; L443-I471 HydrophobicContact CD1-CB 4.07Å; L443-I471 HydrophobicContact CD1-CG2 3.49Å; L443-I471 VanDerWaalsContact CD1-CG2 3.49Å; L443-V473 HydrophobicContact CD1-CB 4.48Å; L443-V473 HydrophobicContact CD1-CG2 3.74Å
444	I	97.3	Very high	92.5	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.1	171.1	-56.6	178.6	0	0	0	108.4	A317 F369 F419 V422 V423 L442 I470 I471 I472 V473	A317-I444 HydrophobicContact CB-CG1 4.3Å; A317-I444 WeakPolarHBondContact O-CA 3.5Å; F369-I444 HydrophobicContact CE1-CG2 4.07Å; F369-I444 HydrophobicContact CZ-CG2 3.99Å; F419-I444 HydrophobicContact CB-CD1 4.3Å; F419-I444 HydrophobicContact CD1-CG2 4.15Å; F419-I444 HydrophobicContact CD2-CD1 4.23Å; F419-I444 HydrophobicContact CD2-CG2 4.48Å; F419-I444 HydrophobicContact CE1-CG2 3.94Å; F419-I444 HydrophobicContact CE2-CG2 4.28Å; F419-I444 HydrophobicContact CG-CD1 4.19Å; F419-I444 HydrophobicContact CG-CG2 4.46Å; F419-I444 HydrophobicContact CZ-CG2 4.04Å; V422-I444 HydrophobicContact CG2-CD1 4.25Å; V423-I444 HydrophobicContact CG2-CD1 4.15Å; L442-I444 HydrophobicContact CD1-CG1 4.3Å; L442-I444 HydrophobicContact CD2-CD1 4.09Å; L442-I444 HydrophobicContact CD2-CG1 4.15Å; L442-I444 HydrophobicContact CG-CD1 4.4Å; L442-I444 HydrophobicContact CG-CG1 3.93Å; I444-I470 HydrophobicContact CD1-CG2 4.01Å; I444-I470 HydrophobicContact CG1-CG2 4.47Å; I444-I471 PolarHBondContact N-O 3.29Å; I444-I472 HydrophobicContact CB-CG1 4.39Å; I444-I472 CarbonylContact O-C 3.58Å; I444-I472 WeakPolarHBondContact O-CA 3.37Å; I444-V473 PolarHBondContact O-N 2.92Å
445	I	96.9	Very high	92.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.1	172.2	-48	173.4	0	0	0	108.5	A317 D319 Y344 A347 L348 L443 V473 V475	A317-I445 PolarHBondContact O-N 3.35Å; D319-I445 WeakPolarHBondContact CB-O 3.4Å; D319-I445 PolarHBondContact N-O 3.4Å; Y344-I445 HydrophobicContact CD1-CB 3.82Å; Y344-I445 HydrophobicContact CD1-CG2 3.35Å; Y344-I445 HydrophobicContact CE1-CB 3.98Å; Y344-I445 HydrophobicContact CE1-CG2 3.57Å; Y344-I445 WeakPolarHBondContact CE1-O 3.39Å; Y344-I445 HydrophobicContact CG-CG2 4.15Å; A347-I445 HydrophobicContact CB-CD1 3.98Å; A347-I445 HydrophobicContact CB-CG2 4.47Å; L348-I445 HydrophobicContact CD2-CD1 3.52Å; L348-I445 HydrophobicContact CG-CD1 3.57Å; L443-I445 HydrophobicContact CD1-CG1 4.16Å; L443-I445 HydrophobicContact CD2-CD1 4.1Å; L443-I445 HydrophobicContact CD2-CG1 4.2Å; L443-I445 HydrophobicContact CG-CD1 4.42Å; L443-I445 HydrophobicContact CG-CG1 3.98Å; I445-V473 WeakPolarHBondContact CA-O 3.08Å; I445-V473 HydrophobicContact CG1-CB 4.47Å; I445-V475 HydrophobicContact CG2-CG1 3.79Å; I445-V475 HydrophobicContact CG2-CG2 4.39Å
446	T	95.6	Very high	92.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	151.5	-171	-176.6	0	0	0	0	111.6	D319 F419 G448 I472 V473 G474 V475 M483	D319-T446 WeakPolarHBondContact OD2-CB 3.33Å; D319-T446 PolarHBondContact OD2-OG1 3.32Å; F419-T446 HydrophobicContact CZ-CG2 3.76Å; T446-G448 VanDerWaalsContact C-N 3.33Å; T446-G448 PolarHBondContact OG1-N 2.94Å; T446-I472 HydrophobicContact CG2-CG2 4.18Å; T446-V473 PolarHBondContact N-O 2.66Å; T446-V473 VanDerWaalsContact N-O 3.12Å; T446-G474 CarbonylContact O-C 3.59Å; T446-G474 WeakPolarHBondContact O-CA 3.42Å; T446-V475 WeakPolarHBondContact O-CG2 3.42Å; T446-V475 PolarHBondContact O-N 3.37Å; T446-M483 HydrophobicContact CG2-CE 3.99Å
447	D	91.1	Very high	93.1	Very high	12 Å²	12	26.3 Å²	26.3	6%	0.064	15%	0.153	C	C	.	.	S	Bend	trans	-88.8	1.2	176.3	67.9	-42.2	0	0	0	114.7	S323 N324 L333 Y344 V475 A478	S323-D447 WeakPolarHBondContact CB-OD2 3.48Å; S323-D447 VanDerWaalsContact OG-CG 3.29Å; S323-D447 PolarHBondContact OG-OD1 2.91Å; S323-D447 PolarHBondContact OG-OD2 2.8Å; N324-D447 PolarHBondContact N-OD2 2.94Å; N324-D447 PolarHBondContact ND2-OD1 2.87Å; N324-D447 VanDerWaalsContact OD1-CB 3.3Å; N324-D447 WeakPolarHBondContact OD1-CB 3.36Å; L333-D447 HydrophobicContact CD1-CB 3.35Å; Y344-D447 PolarHBondContact OH-N 3.29Å; D447-V475 CarbonylContact C-O 3.54Å; D447-V475 VanDerWaalsContact CA-O 3.26Å; D447-V475 WeakPolarHBondContact CA-O 3.5Å; D447-V475 HydrophobicContact CB-CG2 4.23Å; D447-A478 WeakPolarHBondContact O-CB 3.3Å
448	G	72.7	Confident	93.3	Very high	5 Å²	5	27.4 Å²	27.4	5%	0.052	16%	0.155	C	C	.	.	S	Bend	trans	92.7	101.8	170.8	0	0	0	0	0	112.8	T446 A478	T446-G448 VanDerWaalsContact C-N 3.33Å; T446-G448 PolarHBondContact OG1-N 2.94Å; G448-A478 WeakPolarHBondContact O-CB 3.38Å
449	V	77	Confident	93.5	Very high	91 Å²	91	24.9 Å²	24.9	55%	0.552	14%	0.143	S	C	*	.			trans	167.2	105.6	145.9	158.6	0	0	0	0	105	T417	T417-V449 WeakPolarHBondContact CB-O 3.48Å; T417-V449 WeakPolarHBondContact CG2-O 3.31Å; T417-V449 PolarHBondContact OG1-O 2.9Å
450	I	89.3	Confident	93.6	Very high	18 Å²	18	25 Å²	25	9%	0.092	14%	0.144	C	C	.	.			trans	-81.7	129.3	177.1	-168.6	173.7	0	0	0	110.4	F419 D452 M453 T456 A482 M483 L486	F419-I450 HydrophobicContact CB-CD1 4.2Å; F419-I450 HydrophobicContact CD2-CD1 3.54Å; F419-I450 HydrophobicContact CD2-CG1 4.22Å; F419-I450 HydrophobicContact CE2-CD1 3.99Å; F419-I450 HydrophobicContact CE2-CG1 4.39Å; F419-I450 HydrophobicContact CG-CD1 3.95Å; F419-I450 HydrophobicContact CG-CG1 4.38Å; I450-D452 WeakPolarHBondContact CG1-OD1 3.46Å; I450-M453 HydrophobicContact CG2-CB 4.18Å; I450-M453 HydrophobicContact CG2-CE 3.67Å; I450-M453 HydrophobicContact CG2-SD 4.06Å; I450-T456 HydrophobicContact CD1-CG2 3.61Å; I450-T456 WeakPolarHBondContact CD1-OG1 3.45Å; I450-A482 HydrophobicContact CG2-CB 3.7Å; I450-M483 HydrophobicContact CB-CE 4.34Å; I450-L486 HydrophobicContact CD1-CD1 4.08Å
451	S	92.6	Very high	93.6	Very high	66 Å²	66	24.5 Å²	24.5	46%	0.462	14%	0.142	S	C	.	.	S	Bend	trans	-94.8	-26.9	-178.4	-59.8	0	0	0	0	113.1	P416 T417	P416-S451 WeakPolarHBondContact CB-OG 3.35Å; T417-S451 PolarHBondContact N-OG 2.99Å; T417-S451 WeakPolarHBondContact O-CB 3Å; T417-S451 PolarHBondContact O-N 2.8Å
452	D	94.9	Very high	93.6	Very high	11 Å²	11	27.7 Å²	27.7	6%	0.059	16%	0.159	C	C	.	.			trans	-106.4	39.7	-177.2	70.5	-16.1	0	0	0	112.9	N418 F419 A420 I450 A454 Q455 T456	N418-D452 VanDerWaalsContact CA-CG 3.42Å; N418-D452 WeakPolarHBondContact CA-OD1 3.42Å; N418-D452 WeakPolarHBondContact CA-OD2 3.41Å; N418-D452 HydrophobicContact CB-CB 4.25Å; N418-D452 VanDerWaalsContact CB-OD2 3.28Å; N418-D452 WeakPolarHBondContact CB-OD2 3.45Å; N418-D452 WeakPolarHBondContact OD1-CB 3.42Å; F419-D452 PolarHBondContact N-OD1 2.68Å; F419-D452 PolarHBondContact N-OD2 2.97Å; F419-D452 VanDerWaalsContact N-OD2 3.16Å; A420-D452 WeakPolarHBondContact CB-OD2 3.29Å; A420-D452 PolarHBondContact N-OD2 3.07Å; I450-D452 WeakPolarHBondContact CG1-OD1 3.46Å; D452-A454 VanDerWaalsContact C-N 3.28Å; D452-A454 PolarHBondContact O-N 2.86Å; D452-A454 VanDerWaalsContact O-N 3.13Å; D452-Q455 HydrophobicContact CB-CB 4.22Å; D452-Q455 PolarHBondContact O-N 2.82Å; D452-Q455 PolarHBondContact O-OE1 2.76Å; D452-T456 WeakPolarHBondContact O-CB 3.33Å; D452-T456 PolarHBondContact O-N 3.44Å; D452-T456 PolarHBondContact O-OG1 3.1Å; D452-T456 PolarHBondContact OD1-OG1 3.17Å; D452-T456 PolarHBondContact OD2-OG1 3.13Å
453	M	93.6	Very high	93.7	Very high	38 Å²	38	27.7 Å²	27.7	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-48.7	-45.6	-174	-179	57.2	101.6	0	0	113.7	I450 T456 K457 A482 L486	I450-M453 HydrophobicContact CG2-CB 4.18Å; I450-M453 HydrophobicContact CG2-CE 3.67Å; I450-M453 HydrophobicContact CG2-SD 4.06Å; M453-T456 PolarHBondContact O-N 2.79Å; M453-K457 HydrophobicContact CG-CD 4.47Å; M453-K457 WeakPolarHBondContact O-CG 3.28Å; M453-K457 PolarHBondContact O-N 3.19Å; M453-K457 HydrophobicContact SD-CD 4.39Å; M453-K457 HydrophobicContact SD-CG 4.22Å; M453-A482 HydrophobicContact CE-CB 3.38Å; M453-A482 VanDerWaalsContact CE-O 3.3Å; M453-A482 WeakPolarHBondContact CE-O 3.46Å; M453-L486 HydrophobicContact CE-CG 4.39Å; M453-L486 HydrophobicContact SD-CD1 4.43Å; M453-L486 HydrophobicContact SD-CD2 3.81Å; M453-L486 HydrophobicContact SD-CG 4.15Å
454	A	95.3	Very high	93.7	Very high	64 Å²	64	27.7 Å²	27.7	53%	0.529	16%	0.159	S	C	.	.	H	α-helix	trans	-65.4	-42.2	-178.6	0	0	0	0	0	112.4	D452 E458	D452-A454 VanDerWaalsContact C-N 3.28Å; D452-A454 PolarHBondContact O-N 2.86Å; D452-A454 VanDerWaalsContact O-N 3.13Å; A454-E458 WeakPolarHBondContact O-CB 3.35Å; A454-E458 PolarHBondContact O-N 2.92Å
455	Q	97.1	Very high	93.6	Very high	106 Å²	106	31.6 Å²	31.6	50%	0.495	18%	0.176	S	C	.	.	H	α-helix	trans	-69.5	-37.5	177.4	-63.8	81.1	-8.6	0	0	111	A420 D452 E458 A459	A420-Q455 HydrophobicContact CB-CB 3.76Å; D452-Q455 HydrophobicContact CB-CB 4.22Å; D452-Q455 PolarHBondContact O-N 2.82Å; D452-Q455 PolarHBondContact O-OE1 2.76Å; Q455-E458 PolarHBondContact O-N 2.88Å; Q455-A459 WeakPolarHBondContact O-CB 3.3Å; Q455-A459 PolarHBondContact O-N 2.99Å
456	T	96.8	Very high	93.6	Very high	1 Å²	1	32 Å²	32	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-67.1	-44.9	176.8	-68.1	0	0	0	0	111.1	F419 A420 I450 D452 M453 E458 A459 I460 L486	F419-T456 HydrophobicContact CB-CG2 4Å; F419-T456 HydrophobicContact CD2-CG2 4.43Å; A420-T456 PolarHBondContact N-OG1 2.77Å; A420-T456 VanDerWaalsContact N-OG1 3.17Å; I450-T456 HydrophobicContact CD1-CG2 3.61Å; I450-T456 WeakPolarHBondContact CD1-OG1 3.45Å; D452-T456 WeakPolarHBondContact O-CB 3.33Å; D452-T456 PolarHBondContact O-N 3.44Å; D452-T456 PolarHBondContact O-OG1 3.1Å; D452-T456 PolarHBondContact OD1-OG1 3.17Å; D452-T456 PolarHBondContact OD2-OG1 3.13Å; M453-T456 PolarHBondContact O-N 2.79Å; T456-E458 VanDerWaalsContact C-N 3.31Å; T456-E458 PolarHBondContact O-N 3.22Å; T456-A459 PolarHBondContact O-N 3.45Å; T456-A459 VanDerWaalsContact O-N 3.17Å; T456-I460 HydrophobicContact CG2-CD1 3.67Å; T456-I460 HydrophobicContact CG2-CG1 4.39Å; T456-I460 VanDerWaalsContact O-CG1 3.29Å; T456-I460 WeakPolarHBondContact O-CG1 3.45Å; T456-I460 PolarHBondContact O-N 3.39Å; T456-L486 HydrophobicContact CG2-CD1 3.97Å; T456-L486 HydrophobicContact CG2-CD2 4.43Å
457	K	96.4	Very high	93.7	Very high	35 Å²	35	32 Å²	32	15%	0.152	18%	0.178	C	C	.	.	H	α-helix	trans	-58.5	-42.5	171.3	-74	-178.4	-177.4	165.7	0	112.2	M453 I460 V461 E485 L486 I493	M453-K457 HydrophobicContact CG-CD 4.47Å; M453-K457 WeakPolarHBondContact O-CG 3.28Å; M453-K457 PolarHBondContact O-N 3.19Å; M453-K457 HydrophobicContact SD-CD 4.39Å; M453-K457 HydrophobicContact SD-CG 4.22Å; K457-I460 PolarHBondContact O-N 3.27Å; K457-V461 WeakPolarHBondContact O-CB 3.28Å; K457-V461 VanDerWaalsContact O-CG2 3.23Å; K457-V461 WeakPolarHBondContact O-CG2 3.31Å; K457-V461 PolarHBondContact O-N 3.17Å; K457-E485 IonicContact NZ-OE1 2.72Å; K457-E485 PolarHBondContact NZ-OE1 3.49Å; K457-E485 IonicContact NZ-OE2 3.42Å; K457-E485 PolarHBondContact NZ-OE2 3.37Å; K457-L486 HydrophobicContact CG-CD2 3.84Å; K457-I493 HydrophobicContact CB-CG2 4.17Å; K457-I493 HydrophobicContact CG-CG2 3.99Å
458	E	97.2	Very high	94	Very high	57 Å²	57	31.5 Å²	31.5	27%	0.266	18%	0.175	S	C	.	.	H	α-helix	trans	-62	-43	175.4	-176	169.9	-169.6	0	0	112.1	A454 Q455 T456 N462 R496	A454-E458 WeakPolarHBondContact O-CB 3.35Å; A454-E458 PolarHBondContact O-N 2.92Å; Q455-E458 PolarHBondContact O-N 2.88Å; T456-E458 VanDerWaalsContact C-N 3.31Å; T456-E458 PolarHBondContact O-N 3.22Å; E458-N462 WeakPolarHBondContact O-CB 3.39Å; E458-N462 VanDerWaalsContact O-CG 3.25Å; E458-N462 PolarHBondContact O-N 3.36Å; E458-N462 PolarHBondContact O-ND2 3.33Å; E458-R496 VanDerWaalsContact CD-NH2 3.34Å; E458-R496 IonicContact OE1-CZ 2.6Å; E458-R496 VanDerWaalsContact OE1-CZ 3.26Å; E458-R496 IonicContact OE1-NE 2.56Å; E458-R496 IonicContact OE1-NH1 3.26Å; E458-R496 IonicContact OE1-NH2 3.33Å; E458-R496 PolarHBondContact OE1-NH2 3.21Å; E458-R496 IonicContact OE2-CZ 3.82Å; E458-R496 IonicContact OE2-NE 2.82Å; E458-R496 IonicContact OE2-NH2 2.74Å; E458-R496 PolarHBondContact OE2-NH2 2.75Å
459	A	97.9	Very high	95.2	Very high	3 Å²	3	31.2 Å²	31.2	3%	0.025	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-45.5	176.4	0	0	0	0	0	111.5	A420 V423 Q455 T456 N462 A463	A420-A459 HydrophobicContact CB-CB 4.44Å; V423-A459 HydrophobicContact CB-CB 4.15Å; V423-A459 HydrophobicContact CG1-CB 3.74Å; Q455-A459 WeakPolarHBondContact O-CB 3.3Å; Q455-A459 PolarHBondContact O-N 2.99Å; T456-A459 PolarHBondContact O-N 3.45Å; T456-A459 VanDerWaalsContact O-N 3.17Å; A459-N462 PolarHBondContact O-N 2.8Å; A459-A463 VanDerWaalsContact O-CB 3.24Å; A459-A463 WeakPolarHBondContact O-CB 3.49Å; A459-A463 PolarHBondContact O-N 2.7Å
460	I	97.4	Very high	96.1	Very high	2 Å²	2	27 Å²	27	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-65	-46.3	178.9	-65.8	161.5	0	0	0	111.3	T456 K457 N462 A463 A464 I470 L486 I493 I504 V505	T456-I460 HydrophobicContact CG2-CD1 3.67Å; T456-I460 HydrophobicContact CG2-CG1 4.39Å; T456-I460 VanDerWaalsContact O-CG1 3.29Å; T456-I460 WeakPolarHBondContact O-CG1 3.45Å; T456-I460 PolarHBondContact O-N 3.39Å; K457-I460 PolarHBondContact O-N 3.27Å; I460-N462 PolarHBondContact O-N 2.94Å; I460-A463 CarbonylContact O-C 3Å; I460-A463 PolarHBondContact O-N 3.46Å; I460-A464 PolarHBondContact O-N 2.72Å; I460-I470 HydrophobicContact CG1-CD1 3.93Å; I460-L486 HydrophobicContact CD1-CD1 4.35Å; I460-L486 HydrophobicContact CD1-CD2 3.76Å; I460-L486 HydrophobicContact CD1-CG 4.47Å; I460-I493 HydrophobicContact CD1-CD1 4.45Å; I460-I493 HydrophobicContact CG2-CD1 3.62Å; I460-I504 HydrophobicContact CG2-CD1 4.07Å; I460-I504 HydrophobicContact CG2-CG1 3.98Å; I460-V505 HydrophobicContact CD1-CG2 4Å; I460-V505 HydrophobicContact CG1-CG2 4.28Å; I460-V505 HydrophobicContact CG2-CG2 3.78Å
461	V	97.1	Very high	96.4	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.024	14%	0.142	C	C	.	.	H	α-helix	trans	-60	-36.3	176.4	169.4	0	0	0	0	111.5	K457 I493 K498 A500	K457-V461 WeakPolarHBondContact O-CB 3.28Å; K457-V461 VanDerWaalsContact O-CG2 3.23Å; K457-V461 WeakPolarHBondContact O-CG2 3.31Å; K457-V461 PolarHBondContact O-N 3.17Å; V461-I493 HydrophobicContact CG2-CG2 4Å; V461-K498 HydrophobicContact CG1-CB 4.29Å; V461-K498 HydrophobicContact CG1-CD 4.02Å; V461-K498 HydrophobicContact CG1-CG 4.03Å; V461-A500 HydrophobicContact CG2-CB 4.25Å
462	N	96.6	Very high	96.5	Very high	67 Å²	67	23 Å²	23	36%	0.358	12%	0.121	S	C	.	.	H	α-helix	trans	-75	-30.9	175.2	-73.5	-33.8	0	0	0	113.2	E458 A459 I460 K465	E458-N462 WeakPolarHBondContact O-CB 3.39Å; E458-N462 VanDerWaalsContact O-CG 3.25Å; E458-N462 PolarHBondContact O-N 3.36Å; E458-N462 PolarHBondContact O-ND2 3.33Å; A459-N462 PolarHBondContact O-N 2.8Å; I460-N462 PolarHBondContact O-N 2.94Å; N462-K465 WeakPolarHBondContact O-CE 3.41Å; N462-K465 WeakPolarHBondContact O-CG 3.32Å
463	A	97.4	Very high	96.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-78.1	-27.3	177.6	0	0	0	0	0	113	A427 A459 I460 K465 L466 M468 I504	A427-A463 HydrophobicContact CB-CB 4.36Å; A459-A463 VanDerWaalsContact O-CB 3.24Å; A459-A463 WeakPolarHBondContact O-CB 3.49Å; A459-A463 PolarHBondContact O-N 2.7Å; I460-A463 CarbonylContact O-C 3Å; I460-A463 PolarHBondContact O-N 3.46Å; A463-K465 PolarHBondContact O-N 3.45Å; A463-L466 WeakPolarHBondContact O-CA 3.4Å; A463-L466 VanDerWaalsContact O-CB 3.27Å; A463-L466 WeakPolarHBondContact O-CB 3.32Å; A463-L466 PolarHBondContact O-N 2.77Å; A463-M468 HydrophobicContact CB-CE 4.29Å; A463-M468 HydrophobicContact CB-CG 4.25Å; A463-M468 HydrophobicContact CB-SD 3.63Å; A463-I504 HydrophobicContact CB-CD1 3.76Å
464	A	96.6	Very high	96.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.4	-177.5	0	0	0	0	0	114.5	I460 A500 R502 I504	I460-A464 PolarHBondContact O-N 2.72Å; A464-A500 HydrophobicContact CB-CB 3.8Å; A464-R502 VanDerWaalsContact O-CZ 3.31Å; A464-R502 PolarHBondContact O-NE 2.8Å; A464-R502 VanDerWaalsContact O-NE 3.13Å; A464-R502 PolarHBondContact O-NH2 2.99Å; A464-I504 HydrophobicContact CB-CD1 4.43Å; A464-I504 HydrophobicContact CB-CG1 4.5Å; A464-I504 HydrophobicContact CB-CG2 4.47Å
465	K	95.8	Very high	96.5	Very high	84 Å²	84	17.6 Å²	17.6	37%	0.365	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-10.5	175.8	74.8	-176.3	175.2	170.9	0	114	N462 A463 E501 R546	N462-K465 WeakPolarHBondContact O-CE 3.41Å; N462-K465 WeakPolarHBondContact O-CG 3.32Å; A463-K465 PolarHBondContact O-N 3.45Å; K465-E501 WeakPolarHBondContact CB-OE2 3.16Å; K465-R546 PolarHBondContact O-NH2 2.9Å
466	L	97.9	Very high	96.1	Very high	9 Å²	9	13.2 Å²	13.2	5%	0.047	7%	0.067	C	C	.	.	S	Bend	trans	-100.8	161.2	-173.1	-56.9	-179	0	0	0	111.4	A427 A430 A431 A463 M468 R502 Y542	A427-L466 HydrophobicContact CB-CD1 3.9Å; A427-L466 VanDerWaalsContact O-CD1 3.26Å; A427-L466 WeakPolarHBondContact O-CD1 3.5Å; A430-L466 HydrophobicContact CB-CB 4.04Å; A430-L466 HydrophobicContact CB-CD1 4.39Å; A431-L466 HydrophobicContact CB-CD1 4.03Å; A431-L466 HydrophobicContact CB-CD2 3.97Å; A463-L466 WeakPolarHBondContact O-CA 3.4Å; A463-L466 VanDerWaalsContact O-CB 3.27Å; A463-L466 WeakPolarHBondContact O-CB 3.32Å; A463-L466 PolarHBondContact O-N 2.77Å; L466-M468 HydrophobicContact CB-CG 4.31Å; L466-M468 PolarHBondContact O-N 3.42Å; L466-R502 PolarHBondContact O-NH2 2.82Å; L466-Y542 VanDerWaalsContact C-CE2 3.44Å
467	P	97.6	Very high	95.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.1	C	C	.	.	S	Bend	trans	-75.1	65.7	177	30.1	-34.2	0	0	0	111.2	A430 V433 Y439 F440 Y542	A430-P467 HydrophobicContact CB-CG 4.2Å; A430-P467 WeakPolarHBondContact O-CD 3.19Å; A430-P467 WeakPolarHBondContact O-CG 3.25Å; V433-P467 WeakPolarHBondContact O-CG 3.5Å; Y439-P467 HydrophobicContact CD2-CB 3.85Å; Y439-P467 HydrophobicContact CE2-CB 4.32Å; F440-P467 PolarHBondContact N-O 2.84Å; P467-Y542 HydrophobicContact CB-CD1 3.95Å; P467-Y542 HydrophobicContact CB-CD2 4.4Å; P467-Y542 HydrophobicContact CB-CE1 3.55Å; P467-Y542 HydrophobicContact CB-CE2 4.01Å; P467-Y542 HydrophobicContact CB-CG 4.37Å; P467-Y542 HydrophobicContact CG-CE1 4.36Å; P467-Y542 HydrophobicContact CG-CE2 4.46Å
468	M	97.4	Very high	95.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	152.7	177.3	69.4	179.7	-73.9	0	0	114.1	V426 A427 A430 Y439 F440 A463 L466 I470 I504	V426-M468 HydrophobicContact CB-CE 4.1Å; V426-M468 HydrophobicContact CG1-CE 3.93Å; A427-M468 VanDerWaalsContact CA-SD 3.54Å; A427-M468 HydrophobicContact CB-SD 3.75Å; A430-M468 HydrophobicContact CB-CB 4.09Å; A430-M468 HydrophobicContact CB-CG 4.38Å; A430-M468 HydrophobicContact CB-SD 4.24Å; Y439-M468 PolarHBondContact OH-O 3.29Å; F440-M468 HydrophobicContact CB-CB 3.96Å; F440-M468 CarbonylContact O-C 3.54Å; F440-M468 WeakPolarHBondContact O-CA 3.42Å; F440-M468 WeakPolarHBondContact O-CB 3.12Å; A463-M468 HydrophobicContact CB-CE 4.29Å; A463-M468 HydrophobicContact CB-CG 4.25Å; A463-M468 HydrophobicContact CB-SD 3.63Å; L466-M468 HydrophobicContact CB-CG 4.31Å; L466-M468 PolarHBondContact O-N 3.42Å; M468-I470 HydrophobicContact CE-CD1 4.18Å; M468-I470 HydrophobicContact CE-CG1 3.92Å; M468-I504 WeakPolarHBondContact O-CG2 3.42Å
469	S	97.1	Very high	94.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	154.9	170.7	-68.5	0	0	0	0	110.3	Y439 F440 V441 L442 I504 I535 Q538	Y439-S469 WeakPolarHBondContact CE1-OG 3.01Å; Y439-S469 PolarHBondContact OH-OG 3.43Å; F440-S469 PolarHBondContact O-N 3.14Å; V441-S469 WeakPolarHBondContact CA-O 3.34Å; L442-S469 PolarHBondContact N-O 2.82Å; S469-I504 CarbonylContact C-O 3.56Å; S469-I535 VanDerWaalsContact CB-CD1 3.46Å; S469-Q538 PolarHBondContact OG-OE1 2.84Å
470	I	97.1	Very high	94.1	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124.4	-178.7	-56.5	169.3	0	0	0	107.3	V423 L442 I444 I460 M468 I472 I504 V505 Q506	V423-I470 HydrophobicContact CG1-CD1 3.85Å; V423-I470 HydrophobicContact CG2-CD1 4.15Å; L442-I470 CarbonylContact O-C 3.32Å; L442-I470 WeakPolarHBondContact O-CA 3.47Å; I444-I470 HydrophobicContact CD1-CG2 4.01Å; I444-I470 HydrophobicContact CG1-CG2 4.47Å; I460-I470 HydrophobicContact CG1-CD1 3.93Å; M468-I470 HydrophobicContact CE-CD1 4.18Å; M468-I470 HydrophobicContact CE-CG1 3.92Å; I470-I472 HydrophobicContact CG2-CG1 4.04Å; I470-I504 HydrophobicContact CD1-CD1 3.99Å; I470-I504 HydrophobicContact CG1-CD1 4.45Å; I470-I504 PolarHBondContact N-O 2.78Å; I470-V505 HydrophobicContact CB-CG2 4.32Å; I470-V505 HydrophobicContact CD1-CG2 4.41Å; I470-V505 CarbonylContact O-C 3.36Å; I470-V505 VanDerWaalsContact O-CA 3.24Å; I470-V505 WeakPolarHBondContact O-CA 3.39Å; I470-Q506 PolarHBondContact O-N 3.39Å
471	I	95.6	Very high	93.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.1	172.7	-67	166.3	0	0	0	107.1	V351 V441 L442 L443 I444 V473 Q506 V531 L532 I535	V351-I471 HydrophobicContact CG1-CD1 4.47Å; V441-I471 HydrophobicContact CG1-CD1 3.68Å; V441-I471 HydrophobicContact CG1-CG1 4.34Å; L442-I471 PolarHBondContact O-N 2.91Å; L443-I471 CarbonylContact C-O 3.5Å; L443-I471 WeakPolarHBondContact CA-O 3.44Å; L443-I471 HydrophobicContact CD1-CB 4.07Å; L443-I471 HydrophobicContact CD1-CG2 3.49Å; L443-I471 VanDerWaalsContact CD1-CG2 3.49Å; I444-I471 PolarHBondContact N-O 3.29Å; I471-V473 HydrophobicContact CG2-CG2 4.11Å; I471-Q506 CarbonylContact C-O 3.57Å; I471-Q506 WeakPolarHBondContact CA-O 3.18Å; I471-V531 HydrophobicContact CB-CG1 4.34Å; I471-V531 HydrophobicContact CD1-CG1 3.81Å; I471-V531 HydrophobicContact CG1-CG1 4.2Å; I471-V531 HydrophobicContact CG2-CB 4.45Å; I471-V531 HydrophobicContact CG2-CG1 3.3Å; I471-V531 HydrophobicContact CG2-CG2 4.5Å; I471-L532 HydrophobicContact CD1-CD2 3.98Å; I471-I535 HydrophobicContact CD1-CD1 4.03Å; I471-I535 HydrophobicContact CD1-CG1 4.26Å; I471-I535 HydrophobicContact CG1-CD1 4.16Å
472	I	94.8	Very high	93.3	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	116.9	175.2	-53	179.2	0	0	0	108.6	F419 I444 T446 I470 M483 L486 V505 Q506 F507 V508	F419-I472 HydrophobicContact CE2-CD1 4.39Å; F419-I472 HydrophobicContact CE2-CG2 4.46Å; I444-I472 HydrophobicContact CB-CG1 4.39Å; I444-I472 CarbonylContact O-C 3.58Å; I444-I472 WeakPolarHBondContact O-CA 3.37Å; T446-I472 HydrophobicContact CG2-CG2 4.18Å; I470-I472 HydrophobicContact CG2-CG1 4.04Å; I472-M483 HydrophobicContact CG2-CG 4.15Å; I472-L486 HydrophobicContact CD1-CD1 4.16Å; I472-V505 HydrophobicContact CD1-CG1 3.82Å; I472-V505 HydrophobicContact CG1-CG1 4.22Å; I472-Q506 PolarHBondContact N-O 2.91Å; I472-F507 HydrophobicContact CB-CD2 4.02Å; I472-F507 HydrophobicContact CG2-CD2 3.88Å; I472-F507 HydrophobicContact CG2-CE2 4.39Å; I472-F507 WeakPolarHBondContact O-CA 3.32Å; I472-F507 VanDerWaalsContact O-CD2 3.32Å; I472-F507 WeakPolarHBondContact O-CD2 3.49Å; I472-V508 PolarHBondContact O-N 2.86Å
473	V	94.9	Very high	93	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.3	173.9	-179.9	0	0	0	0	109.7	A347 L443 I444 I445 T446 I471 V475 V508 F510 L527 V531	A347-V473 HydrophobicContact CB-CG1 3.91Å; L443-V473 HydrophobicContact CD1-CB 4.48Å; L443-V473 HydrophobicContact CD1-CG2 3.74Å; I444-V473 PolarHBondContact O-N 2.92Å; I445-V473 WeakPolarHBondContact CA-O 3.08Å; I445-V473 HydrophobicContact CG1-CB 4.47Å; T446-V473 PolarHBondContact N-O 2.66Å; T446-V473 VanDerWaalsContact N-O 3.12Å; I471-V473 HydrophobicContact CG2-CG2 4.11Å; V473-V475 HydrophobicContact CG1-CG1 4.42Å; V473-V508 WeakPolarHBondContact CA-O 3.45Å; V473-F510 HydrophobicContact CG1-CB 3.96Å; V473-F510 HydrophobicContact CG1-CD2 4.49Å; V473-L527 HydrophobicContact CG1-CD1 4.42Å; V473-V531 HydrophobicContact CG2-CG2 4.02Å
474	G	94.5	Very high	92.6	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	120.5	176.7	0	0	0	0	0	111.6	T446 V508 F510	T446-G474 CarbonylContact O-C 3.59Å; T446-G474 WeakPolarHBondContact O-CA 3.42Å; G474-V508 PolarHBondContact N-O 3.24Å; G474-F510 VanDerWaalsContact O-CB 3.28Å; G474-F510 WeakPolarHBondContact O-CB 3.33Å; G474-F510 PolarHBondContact O-N 2.92Å
475	V	93.2	Very high	92.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.			trans	-108.8	159	177	-61	0	0	0	0	111.8	L333 A343 Y344 I445 T446 D447 V473 F480 F510	L333-V475 HydrophobicContact CD1-CG2 4.48Å; A343-V475 HydrophobicContact CB-CB 3.86Å; A343-V475 HydrophobicContact CB-CG1 3.79Å; Y344-V475 HydrophobicContact CD2-CG2 4.04Å; Y344-V475 HydrophobicContact CE1-CG2 4.15Å; Y344-V475 HydrophobicContact CE2-CG2 3.45Å; Y344-V475 VanDerWaalsContact CE2-CG2 3.45Å; I445-V475 HydrophobicContact CG2-CG1 3.79Å; I445-V475 HydrophobicContact CG2-CG2 4.39Å; T446-V475 WeakPolarHBondContact O-CG2 3.42Å; T446-V475 PolarHBondContact O-N 3.37Å; D447-V475 CarbonylContact C-O 3.54Å; D447-V475 VanDerWaalsContact CA-O 3.26Å; D447-V475 WeakPolarHBondContact CA-O 3.5Å; D447-V475 HydrophobicContact CB-CG2 4.23Å; V473-V475 HydrophobicContact CG1-CG1 4.42Å; V475-F480 WeakPolarHBondContact O-CZ 3.15Å; V475-F510 HydrophobicContact CG1-CB 4.04Å; V475-F510 HydrophobicContact CG1-CG 4.36Å
476	G	89.5	Confident	92.1	Very high	14 Å²	14	33.1 Å²	33.1	14%	0.144	18%	0.177	C	C	.	.	S	Bend	trans	82.2	-154.9	-179.8	0	0	0	0	0	113.7
477	Q	85.6	Confident	91.6	Very high	148 Å²	148	33.6 Å²	33.6	69%	0.692	18%	0.18	S	C	*	.	S	Bend	trans	-120	12.4	-168.4	-62.3	-60.8	-31.6	0	0	113.6
478	A	85.6	Confident	90.8	Very high	28 Å²	28	33.8 Å²	33.8	23%	0.231	18%	0.182	C	C	.	.			trans	-65.1	167.8	178	0	0	0	0	0	112.7	D447 G448 F480 R511	D447-A478 WeakPolarHBondContact O-CB 3.3Å; G448-A478 WeakPolarHBondContact O-CB 3.38Å; A478-F480 HydrophobicContact CB-CE1 4.5Å; A478-R511 PolarHBondContact O-NH1 2.88Å
479	E	85.6	Confident	90	Very high	157 Å²	157	38.4 Å²	38.4	73%	0.734	21%	0.206	S	C	*	.			trans	-83.3	131	167.7	-67.5	-179.5	169.9	0	0	109.1
480	F	89.5	Confident	89.2	Confident	7 Å²	7	45.8 Å²	45.8	3%	0.031	25%	0.246	C	C	.	.			trans	-110.3	20	-171.9	-65	-67	0	0	0	113.4	V475 A478 A482 M483 V484 F507 P509	V475-F480 WeakPolarHBondContact O-CZ 3.15Å; A478-F480 HydrophobicContact CB-CE1 4.5Å; F480-A482 PolarHBondContact O-N 3.39Å; F480-A482 VanDerWaalsContact O-N 3.11Å; F480-M483 HydrophobicContact CB-CB 4.45Å; F480-M483 HydrophobicContact CD1-CG 4.47Å; F480-M483 HydrophobicContact CD1-SD 4.01Å; F480-M483 WeakPolarHBondContact O-CA 3.33Å; F480-M483 PolarHBondContact O-N 2.87Å; F480-V484 PolarHBondContact O-N 3.05Å; F480-F507 HydrophobicContact CB-CE1 3.73Å; F480-F507 HydrophobicContact CB-CE2 4.38Å; F480-F507 HydrophobicContact CB-CZ 3.4Å; F480-F507 VanDerWaalsContact CB-CZ 3.4Å; F480-F507 HydrophobicContact CD1-CE2 4.21Å; F480-F507 AromaticContact CD1-CZ 3.87Å; F480-F507 HydrophobicContact CD1-CZ 3.87Å; F480-F507 AromaticContact CD2-CZ 3.99Å; F480-F507 HydrophobicContact CD2-CZ 3.99Å; F480-F507 HydrophobicContact CG-CE1 4.3Å; F480-F507 HydrophobicContact CG-CE2 4.3Å; F480-F507 AromaticContact CG-CZ 3.51Å; F480-F507 HydrophobicContact CG-CZ 3.51Å; F480-P509 HydrophobicContact CD2-CB 4.16Å; F480-P509 HydrophobicContact CE2-CB 4.28Å
481	D	89.4	Confident	88.6	Confident	120 Å²	120	51.1 Å²	51.1	64%	0.642	28%	0.278	S	S	*	.	H	α-helix	trans	-53.4	-37.8	-177.6	-61.5	-16.4	0	0	0	112.5	M483 V484 E485	D481-M483 VanDerWaalsContact C-N 3.34Å; D481-M483 PolarHBondContact O-N 3.25Å; D481-V484 PolarHBondContact O-N 3.06Å; D481-E485 PolarHBondContact O-N 3.32Å
482	A	88.5	Confident	88.4	Confident	27 Å²	27	56 Å²	56	22%	0.223	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-40.9	174.8	0	0	0	0	0	112.7	I450 M453 F480 E485 L486	I450-A482 HydrophobicContact CG2-CB 3.7Å; M453-A482 HydrophobicContact CE-CB 3.38Å; M453-A482 VanDerWaalsContact CE-O 3.3Å; M453-A482 WeakPolarHBondContact CE-O 3.46Å; F480-A482 PolarHBondContact O-N 3.39Å; F480-A482 VanDerWaalsContact O-N 3.11Å; A482-E485 PolarHBondContact O-N 3.42Å; A482-L486 WeakPolarHBondContact O-CG 3.15Å; A482-L486 PolarHBondContact O-N 3.24Å
483	M	90.2	Very high	88.3	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-76.3	-35.2	-179	-66.3	70	-176.3	0	0	111.2	F419 T446 I450 I472 F480 D481 E485 L486 D487 F507	F419-M483 HydrophobicContact CE2-CE 4.2Å; F419-M483 HydrophobicContact CZ-CE 4.03Å; T446-M483 HydrophobicContact CG2-CE 3.99Å; I450-M483 HydrophobicContact CB-CE 4.34Å; I472-M483 HydrophobicContact CG2-CG 4.15Å; F480-M483 HydrophobicContact CB-CB 4.45Å; F480-M483 HydrophobicContact CD1-CG 4.47Å; F480-M483 HydrophobicContact CD1-SD 4.01Å; F480-M483 WeakPolarHBondContact O-CA 3.33Å; F480-M483 PolarHBondContact O-N 2.87Å; D481-M483 VanDerWaalsContact C-N 3.34Å; D481-M483 PolarHBondContact O-N 3.25Å; M483-E485 VanDerWaalsContact C-N 3.28Å; M483-E485 PolarHBondContact O-N 3.36Å; M483-L486 CarbonylContact O-C 3.55Å; M483-L486 WeakPolarHBondContact O-CA 3.32Å; M483-L486 WeakPolarHBondContact O-CB 3.26Å; M483-L486 PolarHBondContact O-N 2.91Å; M483-D487 PolarHBondContact O-N 2.83Å; M483-F507 HydrophobicContact CB-CB 4.38Å; M483-F507 HydrophobicContact CB-CD1 3.88Å; M483-F507 HydrophobicContact CB-CD2 3.37Å; M483-F507 HydrophobicContact CB-CE1 4Å; M483-F507 HydrophobicContact CB-CE2 3.5Å; M483-F507 HydrophobicContact CB-CG 3.57Å; M483-F507 HydrophobicContact CB-CZ 3.84Å; M483-F507 HydrophobicContact CG-CD2 4Å; M483-F507 HydrophobicContact CG-CE2 3.89Å; M483-F507 HydrophobicContact CG-CZ 4.47Å
484	V	89.1	Confident	88.2	Confident	77 Å²	77	59.3 Å²	59.3	47%	0.467	32%	0.319	S	S	.	.	H	α-helix	trans	-60.9	-39	170.2	176.6	0	0	0	0	110.7	F480 D481 L486 D487 F507	F480-V484 PolarHBondContact O-N 3.05Å; D481-V484 PolarHBondContact O-N 3.06Å; V484-L486 VanDerWaalsContact C-N 3.25Å; V484-L486 PolarHBondContact O-N 3.02Å; V484-D487 WeakPolarHBondContact O-CB 3.45Å; V484-D487 PolarHBondContact O-N 3.12Å; V484-F507 HydrophobicContact CG2-CD1 4Å; V484-F507 HydrophobicContact CG2-CE1 3.99Å
485	E	90	Very high	88.2	Confident	105 Å²	105	60.2 Å²	60.2	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-30	173.2	-168.4	-175.3	-173.1	0	0	112.7	K457 D481 A482 M483	K457-E485 IonicContact NZ-OE1 2.72Å; K457-E485 PolarHBondContact NZ-OE1 3.49Å; K457-E485 IonicContact NZ-OE2 3.42Å; K457-E485 PolarHBondContact NZ-OE2 3.37Å; D481-E485 PolarHBondContact O-N 3.32Å; A482-E485 PolarHBondContact O-N 3.42Å; M483-E485 VanDerWaalsContact C-N 3.28Å; M483-E485 PolarHBondContact O-N 3.36Å
486	L	91	Very high	88.1	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-79.7	-17.2	176.6	-68	-179	0	0	0	113.4	I450 M453 T456 K457 I460 I472 A482 M483 V484 G488 I493 V505	I450-L486 HydrophobicContact CD1-CD1 4.08Å; M453-L486 HydrophobicContact CE-CG 4.39Å; M453-L486 HydrophobicContact SD-CD1 4.43Å; M453-L486 HydrophobicContact SD-CD2 3.81Å; M453-L486 HydrophobicContact SD-CG 4.15Å; T456-L486 HydrophobicContact CG2-CD1 3.97Å; T456-L486 HydrophobicContact CG2-CD2 4.43Å; K457-L486 HydrophobicContact CG-CD2 3.84Å; I460-L486 HydrophobicContact CD1-CD1 4.35Å; I460-L486 HydrophobicContact CD1-CD2 3.76Å; I460-L486 HydrophobicContact CD1-CG 4.47Å; I472-L486 HydrophobicContact CD1-CD1 4.16Å; A482-L486 WeakPolarHBondContact O-CG 3.15Å; A482-L486 PolarHBondContact O-N 3.24Å; M483-L486 CarbonylContact O-C 3.55Å; M483-L486 WeakPolarHBondContact O-CA 3.32Å; M483-L486 WeakPolarHBondContact O-CB 3.26Å; M483-L486 PolarHBondContact O-N 2.91Å; V484-L486 VanDerWaalsContact C-N 3.25Å; V484-L486 PolarHBondContact O-N 3.02Å; L486-G488 VanDerWaalsContact C-N 3.28Å; L486-G488 PolarHBondContact O-N 3.08Å; L486-I493 WeakPolarHBondContact O-CD1 3.32Å; L486-V505 HydrophobicContact CB-CG1 4.35Å; L486-V505 WeakPolarHBondContact O-CB 3.49Å; L486-V505 VanDerWaalsContact O-CG1 3.29Å; L486-V505 WeakPolarHBondContact O-CG1 3.42Å; L486-V505 WeakPolarHBondContact O-CG2 3.38Å
487	D	88.1	Confident	88	Confident	20 Å²	20	73.2 Å²	73.2	11%	0.107	40%	0.395	C	S	.	.	H	α-helix	trans	-64.9	-31.3	-176.3	-150	16.6	0	0	0	112.5	M483 V484 D489 Q506 F507	M483-D487 PolarHBondContact O-N 2.83Å; V484-D487 WeakPolarHBondContact O-CB 3.45Å; V484-D487 PolarHBondContact O-N 3.12Å; D487-D489 PolarHBondContact O-N 3.34Å; D487-Q506 VanDerWaalsContact OD1-CA 3.27Å; D487-Q506 WeakPolarHBondContact OD1-CA 3.39Å; D487-F507 HydrophobicContact CB-CB 4.22Å; D487-F507 PolarHBondContact OD1-N 2.92Å
488	G	80.7	Confident	88.3	Confident	4 Å²	4	70.6 Å²	70.6	4%	0.041	38%	0.382	C	S	.	.			trans	80.1	-10.3	172	0	0	0	0	0	116	L486 V491 D503	L486-G488 VanDerWaalsContact C-N 3.28Å; L486-G488 PolarHBondContact O-N 3.08Å; G488-V491 CarbonylContact O-C 3.59Å; G488-D503 VanDerWaalsContact C-OD2 3.24Å
489	D	80.6	Confident	88.8	Confident	97 Å²	97	74.4 Å²	74.4	52%	0.519	40%	0.398	S	S	.	.	S	Bend	trans	-53.7	-53.7	178.3	-84.6	-5.9	0	0	0	114	D487	D487-D489 PolarHBondContact O-N 3.34Å
490	D	79.6	Confident	89.2	Confident	155 Å²	155	67.4 Å²	67.4	83%	0.829	37%	0.366	S	S	*	.	S	Bend	trans	-79.2	-42.8	-179.5	-75.3	-38.7	0	0	0	111.8
491	V	85.1	Confident	89.4	Confident	113 Å²	113	72 Å²	72	69%	0.685	39%	0.388	S	S	*	.	S	Bend	trans	-139.5	114.5	-173.6	-177.2	0	0	0	0	109.8	G488 I493	G488-V491 CarbonylContact O-C 3.59Å; V491-I493 PolarHBondContact O-N 3.03Å
492	R	91.3	Very high	89.6	Confident	101 Å²	101	66.9 Å²	66.9	38%	0.381	36%	0.36	S	S	.	.			trans	-51.8	123.3	174.7	-171.2	67	61.1	-141.5	-1.9	110.6	S494 L499 A500 D503	R492-S494 PolarHBondContact O-N 3.39Å; R492-L499 HydrophobicContact CB-CD2 4.16Å; R492-L499 HydrophobicContact CG-CD2 4.19Å; R492-A500 HydrophobicContact CG-CB 4.36Å; R492-D503 IonicContact CZ-OD2 3.47Å; R492-D503 VanDerWaalsContact NH1-N 3.18Å; R492-D503 IonicContact NH1-OD1 2.68Å; R492-D503 IonicContact NH1-OD2 3.41Å; R492-D503 PolarHBondContact NH1-OD2 2.94Å
493	I	92.6	Very high	89.8	Confident	10 Å²	10	66.8 Å²	66.8	5%	0.051	36%	0.355	C	S	.	.			trans	-56.7	137.7	-178	-56.5	168.1	0	0	0	110.5	K457 I460 V461 L486 V491 A500 V505	K457-I493 HydrophobicContact CB-CG2 4.17Å; K457-I493 HydrophobicContact CG-CG2 3.99Å; I460-I493 HydrophobicContact CD1-CD1 4.45Å; I460-I493 HydrophobicContact CG2-CD1 3.62Å; V461-I493 HydrophobicContact CG2-CG2 4Å; L486-I493 WeakPolarHBondContact O-CD1 3.32Å; V491-I493 PolarHBondContact O-N 3.03Å; I493-A500 HydrophobicContact CB-CB 4.5Å; I493-A500 WeakPolarHBondContact O-CB 3.28Å; I493-A500 PolarHBondContact O-N 2.74Å; I493-V505 HydrophobicContact CD1-CG2 4.12Å
494	S	92.6	Very high	90.1	Very high	62 Å²	62	66.8 Å²	66.8	43%	0.434	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	151	174	68.5	0	0	0	0	112.3	R492 K498	R492-S494 PolarHBondContact O-N 3.39Å; S494-K498 CarbonylContact C-O 3.54Å; S494-K498 WeakPolarHBondContact CA-O 3.26Å; S494-K498 WeakPolarHBondContact CB-O 3.41Å
495	S	94	Very high	90.4	Very high	18 Å²	18	63.1 Å²	63.1	13%	0.126	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	131.1	172.5	-174.7	0	0	0	0	109.4	G497 K498	S495-G497 PolarHBondContact O-N 2.81Å; S495-G497 VanDerWaalsContact O-N 3.14Å; S495-K498 PolarHBondContact N-O 3.31Å; S495-K498 PolarHBondContact O-N 3.17Å
496	R	90.9	Very high	90.6	Very high	207 Å²	207	59.1 Å²	59.1	78%	0.781	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	37.4	179.9	-53.1	-178.2	-171.8	-173.7	6.7	113.8	E458 K498	E458-R496 VanDerWaalsContact CD-NH2 3.34Å; E458-R496 IonicContact OE1-CZ 2.6Å; E458-R496 VanDerWaalsContact OE1-CZ 3.26Å; E458-R496 IonicContact OE1-NE 2.56Å; E458-R496 IonicContact OE1-NH1 3.26Å; E458-R496 IonicContact OE1-NH2 3.33Å; E458-R496 PolarHBondContact OE1-NH2 3.21Å; E458-R496 IonicContact OE2-CZ 3.82Å; E458-R496 IonicContact OE2-NE 2.82Å; E458-R496 IonicContact OE2-NH2 2.74Å; E458-R496 PolarHBondContact OE2-NH2 2.75Å; R496-K498 VanDerWaalsContact C-N 3.29Å; R496-K498 PolarHBondContact O-N 3.23Å
497	G	88.1	Confident	90.6	Very high	81 Å²	81	59.7 Å²	59.7	84%	0.835	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	2.5	179.8	0	0	0	0	0	115.3	S495	S495-G497 PolarHBondContact O-N 2.81Å; S495-G497 VanDerWaalsContact O-N 3.14Å
498	K	92.6	Very high	90.8	Very high	92 Å²	92	58.9 Å²	58.9	40%	0.4	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.7	172.5	-172.8	-178.3	176.6	-168.8	0	110	V461 S494 S495 R496	V461-K498 HydrophobicContact CG1-CB 4.29Å; V461-K498 HydrophobicContact CG1-CD 4.02Å; V461-K498 HydrophobicContact CG1-CG 4.03Å; S494-K498 CarbonylContact C-O 3.54Å; S494-K498 WeakPolarHBondContact CA-O 3.26Å; S494-K498 WeakPolarHBondContact CB-O 3.41Å; S495-K498 PolarHBondContact N-O 3.31Å; S495-K498 PolarHBondContact O-N 3.17Å; R496-K498 VanDerWaalsContact C-N 3.29Å; R496-K498 PolarHBondContact O-N 3.23Å
499	L	94.4	Very high	91.3	Very high	109 Å²	109	59.7 Å²	59.7	57%	0.571	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	146.8	172.9	-74	159.9	0	0	0	110.8	R492	R492-L499 HydrophobicContact CB-CD2 4.16Å; R492-L499 HydrophobicContact CG-CD2 4.19Å
500	A	94.6	Very high	91.8	Very high	9 Å²	9	55.2 Å²	55.2	7%	0.074	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-61.6	136.6	168.2	0	0	0	0	0	110.4	V461 A464 R492 I493 R502	V461-A500 HydrophobicContact CG2-CB 4.25Å; A464-A500 HydrophobicContact CB-CB 3.8Å; R492-A500 HydrophobicContact CG-CB 4.36Å; I493-A500 HydrophobicContact CB-CB 4.5Å; I493-A500 WeakPolarHBondContact O-CB 3.28Å; I493-A500 PolarHBondContact O-N 2.74Å; A500-R502 VanDerWaalsContact C-N 3.28Å; A500-R502 PolarHBondContact O-N 2.94Å
501	E	93.7	Very high	92.1	Very high	103 Å²	103	51.8 Å²	51.8	48%	0.481	27%	0.269	S	S	.	.	S	Bend	trans	-67	-29	-178.2	-75.2	174.6	-151.7	0	0	112.6	K465 R546	K465-E501 WeakPolarHBondContact CB-OE2 3.16Å; E501-R546 IonicContact OE2-CZ 3.39Å; E501-R546 IonicContact OE2-NH2 3.77Å; E501-R546 PolarHBondContact OE2-NH2 3.11Å; E501-R546 VanDerWaalsContact OE2-NH2 3.09Å
502	R	93.8	Very high	92.1	Very high	14 Å²	14	51.7 Å²	51.7	5%	0.053	26%	0.264	C	S	.	.	S	Bend	trans	-147.1	165.9	-177.9	-63.7	-178.6	-60.3	108.3	5.7	109.6	A464 L466 A500 I504 Q538 S541	A464-R502 VanDerWaalsContact O-CZ 3.31Å; A464-R502 PolarHBondContact O-NE 2.8Å; A464-R502 VanDerWaalsContact O-NE 3.13Å; A464-R502 PolarHBondContact O-NH2 2.99Å; L466-R502 PolarHBondContact O-NH2 2.82Å; A500-R502 VanDerWaalsContact C-N 3.28Å; A500-R502 PolarHBondContact O-N 2.94Å; R502-I504 HydrophobicContact CB-CG2 4.48Å; R502-Q538 PolarHBondContact NH1-O 2.93Å; R502-Q538 VanDerWaalsContact NH1-O 3.09Å; R502-S541 WeakPolarHBondContact CD-OG 3.3Å
503	D	93.6	Very high	91.7	Very high	25 Å²	25	48.8 Å²	48.8	13%	0.134	25%	0.253	C	S	.	.			trans	-75.2	138.3	159.9	-136.1	-32.7	0	0	0	111	G488 R492 V505	G488-D503 VanDerWaalsContact C-OD2 3.24Å; R492-D503 IonicContact CZ-OD2 3.47Å; R492-D503 VanDerWaalsContact NH1-N 3.18Å; R492-D503 IonicContact NH1-OD1 2.68Å; R492-D503 IonicContact NH1-OD2 3.41Å; R492-D503 PolarHBondContact NH1-OD2 2.94Å; D503-V505 PolarHBondContact OD1-N 2.73Å
504	I	95.4	Very high	90.8	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.273	C	S	.	.			trans	-143.4	3	177.3	65.5	157.7	0	0	0	112.5	I460 A463 A464 M468 S469 I470 R502	I460-I504 HydrophobicContact CG2-CD1 4.07Å; I460-I504 HydrophobicContact CG2-CG1 3.98Å; A463-I504 HydrophobicContact CB-CD1 3.76Å; A464-I504 HydrophobicContact CB-CD1 4.43Å; A464-I504 HydrophobicContact CB-CG1 4.5Å; A464-I504 HydrophobicContact CB-CG2 4.47Å; M468-I504 WeakPolarHBondContact O-CG2 3.42Å; S469-I504 CarbonylContact C-O 3.56Å; I470-I504 HydrophobicContact CD1-CD1 3.99Å; I470-I504 HydrophobicContact CG1-CD1 4.45Å; I470-I504 PolarHBondContact N-O 2.78Å; R502-I504 HydrophobicContact CB-CG2 4.48Å
505	V	95.4	Very high	89.5	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	137.7	-179	-177.1	0	0	0	0	108.1	I460 I470 I472 L486 I493 D503	I460-V505 HydrophobicContact CD1-CG2 4Å; I460-V505 HydrophobicContact CG1-CG2 4.28Å; I460-V505 HydrophobicContact CG2-CG2 3.78Å; I470-V505 HydrophobicContact CB-CG2 4.32Å; I470-V505 HydrophobicContact CD1-CG2 4.41Å; I470-V505 CarbonylContact O-C 3.36Å; I470-V505 VanDerWaalsContact O-CA 3.24Å; I470-V505 WeakPolarHBondContact O-CA 3.39Å; I472-V505 HydrophobicContact CD1-CG1 3.82Å; I472-V505 HydrophobicContact CG1-CG1 4.22Å; L486-V505 HydrophobicContact CB-CG1 4.35Å; L486-V505 WeakPolarHBondContact O-CB 3.49Å; L486-V505 VanDerWaalsContact O-CG1 3.29Å; L486-V505 WeakPolarHBondContact O-CG1 3.42Å; L486-V505 WeakPolarHBondContact O-CG2 3.38Å; I493-V505 HydrophobicContact CD1-CG2 4.12Å; D503-V505 PolarHBondContact OD1-N 2.73Å
506	Q	93.7	Very high	87.8	Confident	21 Å²	21	64.3 Å²	64.3	10%	0.098	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	122.1	167.1	179.7	61.6	24.4	0	0	108.4	I470 I471 I472 D487 V508 E534	I470-Q506 PolarHBondContact O-N 3.39Å; I471-Q506 CarbonylContact C-O 3.57Å; I471-Q506 WeakPolarHBondContact CA-O 3.18Å; I472-Q506 PolarHBondContact N-O 2.91Å; D487-Q506 VanDerWaalsContact OD1-CA 3.27Å; D487-Q506 WeakPolarHBondContact OD1-CA 3.39Å; Q506-V508 HydrophobicContact CG-CG2 4.16Å; Q506-E534 VanDerWaalsContact OE1-CG 3.3Å; Q506-E534 PolarHBondContact OE1-OE1 3.11Å; Q506-E534 PolarHBondContact OE1-OE2 3.15Å
507	F	92.6	Very high	86.4	Confident	12 Å²	12	59.5 Å²	59.5	5%	0.053	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.7	176.2	172.6	-111.8	0	0	0	112	I472 F480 M483 V484 D487 P509	I472-F507 HydrophobicContact CB-CD2 4.02Å; I472-F507 HydrophobicContact CG2-CD2 3.88Å; I472-F507 HydrophobicContact CG2-CE2 4.39Å; I472-F507 WeakPolarHBondContact O-CA 3.32Å; I472-F507 VanDerWaalsContact O-CD2 3.32Å; I472-F507 WeakPolarHBondContact O-CD2 3.49Å; F480-F507 HydrophobicContact CB-CE1 3.73Å; F480-F507 HydrophobicContact CB-CE2 4.38Å; F480-F507 HydrophobicContact CB-CZ 3.4Å; F480-F507 VanDerWaalsContact CB-CZ 3.4Å; F480-F507 HydrophobicContact CD1-CE2 4.21Å; F480-F507 AromaticContact CD1-CZ 3.87Å; F480-F507 HydrophobicContact CD1-CZ 3.87Å; F480-F507 AromaticContact CD2-CZ 3.99Å; F480-F507 HydrophobicContact CD2-CZ 3.99Å; F480-F507 HydrophobicContact CG-CE1 4.3Å; F480-F507 HydrophobicContact CG-CE2 4.3Å; F480-F507 AromaticContact CG-CZ 3.51Å; F480-F507 HydrophobicContact CG-CZ 3.51Å; M483-F507 HydrophobicContact CB-CB 4.38Å; M483-F507 HydrophobicContact CB-CD1 3.88Å; M483-F507 HydrophobicContact CB-CD2 3.37Å; M483-F507 HydrophobicContact CB-CE1 4Å; M483-F507 HydrophobicContact CB-CE2 3.5Å; M483-F507 HydrophobicContact CB-CG 3.57Å; M483-F507 HydrophobicContact CB-CZ 3.84Å; M483-F507 HydrophobicContact CG-CD2 4Å; M483-F507 HydrophobicContact CG-CE2 3.89Å; M483-F507 HydrophobicContact CG-CZ 4.47Å; V484-F507 HydrophobicContact CG2-CD1 4Å; V484-F507 HydrophobicContact CG2-CE1 3.99Å; D487-F507 HydrophobicContact CB-CB 4.22Å; D487-F507 PolarHBondContact OD1-N 2.92Å; F507-P509 HydrophobicContact CE1-CB 4.38Å; F507-P509 HydrophobicContact CE1-CG 4.37Å; F507-P509 HydrophobicContact CZ-CB 4.05Å
508	V	91.4	Very high	85	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.012	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	119.9	176.6	-175.1	0	0	0	0	111.3	I472 V473 G474 Q506 F510 Y513 L527 D530 V531	I472-V508 PolarHBondContact O-N 2.86Å; V473-V508 WeakPolarHBondContact CA-O 3.45Å; G474-V508 PolarHBondContact N-O 3.24Å; Q506-V508 HydrophobicContact CG-CG2 4.16Å; V508-F510 PolarHBondContact O-N 2.93Å; V508-Y513 HydrophobicContact CG1-CD2 4.15Å; V508-Y513 HydrophobicContact CG1-CE2 3.24Å; V508-L527 HydrophobicContact CB-CD1 4.44Å; V508-L527 HydrophobicContact CG1-CD1 3.68Å; V508-D530 HydrophobicContact CG2-CB 4.49Å; V508-V531 HydrophobicContact CB-CG2 3.67Å; V508-V531 HydrophobicContact CG1-CG2 4.08Å; V508-V531 HydrophobicContact CG2-CB 4.42Å; V508-V531 HydrophobicContact CG2-CG2 3.57Å
509	P	92	Very high	84	Confident	21 Å²	21	56.3 Å²	56.3	14%	0.136	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	113.7	172.5	30.7	-34.3	0	0	0	110.9	F480 F507 R511 D512 Y513	F480-P509 HydrophobicContact CD2-CB 4.16Å; F480-P509 HydrophobicContact CE2-CB 4.28Å; F507-P509 HydrophobicContact CE1-CB 4.38Å; F507-P509 HydrophobicContact CE1-CG 4.37Å; F507-P509 HydrophobicContact CZ-CB 4.05Å; P509-R511 HydrophobicContact CB-CG 4.44Å; P509-R511 PolarHBondContact O-N 2.91Å; P509-D512 HydrophobicContact CG-CB 4.39Å; P509-D512 WeakPolarHBondContact CG-OD2 3.33Å; P509-D512 PolarHBondContact O-N 3.18Å; P509-D512 VanDerWaalsContact O-N 3.15Å; P509-Y513 WeakPolarHBondContact O-CD2 3.41Å
510	F	89.7	Confident	83	Confident	3 Å²	3	54.5 Å²	54.5	1%	0.013	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-56.7	-30.5	-178	-175.3	-104.4	0	0	0	113.6	A343 M346 A347 V473 G474 V475 V508 D512 Y513 M514 L527	A343-F510 HydrophobicContact CB-CD1 4.03Å; A343-F510 HydrophobicContact CB-CE1 4.04Å; M346-F510 HydrophobicContact CB-CE2 4.19Å; M346-F510 HydrophobicContact CB-CZ 3.66Å; M346-F510 HydrophobicContact CE-CE1 3.79Å; M346-F510 HydrophobicContact CE-CZ 3.87Å; M346-F510 HydrophobicContact SD-CZ 4.17Å; A347-F510 HydrophobicContact CB-CD2 4.34Å; V473-F510 HydrophobicContact CG1-CB 3.96Å; V473-F510 HydrophobicContact CG1-CD2 4.49Å; G474-F510 VanDerWaalsContact O-CB 3.28Å; G474-F510 WeakPolarHBondContact O-CB 3.33Å; G474-F510 PolarHBondContact O-N 2.92Å; V475-F510 HydrophobicContact CG1-CB 4.04Å; V475-F510 HydrophobicContact CG1-CG 4.36Å; V508-F510 PolarHBondContact O-N 2.93Å; F510-D512 PolarHBondContact O-N 3.03Å; F510-Y513 PolarHBondContact O-N 2.79Å; F510-M514 HydrophobicContact CD1-CG 3.91Å; F510-M514 HydrophobicContact CD1-SD 4Å; F510-M514 HydrophobicContact CE1-CG 3.62Å; F510-M514 HydrophobicContact CE1-SD 3.56Å; F510-M514 VanDerWaalsContact CE1-SD 3.56Å; F510-M514 HydrophobicContact CZ-CG 4.33Å; F510-L527 HydrophobicContact CD2-CD1 3.88Å; F510-L527 HydrophobicContact CD2-CD2 3.51Å; F510-L527 HydrophobicContact CD2-CG 4.2Å; F510-L527 HydrophobicContact CE2-CD2 3.72Å
511	R	86.7	Confident	82	Confident	84 Å²	84	56.7 Å²	56.7	32%	0.317	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-61.5	-26.2	-178.3	72.1	-176.1	173.6	-158.3	-9.6	113.4	A478 P509 Y513 M514	A478-R511 PolarHBondContact O-NH1 2.88Å; P509-R511 HydrophobicContact CB-CG 4.44Å; P509-R511 PolarHBondContact O-N 2.91Å; R511-Y513 PolarHBondContact O-N 2.85Å; R511-M514 PolarHBondContact O-N 3.3Å
512	D	85.4	Confident	81.2	Confident	111 Å²	111	53 Å²	53	59%	0.594	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-73.2	-15.3	-176.7	-66.6	1.3	0	0	0	111.9	P509 F510	P509-D512 HydrophobicContact CG-CB 4.39Å; P509-D512 WeakPolarHBondContact CG-OD2 3.33Å; P509-D512 PolarHBondContact O-N 3.18Å; P509-D512 VanDerWaalsContact O-N 3.15Å; F510-D512 PolarHBondContact O-N 3.03Å
513	Y	81.6	Confident	80.4	Confident	39 Å²	39	52.6 Å²	52.6	15%	0.153	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-106.8	-9.8	-177.8	-55.5	-84.6	0	0	0	113.3	V508 P509 F510 R511 D515 S523 R526 L527 D530	V508-Y513 HydrophobicContact CG1-CD2 4.15Å; V508-Y513 HydrophobicContact CG1-CE2 3.24Å; P509-Y513 WeakPolarHBondContact O-CD2 3.41Å; F510-Y513 PolarHBondContact O-N 2.79Å; R511-Y513 PolarHBondContact O-N 2.85Å; Y513-D515 PolarHBondContact O-N 3.34Å; Y513-D515 VanDerWaalsContact O-N 3.16Å; Y513-S523 WeakPolarHBondContact O-CA 3.45Å; Y513-S523 WeakPolarHBondContact O-CB 3.49Å; Y513-S523 PolarHBondContact O-OG 3.44Å; Y513-R526 HydrophobicContact CD1-CB 3.59Å; Y513-R526 HydrophobicContact CE1-CB 4.18Å; Y513-L527 HydrophobicContact CD2-CB 4.45Å; Y513-L527 HydrophobicContact CD2-CD1 3.81Å; Y513-L527 HydrophobicContact CE2-CD1 4.15Å; Y513-L527 HydrophobicContact CG-CB 4.26Å; Y513-L527 HydrophobicContact CG-CD1 4.44Å; Y513-D530 HydrophobicContact CE1-CB 4.46Å; Y513-D530 WeakPolarHBondContact CE1-OD2 3.5Å; Y513-D530 VanDerWaalsContact CZ-OD2 3.23Å; Y513-D530 WeakPolarHBondContact OH-CB 3.24Å; Y513-D530 PolarHBondContact OH-OD2 2.9Å
514	M	73.6	Confident	79.9	Confident	93 Å²	93	52.8 Å²	52.8	46%	0.458	27%	0.266	S	S	.	.			trans	-72.6	108.7	178.7	-67.6	-148.8	-58.6	0	0	110.5	F510 R511	F510-M514 HydrophobicContact CD1-CG 3.91Å; F510-M514 HydrophobicContact CD1-SD 4Å; F510-M514 HydrophobicContact CE1-CG 3.62Å; F510-M514 HydrophobicContact CE1-SD 3.56Å; F510-M514 VanDerWaalsContact CE1-SD 3.56Å; F510-M514 HydrophobicContact CZ-CG 4.33Å; R511-M514 PolarHBondContact O-N 3.3Å
515	D	66.4	Low	79.2	Confident	69 Å²	69	54.4 Å²	54.4	37%	0.369	28%	0.279	S	S	.	.			trans	-74.6	136.2	177.4	-168.2	-6.5	0	0	0	110.7	Y513 T517 G518 S523	Y513-D515 PolarHBondContact O-N 3.34Å; Y513-D515 VanDerWaalsContact O-N 3.16Å; D515-T517 PolarHBondContact O-N 3.44Å; D515-T517 PolarHBondContact OD1-N 3.12Å; D515-T517 PolarHBondContact OD1-OG1 3.33Å; D515-T517 PolarHBondContact OD2-OG1 3.48Å; D515-G518 PolarHBondContact O-N 3.45Å; D515-S523 PolarHBondContact N-OG 3.2Å
516	R	57.7	Low	78.7	Confident	254 Å²	254	60.6 Å²	60.6	96%	0.958	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-18.6	173.4	-67.1	-178.4	173	-179.6	-1.4	112.4	G518	R516-G518 VanDerWaalsContact C-N 3.34Å
517	T	61	Low	78.3	Confident	106 Å²	106	59.6 Å²	59.6	65%	0.65	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-11.6	177.3	71.9	0	0	0	0	114.1	D515	D515-T517 PolarHBondContact O-N 3.44Å; D515-T517 PolarHBondContact OD1-N 3.12Å; D515-T517 PolarHBondContact OD1-OG1 3.33Å; D515-T517 PolarHBondContact OD2-OG1 3.48Å
518	G	60.6	Low	78	Confident	42 Å²	42	59 Å²	59	43%	0.433	30%	0.295	S	S	.	.			trans	81.2	12	178.2	0	0	0	0	0	115.5	D515 R516 H520	D515-G518 PolarHBondContact O-N 3.45Å; R516-G518 VanDerWaalsContact C-N 3.34Å; G518-H520 VanDerWaalsContact C-N 3.33Å; G518-H520 PolarHBondContact O-CD2 3.15Å; G518-H520 VanDerWaalsContact O-CD2 3.29Å; G518-H520 PolarHBondContact O-N 3.44Å
519	N	70.2	Confident	77.7	Confident	65 Å²	65	61.3 Å²	61.3	35%	0.348	31%	0.305	S	S	.	.			trans	-79.6	79.6	174.5	-167	-10.6	0	0	0	112	V521 L522 S523	N519-V521 PolarHBondContact O-N 2.88Å; N519-V521 VanDerWaalsContact O-N 3.09Å; N519-V521 PolarHBondContact OD1-N 3.05Å; N519-L522 WeakPolarHBondContact ND2-CD1 3.33Å; N519-L522 PolarHBondContact O-N 3.33Å; N519-S523 PolarHBondContact O-N 3.35Å
520	H	72.8	Confident	77.4	Confident	70 Å²	70	63.5 Å²	63.5	32%	0.324	32%	0.316	S	S	.	.	H	α-helix	trans	-56.2	-27.5	-177.6	-62.4	-64	0	0	0	114.7	Q340 G518 M524	Q340-H520 PolarHBondContact NE2-CE1 3.17Å; Q340-H520 PolarHBondContact NE2-NE2 3.37Å; G518-H520 VanDerWaalsContact C-N 3.33Å; G518-H520 PolarHBondContact O-CD2 3.15Å; G518-H520 VanDerWaalsContact O-CD2 3.29Å; G518-H520 PolarHBondContact O-N 3.44Å; H520-M524 WeakPolarHBondContact O-CB 3.33Å; H520-M524 VanDerWaalsContact O-CG 3.24Å; H520-M524 WeakPolarHBondContact O-CG 3.46Å; H520-M524 PolarHBondContact O-N 3.09Å
521	V	74.7	Confident	77.2	Confident	55 Å²	55	63.4 Å²	63.4	33%	0.333	32%	0.315	S	S	.	.	H	α-helix	trans	-67.8	-44.5	-177.7	-179.3	0	0	0	0	111	N519 M524 A525	N519-V521 PolarHBondContact O-N 2.88Å; N519-V521 VanDerWaalsContact O-N 3.09Å; N519-V521 PolarHBondContact OD1-N 3.05Å; V521-M524 PolarHBondContact O-N 3.5Å; V521-A525 PolarHBondContact O-N 3.02Å
522	L	76.4	Confident	77.3	Confident	25 Å²	25	59.4 Å²	59.4	13%	0.131	30%	0.3	C	S	.	.	H	α-helix	trans	-68	-40.8	177.9	-102.5	158.4	0	0	0	111.6	E60 N519 A525 R526	E60-L522 HydrophobicContact CB-CD1 4.49Å; E60-L522 HydrophobicContact CG-CD1 3.89Å; E60-L522 HydrophobicContact CG-CD2 3.81Å; E60-L522 HydrophobicContact CG-CG 4.08Å; N519-L522 WeakPolarHBondContact ND2-CD1 3.33Å; N519-L522 PolarHBondContact O-N 3.33Å; L522-A525 PolarHBondContact O-N 3.48Å; L522-R526 WeakPolarHBondContact O-CG 3.4Å; L522-R526 PolarHBondContact O-N 2.75Å
523	S	78.5	Confident	77.2	Confident	6 Å²	6	56.3 Å²	56.3	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-58	-46.6	173.4	-66.1	0	0	0	0	112.3	Y513 D515 N519 R526 L527	Y513-S523 WeakPolarHBondContact O-CA 3.45Å; Y513-S523 WeakPolarHBondContact O-CB 3.49Å; Y513-S523 PolarHBondContact O-OG 3.44Å; D515-S523 PolarHBondContact N-OG 3.2Å; N519-S523 PolarHBondContact O-N 3.35Å; S523-R526 PolarHBondContact O-N 3.44Å; S523-L527 PolarHBondContact O-N 3Å
524	M	82.1	Confident	77.6	Confident	30 Å²	30	57 Å²	57	15%	0.148	30%	0.295	C	S	.	.	H	α-helix	trans	-63.5	-43.1	177.3	-75	170.9	37.6	0	0	112.3	K349 A350 H520 V521 L527 A528	K349-M524 HydrophobicContact CB-CE 4.36Å; K349-M524 HydrophobicContact CD-CE 4.14Å; K349-M524 HydrophobicContact CG-CE 3.96Å; A350-M524 HydrophobicContact CB-CB 3.84Å; A350-M524 HydrophobicContact CB-CG 4.03Å; H520-M524 WeakPolarHBondContact O-CB 3.33Å; H520-M524 VanDerWaalsContact O-CG 3.24Å; H520-M524 WeakPolarHBondContact O-CG 3.46Å; H520-M524 PolarHBondContact O-N 3.09Å; V521-M524 PolarHBondContact O-N 3.5Å; M524-L527 PolarHBondContact O-N 3.23Å; M524-A528 WeakPolarHBondContact O-CB 3.22Å; M524-A528 PolarHBondContact O-N 3.22Å
525	A	81.6	Confident	78.4	Confident	35 Å²	35	52.6 Å²	52.6	29%	0.289	27%	0.273	S	S	.	.	H	α-helix	trans	-63.6	-41.9	179.9	0	0	0	0	0	112.1	V59 V521 L522 A528 K529	V59-A525 HydrophobicContact CG1-CB 3.53Å; V521-A525 PolarHBondContact O-N 3.02Å; L522-A525 PolarHBondContact O-N 3.48Å; A525-A528 PolarHBondContact O-N 2.8Å; A525-K529 WeakPolarHBondContact O-CB 3.48Å; A525-K529 PolarHBondContact O-N 3.08Å
526	R	83.8	Confident	79.6	Confident	129 Å²	129	50.1 Å²	50.1	49%	0.487	26%	0.261	S	S	.	.	H	α-helix	trans	-68.3	-39.8	176.9	-66.5	176.9	-175.8	173	2.4	112.6	Y513 L522 S523 K529 D530	Y513-R526 HydrophobicContact CD1-CB 3.59Å; Y513-R526 HydrophobicContact CE1-CB 4.18Å; L522-R526 WeakPolarHBondContact O-CG 3.4Å; L522-R526 PolarHBondContact O-N 2.75Å; S523-R526 PolarHBondContact O-N 3.44Å; R526-K529 WeakPolarHBondContact O-CB 3.45Å; R526-K529 PolarHBondContact O-N 3.37Å; R526-D530 PolarHBondContact O-N 2.85Å
527	L	85.7	Confident	81.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.1	-52.1	172.9	178.6	79.6	0	0	0	110.5	A347 A350 V473 V508 F510 Y513 S523 M524 K529 D530 V531	A347-L527 HydrophobicContact CB-CD2 4.27Å; A350-L527 HydrophobicContact CB-CD2 3.83Å; V473-L527 HydrophobicContact CG1-CD1 4.42Å; V508-L527 HydrophobicContact CB-CD1 4.44Å; V508-L527 HydrophobicContact CG1-CD1 3.68Å; F510-L527 HydrophobicContact CD2-CD1 3.88Å; F510-L527 HydrophobicContact CD2-CD2 3.51Å; F510-L527 HydrophobicContact CD2-CG 4.2Å; F510-L527 HydrophobicContact CE2-CD2 3.72Å; Y513-L527 HydrophobicContact CD2-CB 4.45Å; Y513-L527 HydrophobicContact CD2-CD1 3.81Å; Y513-L527 HydrophobicContact CE2-CD1 4.15Å; Y513-L527 HydrophobicContact CG-CB 4.26Å; Y513-L527 HydrophobicContact CG-CD1 4.44Å; S523-L527 PolarHBondContact O-N 3Å; M524-L527 PolarHBondContact O-N 3.23Å; L527-K529 PolarHBondContact O-N 3.25Å; L527-D530 PolarHBondContact O-N 3.36Å; L527-V531 HydrophobicContact CD1-CG2 4.01Å; L527-V531 HydrophobicContact CG-CG2 3.99Å; L527-V531 VanDerWaalsContact O-CB 3.27Å; L527-V531 WeakPolarHBondContact O-CB 3.32Å; L527-V531 VanDerWaalsContact O-CG2 3.23Å; L527-V531 WeakPolarHBondContact O-CG2 3.43Å; L527-V531 PolarHBondContact O-N 2.94Å
528	A	86.6	Confident	82.7	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-36.9	-176	0	0	0	0	0	111.5	A350 I354 M524 A525 V531 L532	A350-A528 HydrophobicContact CB-CB 4.44Å; A350-A528 WeakPolarHBondContact O-CB 3.19Å; I354-A528 HydrophobicContact CD1-CB 3.54Å; M524-A528 WeakPolarHBondContact O-CB 3.22Å; M524-A528 PolarHBondContact O-N 3.22Å; A525-A528 PolarHBondContact O-N 2.8Å; A528-V531 PolarHBondContact O-N 3.42Å; A528-L532 VanDerWaalsContact O-CB 3.26Å; A528-L532 WeakPolarHBondContact O-CB 3.47Å; A528-L532 WeakPolarHBondContact O-CG 3.35Å; A528-L532 PolarHBondContact O-N 3.28Å
529	K	85	Confident	84.3	Confident	50 Å²	50	36.9 Å²	36.9	22%	0.217	20%	0.195	C	C	.	.	H	α-helix	trans	-53.8	-56.7	174.2	-171.2	171.7	-170.2	133.4	0	111.8	S24 E92 E93 A525 R526 L527 A533	S24-K529 WeakPolarHBondContact OG-CE 3.31Å; S24-K529 PolarHBondContact OG-NZ 3.15Å; E92-K529 HydrophobicContact CG-CB 4.19Å; E92-K529 HydrophobicContact CG-CG 3.67Å; E93-K529 IonicContact OE1-NZ 3.77Å; E93-K529 PolarHBondContact OE1-NZ 3.07Å; A525-K529 WeakPolarHBondContact O-CB 3.48Å; A525-K529 PolarHBondContact O-N 3.08Å; R526-K529 WeakPolarHBondContact O-CB 3.45Å; R526-K529 PolarHBondContact O-N 3.37Å; L527-K529 PolarHBondContact O-N 3.25Å; K529-A533 VanDerWaalsContact O-CB 3.31Å; K529-A533 WeakPolarHBondContact O-CB 3.3Å; K529-A533 PolarHBondContact O-N 3.22Å; K529-A533 VanDerWaalsContact O-N 3.12Å
530	D	85.1	Confident	85.3	Confident	67 Å²	67	34.8 Å²	34.8	36%	0.358	18%	0.184	S	C	.	.	H	α-helix	trans	-74.4	-31.7	-174.9	-66.2	0.2	0	0	0	111.9	V508 Y513 R526 L527	V508-D530 HydrophobicContact CG2-CB 4.49Å; Y513-D530 HydrophobicContact CE1-CB 4.46Å; Y513-D530 WeakPolarHBondContact CE1-OD2 3.5Å; Y513-D530 VanDerWaalsContact CZ-OD2 3.23Å; Y513-D530 WeakPolarHBondContact OH-CB 3.24Å; Y513-D530 PolarHBondContact OH-OD2 2.9Å; R526-D530 PolarHBondContact O-N 2.85Å; L527-D530 PolarHBondContact O-N 3.36Å
531	V	85.9	Confident	86.2	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.1	-39.1	178	163	0	0	0	0	112.8	V351 I471 V473 V508 L527 A528	V351-V531 HydrophobicContact CG1-CG1 4.12Å; V351-V531 HydrophobicContact CG2-CB 4.32Å; V351-V531 HydrophobicContact CG2-CG1 3.65Å; I471-V531 HydrophobicContact CB-CG1 4.34Å; I471-V531 HydrophobicContact CD1-CG1 3.81Å; I471-V531 HydrophobicContact CG1-CG1 4.2Å; I471-V531 HydrophobicContact CG2-CB 4.45Å; I471-V531 HydrophobicContact CG2-CG1 3.3Å; I471-V531 HydrophobicContact CG2-CG2 4.5Å; V473-V531 HydrophobicContact CG2-CG2 4.02Å; V508-V531 HydrophobicContact CB-CG2 3.67Å; V508-V531 HydrophobicContact CG1-CG2 4.08Å; V508-V531 HydrophobicContact CG2-CB 4.42Å; V508-V531 HydrophobicContact CG2-CG2 3.57Å; L527-V531 HydrophobicContact CD1-CG2 4.01Å; L527-V531 HydrophobicContact CG-CG2 3.99Å; L527-V531 VanDerWaalsContact O-CB 3.27Å; L527-V531 WeakPolarHBondContact O-CB 3.32Å; L527-V531 VanDerWaalsContact O-CG2 3.23Å; L527-V531 WeakPolarHBondContact O-CG2 3.43Å; L527-V531 PolarHBondContact O-N 2.94Å; A528-V531 PolarHBondContact O-N 3.42Å
532	L	89.2	Confident	87.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-97.4	-10.9	-172.6	-68	173.9	0	0	0	113.4	F91 E92 V351 I354 I355 I471 A528 E534 I535	F91-L532 HydrophobicContact CD1-CB 4.13Å; F91-L532 WeakPolarHBondContact CD1-O 3.28Å; F91-L532 HydrophobicContact CE1-CB 3.82Å; F91-L532 HydrophobicContact CE1-CD2 4.17Å; F91-L532 HydrophobicContact CE1-CG 4.45Å; F91-L532 WeakPolarHBondContact CE1-O 3.17Å; E92-L532 HydrophobicContact CB-CB 3.74Å; V351-L532 HydrophobicContact CG1-CD2 3.97Å; V351-L532 HydrophobicContact CG1-CG 4.41Å; I354-L532 HydrophobicContact CB-CD1 3.68Å; I354-L532 HydrophobicContact CD1-CD1 4.07Å; I354-L532 HydrophobicContact CG1-CD1 4.37Å; I354-L532 HydrophobicContact CG2-CD1 3.66Å; I355-L532 HydrophobicContact CD1-CD2 4.16Å; I471-L532 HydrophobicContact CD1-CD2 3.98Å; A528-L532 VanDerWaalsContact O-CB 3.26Å; A528-L532 WeakPolarHBondContact O-CB 3.47Å; A528-L532 WeakPolarHBondContact O-CG 3.35Å; A528-L532 PolarHBondContact O-N 3.28Å; L532-E534 PolarHBondContact O-N 2.83Å; L532-E534 VanDerWaalsContact O-N 3.17Å; L532-I535 HydrophobicContact CD2-CG1 4.39Å; L532-I535 PolarHBondContact O-N 2.92Å
533	A	83.5	Confident	88.1	Confident	47 Å²	47	30.2 Å²	30.2	39%	0.388	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-37.2	-175.2	0	0	0	0	0	113.6	K529	K529-A533 VanDerWaalsContact O-CB 3.31Å; K529-A533 WeakPolarHBondContact O-CB 3.3Å; K529-A533 PolarHBondContact O-N 3.22Å; K529-A533 VanDerWaalsContact O-N 3.12Å
534	E	88.1	Confident	88.6	Confident	52 Å²	52	35 Å²	35	24%	0.243	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-19.1	-173.7	-58.9	-143.1	151.7	0	0	115.1	Q506 L532 D537 Q538	Q506-E534 VanDerWaalsContact OE1-CG 3.3Å; Q506-E534 PolarHBondContact OE1-OE1 3.11Å; Q506-E534 PolarHBondContact OE1-OE2 3.15Å; L532-E534 PolarHBondContact O-N 2.83Å; L532-E534 VanDerWaalsContact O-N 3.17Å; E534-D537 PolarHBondContact O-N 2.96Å; E534-D537 VanDerWaalsContact O-N 3.12Å; E534-Q538 HydrophobicContact CB-CG 4.25Å; E534-Q538 WeakPolarHBondContact O-CB 3.46Å; E534-Q538 WeakPolarHBondContact O-CG 3.25Å; E534-Q538 PolarHBondContact O-N 2.9Å; E534-Q538 PolarHBondContact OE2-NE2 2.86Å
535	I	92.1	Very high	89	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-58.2	-44	-171.9	-61	-63.1	0	0	0	112.3	F91 V441 S469 I471 L532 D537 Q538 L539	F91-I535 HydrophobicContact CE1-CB 3.78Å; F91-I535 HydrophobicContact CE1-CG1 4.37Å; F91-I535 HydrophobicContact CE1-CG2 4.1Å; F91-I535 HydrophobicContact CZ-CB 4.24Å; F91-I535 HydrophobicContact CZ-CG2 4.04Å; V441-I535 HydrophobicContact CG1-CD1 4.17Å; V441-I535 HydrophobicContact CG2-CD1 4.32Å; V441-I535 HydrophobicContact CG2-CG2 4.17Å; S469-I535 VanDerWaalsContact CB-CD1 3.46Å; I471-I535 HydrophobicContact CD1-CD1 4.03Å; I471-I535 HydrophobicContact CD1-CG1 4.26Å; I471-I535 HydrophobicContact CG1-CD1 4.16Å; L532-I535 HydrophobicContact CD2-CG1 4.39Å; L532-I535 PolarHBondContact O-N 2.92Å; I535-D537 PolarHBondContact O-N 2.88Å; I535-Q538 PolarHBondContact O-N 3.16Å; I535-L539 WeakPolarHBondContact O-CB 3.39Å; I535-L539 PolarHBondContact O-N 2.8Å
536	P	91.3	Very high	89.6	Confident	18 Å²	18	39.8 Å²	39.8	12%	0.117	20%	0.203	C	C	.	.	H	α-helix	trans	-56.9	-45.9	175.6	-27.4	37.7	0	0	0	113.1	F91 F302 L539 I540	F91-P536 HydrophobicContact CB-CG 3.89Å; F91-P536 HydrophobicContact CD1-CG 3.61Å; F91-P536 HydrophobicContact CD2-CG 4.49Å; F91-P536 HydrophobicContact CE1-CG 4.27Å; F91-P536 HydrophobicContact CG-CG 3.73Å; F302-P536 HydrophobicContact CB-CB 3.92Å; F302-P536 HydrophobicContact CD1-CB 4.46Å; F302-P536 HydrophobicContact CD2-CB 3.89Å; F302-P536 HydrophobicContact CD2-CG 4.39Å; F302-P536 HydrophobicContact CG-CB 3.85Å; F302-P536 HydrophobicContact CG-CG 4.38Å; P536-L539 PolarHBondContact O-N 3.43Å; P536-I540 WeakPolarHBondContact O-CD1 3.07Å; P536-I540 VanDerWaalsContact O-CG1 3.22Å; P536-I540 WeakPolarHBondContact O-CG1 3.44Å; P536-I540 PolarHBondContact O-N 3.17Å
537	D	89.6	Confident	89.9	Confident	115 Å²	115	37.8 Å²	37.8	62%	0.615	21%	0.213	S	C	*	.	H	α-helix	trans	-71.2	-40.2	-177.9	-76.2	-19.9	0	0	0	112	E534 I535 L539 I540 S541	E534-D537 PolarHBondContact O-N 2.96Å; E534-D537 VanDerWaalsContact O-N 3.12Å; I535-D537 PolarHBondContact O-N 2.88Å; D537-L539 VanDerWaalsContact C-N 3.32Å; D537-L539 PolarHBondContact O-N 2.9Å; D537-I540 PolarHBondContact O-N 2.88Å; D537-S541 WeakPolarHBondContact O-CB 3.45Å; D537-S541 PolarHBondContact O-N 3.1Å
538	Q	93.8	Very high	90.3	Very high	8 Å²	8	39 Å²	39	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-39.8	174.9	-68.5	179.5	5.4	0	0	111.5	S469 R502 E534 I535 Y542	S469-Q538 PolarHBondContact OG-OE1 2.84Å; R502-Q538 PolarHBondContact NH1-O 2.93Å; R502-Q538 VanDerWaalsContact NH1-O 3.09Å; E534-Q538 HydrophobicContact CB-CG 4.25Å; E534-Q538 WeakPolarHBondContact O-CB 3.46Å; E534-Q538 WeakPolarHBondContact O-CG 3.25Å; E534-Q538 PolarHBondContact O-N 2.9Å; E534-Q538 PolarHBondContact OE2-NE2 2.86Å; I535-Q538 PolarHBondContact O-N 3.16Å; Q538-Y542 PolarHBondContact O-N 2.77Å
539	L	94.7	Very high	90.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-51.6	173.8	-174.9	157.5	0	0	0	111.2	F302 Y305 T310 I312 Y439 I535 P536 D537 S541 Y542 M543	F302-L539 HydrophobicContact CD2-CD1 4.2Å; F302-L539 HydrophobicContact CD2-CD2 4.45Å; F302-L539 HydrophobicContact CE2-CD1 3.95Å; Y305-L539 HydrophobicContact CD2-CD2 4.14Å; Y305-L539 HydrophobicContact CG-CD2 4.17Å; T310-L539 HydrophobicContact CG2-CD1 4.47Å; I312-L539 HydrophobicContact CD1-CD1 4.5Å; Y439-L539 HydrophobicContact CD1-CD1 4.12Å; Y439-L539 HydrophobicContact CD1-CG 4.49Å; Y439-L539 HydrophobicContact CD2-CB 4.23Å; Y439-L539 HydrophobicContact CD2-CD1 4.09Å; Y439-L539 HydrophobicContact CD2-CG 3.82Å; Y439-L539 HydrophobicContact CE1-CB 4.32Å; Y439-L539 HydrophobicContact CE2-CB 4.03Å; Y439-L539 HydrophobicContact CE2-CG 4.11Å; Y439-L539 HydrophobicContact CG-CB 4.46Å; Y439-L539 HydrophobicContact CG-CD1 3.77Å; Y439-L539 HydrophobicContact CG-CG 4.03Å; I535-L539 WeakPolarHBondContact O-CB 3.39Å; I535-L539 PolarHBondContact O-N 2.8Å; P536-L539 PolarHBondContact O-N 3.43Å; D537-L539 VanDerWaalsContact C-N 3.32Å; D537-L539 PolarHBondContact O-N 2.9Å; L539-S541 VanDerWaalsContact C-N 3.27Å; L539-S541 PolarHBondContact O-N 2.97Å; L539-Y542 WeakPolarHBondContact O-CB 3.26Å; L539-Y542 PolarHBondContact O-N 3.39Å; L539-Y542 VanDerWaalsContact O-N 3.14Å; L539-M543 HydrophobicContact CD2-CE 3.92Å; L539-M543 HydrophobicContact CD2-CG 3.81Å; L539-M543 HydrophobicContact CG-CE 4.28Å; L539-M543 WeakPolarHBondContact O-CG 3.03Å; L539-M543 PolarHBondContact O-N 2.89Å
540	I	91.6	Very high	90.6	Very high	22 Å²	22	44.7 Å²	44.7	11%	0.113	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-42.1	179.1	-67.9	162.5	0	0	0	110.3	F302 P536 D537 Y542 M543 K544	F302-I540 HydrophobicContact CB-CD1 4.05Å; F302-I540 HydrophobicContact CB-CG1 4.41Å; P536-I540 WeakPolarHBondContact O-CD1 3.07Å; P536-I540 VanDerWaalsContact O-CG1 3.22Å; P536-I540 WeakPolarHBondContact O-CG1 3.44Å; P536-I540 PolarHBondContact O-N 3.17Å; D537-I540 PolarHBondContact O-N 2.88Å; I540-Y542 PolarHBondContact O-N 2.61Å; I540-M543 PolarHBondContact O-N 3.36Å; I540-K544 HydrophobicContact CG2-CD 3.75Å; I540-K544 VanDerWaalsContact CG2-CE 3.49Å; I540-K544 HydrophobicContact CG2-CG 4.13Å; I540-K544 WeakPolarHBondContact O-CB 3.4Å; I540-K544 WeakPolarHBondContact O-CG 3.03Å; I540-K544 PolarHBondContact O-N 2.73Å
541	S	91.4	Very high	90.6	Very high	53 Å²	53	45.9 Å²	45.9	37%	0.371	25%	0.253	S	S	.	.	H	α-helix	trans	-58.4	-44.7	176.1	-179.6	0	0	0	0	111.9	R502 D537 L539 S545	R502-S541 WeakPolarHBondContact CD-OG 3.3Å; D537-S541 WeakPolarHBondContact O-CB 3.45Å; D537-S541 PolarHBondContact O-N 3.1Å; L539-S541 VanDerWaalsContact C-N 3.27Å; L539-S541 PolarHBondContact O-N 2.97Å; S541-S545 VanDerWaalsContact O-CB 3.32Å; S541-S545 WeakPolarHBondContact O-CB 3.17Å; S541-S545 PolarHBondContact O-N 3.42Å; S541-S545 PolarHBondContact O-OG 2.89Å
542	Y	95.6	Very high	90.3	Very high	1 Å²	1	51.4 Å²	51.4	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-53.7	172.8	172.6	-97.6	0	0	0	111.4	Q434 Y439 L466 P467 Q538 L539 I540 K544 S545 R546 I548	Q434-Y542 PolarHBondContact O-OH 2.71Å; Q434-Y542 VanDerWaalsContact O-OH 3.12Å; Y439-Y542 HydrophobicContact CE2-CD1 4.47Å; Y439-Y542 HydrophobicContact CE2-CG 4.34Å; L466-Y542 VanDerWaalsContact C-CE2 3.44Å; P467-Y542 HydrophobicContact CB-CD1 3.95Å; P467-Y542 HydrophobicContact CB-CD2 4.4Å; P467-Y542 HydrophobicContact CB-CE1 3.55Å; P467-Y542 HydrophobicContact CB-CE2 4.01Å; P467-Y542 HydrophobicContact CB-CG 4.37Å; P467-Y542 HydrophobicContact CG-CE1 4.36Å; P467-Y542 HydrophobicContact CG-CE2 4.46Å; Q538-Y542 PolarHBondContact O-N 2.77Å; L539-Y542 WeakPolarHBondContact O-CB 3.26Å; L539-Y542 PolarHBondContact O-N 3.39Å; L539-Y542 VanDerWaalsContact O-N 3.14Å; I540-Y542 PolarHBondContact O-N 2.61Å; Y542-K544 VanDerWaalsContact C-N 3.34Å; Y542-K544 PolarHBondContact O-N 3.49Å; Y542-S545 PolarHBondContact O-N 3.33Å; Y542-S545 VanDerWaalsContact O-N 3.16Å; Y542-S545 PolarHBondContact O-OG 3.16Å; Y542-R546 HydrophobicContact CD2-CG 4.34Å; Y542-R546 HydrophobicContact CE1-CG 4.41Å; Y542-R546 HydrophobicContact CE2-CG 3.86Å; Y542-R546 PolarHBondContact O-N 2.98Å; Y542-R546 VanDerWaalsContact O-N 3.15Å; Y542-I548 HydrophobicContact CE1-CD1 3.74Å
543	M	94.8	Very high	89.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.1	-44.4	-175.8	-62.2	-62.7	-173	0	0	111.5	Y305 T310 G436 L539 I540 R546 A547 I548	Y305-M543 HydrophobicContact CD1-CB 4.49Å; Y305-M543 HydrophobicContact CD1-CE 4Å; Y305-M543 HydrophobicContact CD1-CG 3.86Å; Y305-M543 HydrophobicContact CD1-SD 4.11Å; Y305-M543 HydrophobicContact CD2-CG 4.42Å; Y305-M543 HydrophobicContact CE1-CB 3.65Å; Y305-M543 HydrophobicContact CE1-CE 4.42Å; Y305-M543 HydrophobicContact CE1-CG 3.49Å; Y305-M543 VanDerWaalsContact CE1-CG 3.49Å; Y305-M543 HydrophobicContact CE1-SD 3.91Å; Y305-M543 HydrophobicContact CE2-CB 4.06Å; Y305-M543 HydrophobicContact CE2-CG 4.12Å; Y305-M543 HydrophobicContact CG-CG 4.32Å; Y305-M543 VanDerWaalsContact CZ-CB 3.41Å; Y305-M543 VanDerWaalsContact OH-CB 3.3Å; Y305-M543 WeakPolarHBondContact OH-CB 3.49Å; T310-M543 HydrophobicContact CG2-CE 3.89Å; G436-M543 WeakPolarHBondContact O-CE 3.48Å; L539-M543 HydrophobicContact CD2-CE 3.92Å; L539-M543 HydrophobicContact CD2-CG 3.81Å; L539-M543 HydrophobicContact CG-CE 4.28Å; L539-M543 WeakPolarHBondContact O-CG 3.03Å; L539-M543 PolarHBondContact O-N 2.89Å; I540-M543 PolarHBondContact O-N 3.36Å; M543-R546 CarbonylContact O-C 3.56Å; M543-R546 PolarHBondContact O-N 2.89Å; M543-A547 PolarHBondContact O-N 3.06Å; M543-I548 HydrophobicContact CB-CB 4.32Å; M543-I548 PolarHBondContact O-N 3.46Å; M543-I548 HydrophobicContact SD-CB 3.92Å; M543-I548 HydrophobicContact SD-CD1 3.95Å; M543-I548 HydrophobicContact SD-CG2 3.69Å
544	K	89.4	Confident	87.9	Confident	106 Å²	106	56.7 Å²	56.7	46%	0.461	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-47	175.1	-74.8	-179.8	176.1	176.9	0	111.5	E299 I540 Y542 R546 A547	E299-K544 IonicContact OE1-NZ 3.47Å; E299-K544 PolarHBondContact OE1-NZ 2.68Å; I540-K544 HydrophobicContact CG2-CD 3.75Å; I540-K544 VanDerWaalsContact CG2-CE 3.49Å; I540-K544 HydrophobicContact CG2-CG 4.13Å; I540-K544 WeakPolarHBondContact O-CB 3.4Å; I540-K544 WeakPolarHBondContact O-CG 3.03Å; I540-K544 PolarHBondContact O-N 2.73Å; Y542-K544 VanDerWaalsContact C-N 3.34Å; Y542-K544 PolarHBondContact O-N 3.49Å; K544-R546 PolarHBondContact O-N 3.33Å; K544-R546 VanDerWaalsContact O-N 3.14Å; K544-A547 PolarHBondContact O-N 3.31Å
545	S	89.9	Confident	86	Confident	64 Å²	64	58.8 Å²	58.8	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-62.1	-22.3	179.9	77	0	0	0	0	114	S541 Y542	S541-S545 VanDerWaalsContact O-CB 3.32Å; S541-S545 WeakPolarHBondContact O-CB 3.17Å; S541-S545 PolarHBondContact O-N 3.42Å; S541-S545 PolarHBondContact O-OG 2.89Å; Y542-S545 PolarHBondContact O-N 3.33Å; Y542-S545 VanDerWaalsContact O-N 3.16Å; Y542-S545 PolarHBondContact O-OG 3.16Å
546	R	93.8	Very high	83.6	Confident	102 Å²	102	63.8 Å²	63.8	39%	0.385	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	3.5	178.3	-61.9	-60.4	-178.4	-145.5	-11.7	113.6	K465 E501 Y542 M543 K544 I548	K465-R546 PolarHBondContact O-NH2 2.9Å; E501-R546 IonicContact OE2-CZ 3.39Å; E501-R546 IonicContact OE2-NH2 3.77Å; E501-R546 PolarHBondContact OE2-NH2 3.11Å; E501-R546 VanDerWaalsContact OE2-NH2 3.09Å; Y542-R546 HydrophobicContact CD2-CG 4.34Å; Y542-R546 HydrophobicContact CE1-CG 4.41Å; Y542-R546 HydrophobicContact CE2-CG 3.86Å; Y542-R546 PolarHBondContact O-N 2.98Å; Y542-R546 VanDerWaalsContact O-N 3.15Å; M543-R546 CarbonylContact O-C 3.56Å; M543-R546 PolarHBondContact O-N 2.89Å; K544-R546 PolarHBondContact O-N 3.33Å; K544-R546 VanDerWaalsContact O-N 3.14Å; R546-I548 HydrophobicContact CB-CD1 3.63Å; R546-I548 HydrophobicContact CB-CG1 3.73Å; R546-I548 HydrophobicContact CG-CD1 4.35Å; R546-I548 PolarHBondContact O-N 3.36Å
547	A	91.4	Very high	81.1	Confident	86 Å²	86	73 Å²	73	71%	0.711	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	32.7	-173.9	0	0	0	0	0	113.6	M543 K544	M543-A547 PolarHBondContact O-N 3.06Å; K544-A547 PolarHBondContact O-N 3.31Å
548	I	93.1	Very high	78.4	Confident	27 Å²	27	72.8 Å²	72.8	14%	0.138	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-82.1	126.1	177.3	-62.3	167.7	0	0	0	108.4	Y305 Q434 Y542 M543 R546	Y305-I548 HydrophobicContact CE1-CG2 4.35Å; Y305-I548 PolarHBondContact OH-O 3.32Å; Q434-I548 WeakPolarHBondContact O-CD1 3.36Å; Y542-I548 HydrophobicContact CE1-CD1 3.74Å; M543-I548 HydrophobicContact CB-CB 4.32Å; M543-I548 PolarHBondContact O-N 3.46Å; M543-I548 HydrophobicContact SD-CB 3.92Å; M543-I548 HydrophobicContact SD-CD1 3.95Å; M543-I548 HydrophobicContact SD-CG2 3.69Å; R546-I548 HydrophobicContact CB-CD1 3.63Å; R546-I548 HydrophobicContact CB-CG1 3.73Å; R546-I548 HydrophobicContact CG-CD1 4.35Å; R546-I548 PolarHBondContact O-N 3.36Å
549	K	90.9	Very high	75.5	Confident	143 Å²	143	77.5 Å²	77.5	62%	0.622	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-99.6	148.9	174.7	-61.8	-171.6	178.6	-171.1	0	110
550	P	88.1	Confident	72.4	Confident	26 Å²	26	83.3 Å²	83.3	17%	0.169	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-55.2	141.7	170.9	-22	31.9	0	0	0	111.1	H300 D304 Y305	H300-P550 HydrophobicContact CB-CG 3.74Å; H300-P550 WeakPolarHBondContact CD2-CD 3.39Å; D304-P550 HydrophobicContact CB-CB 4.2Å; D304-P550 HydrophobicContact CB-CG 3.78Å; Y305-P550 HydrophobicContact CD1-CB 4.19Å; Y305-P550 HydrophobicContact CD1-CG 3.86Å; Y305-P550 HydrophobicContact CD2-CG 4.13Å; Y305-P550 HydrophobicContact CE1-CB 4.38Å; Y305-P550 HydrophobicContact CE1-CG 3.73Å; Y305-P550 HydrophobicContact CE2-CG 3.99Å; Y305-P550 HydrophobicContact CG-CB 4.49Å; Y305-P550 HydrophobicContact CG-CG 4.05Å
551	N	85.4	Confident	69.4	Low	92 Å²	92	91.3 Å²	91.3	49%	0.492	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-65.7	151.2	173	-68	-41.4	0	0	0	110.5	G308 V553	G308-N551 WeakPolarHBondContact CA-O 3.08Å; G308-N551 WeakPolarHBondContact O-CB 3.46Å; G308-N551 PolarHBondContact O-ND2 3.31Å; N551-V553 PolarHBondContact O-N 3.48Å
552	P	78.1	Confident	66.6	Low	117 Å²	117	97.1 Å²	97.1	76%	0.76	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-56.3	139.7	169.5	-19	30.5	0	0	0	110.4
553	V	65.3	Low	63.6	Low	88 Å²	88	102.7 Å²	102.7	53%	0.533	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-57.7	127.7	175.8	-175.4	0	0	0	0	108.6	A132 N551	A132-V553 HydrophobicContact CB-CG1 3.9Å; N551-V553 PolarHBondContact O-N 3.48Å
554	P	57.3	Low	60.6	Low	70 Å²	70	111.4 Å²	111.4	46%	0.455	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-53.9	137.6	176.2	-23.5	31.6	0	0	0	110.2
555	P	47.9	Very low	58	Low	96 Å²	96	112.9 Å²	112.9	62%	0.623	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-58.5	136.3	178.1	22.6	-31	0	0	0	109.4	Y557	P555-Y557 PolarHBondContact O-N 3.4Å
556	P	42.1	Very low	55.4	Low	105 Å²	105	118.5 Å²	118.5	68%	0.682	65%	0.652	S	S	*	*	S	Bend	trans	-58.1	130.2	167.4	25.5	-30.3	0	0	0	106.4
557	Y	38.4	Very low	52.6	Low	212 Å²	212	119.1 Å²	119.1	83%	0.831	67%	0.673	S	S	*	*			trans	85.4	84.7	-175.5	-48.1	-77.1	0	0	0	116.6	P555	P555-Y557 PolarHBondContact O-N 3.4Å
558	S	33	Very low	50	Low	111 Å²	111	125 Å²	125	78%	0.776	70%	0.699	S	S	*	*			trans	-107.1	99.8	134.8	-56.4	0	0	0	0	106.5	C560	S558-C560 PolarHBondContact O-N 2.96Å; S558-C560 VanDerWaalsContact O-N 3.15Å
559	S	34	Very low	47.9	Very low	106 Å²	106	130 Å²	130	74%	0.741	73%	0.727	S	S	*	*			trans	-56.8	122.9	165.8	44.1	0	0	0	0	107.2	K561	S559-K561 PolarHBondContact O-N 3.05Å
560	C	29.1	Very low	45.6	Very low	122 Å²	122	129.3 Å²	129.3	82%	0.824	73%	0.733	S	S	*	*			trans	-53.4	108.2	169	-167.6	0	0	0	0	106.6	S558 Q562	S558-C560 PolarHBondContact O-N 2.96Å; S558-C560 VanDerWaalsContact O-N 3.15Å; C560-Q562 PolarHBondContact O-N 3.36Å
561	K	29.2	Very low	43.3	Very low	191 Å²	191	135 Å²	135	83%	0.83	76%	0.764	S	S	*	*			trans	-60.9	114.5	169.9	-76.7	-172.6	177.2	-175.9	0	105.5	S559	S559-K561 PolarHBondContact O-N 3.05Å
562	Q	31.9	Very low	40.8	Very low	174 Å²	174	137.5 Å²	137.5	81%	0.813	78%	0.78	S	S	*	*			trans	-52.5	134	166.8	-75.2	-176.7	-33	0	0	107.6	C560 E564	C560-Q562 PolarHBondContact O-N 3.36Å; Q562-E564 PolarHBondContact O-N 3Å; Q562-E564 VanDerWaalsContact O-N 3.14Å
563	P	33.1	Very low	38.5	Very low	118 Å²	118	138.8 Å²	138.8	77%	0.766	78%	0.782	S	S	*	*			trans	-58.7	123.1	171.5	22.6	-29.2	0	0	0	107.7	T565	P563-T565 PolarHBondContact O-N 3.14Å
564	E	32	Very low	36.7	Very low	184 Å²	184	142.2 Å²	142.2	86%	0.86	80%	0.798	S	S	*	*			trans	-55.9	111.5	169.1	-73.3	178.5	169.5	0	0	107	Q562 E566	Q562-E564 PolarHBondContact O-N 3Å; Q562-E564 VanDerWaalsContact O-N 3.14Å; E564-E566 VanDerWaalsContact C-N 3.35Å; E564-E566 PolarHBondContact O-N 2.98Å
565	T	34.9	Very low	35.2	Very low	136 Å²	136	147.4 Å²	147.4	83%	0.834	82%	0.823	S	S	*	*			trans	-63.5	101.6	165.2	43.5	0	0	0	0	107	P563 S567	P563-T565 PolarHBondContact O-N 3.14Å; T565-S567 PolarHBondContact O-N 3.39Å; T565-S567 VanDerWaalsContact O-N 3.1Å
566	E	34.4	Very low	34.2	Very low	182 Å²	182	151.3 Å²	151.3	85%	0.85	84%	0.838	S	S	*	*			trans	-61	111.4	161.3	-76.9	-172.9	161.7	0	0	107.7	E564 V568	E564-E566 VanDerWaalsContact C-N 3.35Å; E564-E566 PolarHBondContact O-N 2.98Å; E566-V568 PolarHBondContact O-N 3.1Å
567	S	35.2	Very low	33.6	Very low	116 Å²	116	155.2 Å²	155.2	81%	0.811	85%	0.851	S	S	*	*			trans	-62.6	120.9	168	48.2	0	0	0	0	110	T565	T565-S567 PolarHBondContact O-N 3.39Å; T565-S567 VanDerWaalsContact O-N 3.1Å
568	V	37.7	Very low	33.1	Very low	210 Å²	210	150 Å²	150	100%	1.273	85%	0.853	S	S	*	*			trans	-122.2	0	152.7	-177.8	0	0	0	0	108.3	E566	E566-V568 PolarHBondContact O-N 3.1Å

Retrieved 568 of 568 residues in 1153.5 ms (Link to these results)

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