A0A5K4ELK6_SCHMA Loading...

Cell polarity protein

AlphaFold DB , UniProt , Accession A0A5K4ELK6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 664 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	29.6	Very low	33.9	Very low	93 Å²	93	92.1 Å²	92.1	46%	0.458	50%	0.499	S	S	.	.				0	121.7	0	-161.3	169.7	89.7	0	0	108.7	V17 L19 F591	M1-V17 CarbonylContact C-O 3.17Å; M1-V17 PolarHBondContact N-O 3.38Å; M1-V17 PolarHBondContact O-N 3.37Å; M1-L19 HydrophobicContact CB-CD1 4.05Å; M1-L19 HydrophobicContact SD-CD1 4.17Å; M1-F591 HydrophobicContact CE-CD1 4.33Å
2	V	25.8	Very low	33.7	Very low	86 Å²	86	91 Å²	91	52%	0.521	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	112.8	168.3	-177.4	0	0	0	0	106.1	P4 V16	V2-P4 WeakPolarHBondContact O-CD 3.48Å; V2-V16 HydrophobicContact CG1-CG2 4.3Å; V2-V16 HydrophobicContact CG2-CG1 4.11Å; V2-V16 HydrophobicContact CG2-CG2 4.05Å
3	A	36.6	Very low	33.5	Very low	8 Å²	8	85.8 Å²	85.8	7%	0.066	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	106.9	176.4	0	0	0	0	0	108.6	G5 F591	A3-G5 PolarHBondContact O-N 3.26Å; A3-F591 HydrophobicContact CB-CD1 4.04Å; A3-F591 HydrophobicContact CB-CE1 3.82Å
4	P	30.3	Very low	33.2	Very low	90 Å²	90	85.9 Å²	85.9	58%	0.584	46%	0.458	S	S	*	.			trans	-69.6	116.9	172.7	27.1	-31.3	0	0	0	109.1	V2 R6	V2-P4 WeakPolarHBondContact O-CD 3.48Å; P4-R6 PolarHBondContact O-N 3.3Å
5	G	31.7	Very low	33.2	Very low	7 Å²	7	81.3 Å²	81.3	7%	0.072	43%	0.433	C	S	.	.			trans	-59.3	122.1	167.1	0	0	0	0	0	109.5	A3 N7 M12 M588	A3-G5 PolarHBondContact O-N 3.26Å; G5-N7 PolarHBondContact O-N 3.29Å; G5-N7 VanDerWaalsContact O-N 3.13Å; G5-M12 WeakPolarHBondContact O-CE 3.43Å; G5-M588 WeakPolarHBondContact CA-O 3.47Å
6	R	30.2	Very low	32.8	Very low	219 Å²	219	78.2 Å²	78.2	83%	0.826	42%	0.418	S	S	*	.			trans	-71.8	104.3	171.7	-106	-175.7	175.3	-178	-2	108	P4	P4-R6 PolarHBondContact O-N 3.3Å
7	N	35.7	Very low	33.1	Very low	68 Å²	68	73.7 Å²	73.7	36%	0.364	39%	0.394	S	S	.	.			trans	-141.9	121.9	154.5	-127.4	-24.9	0	0	0	109.9	G5 A9	G5-N7 PolarHBondContact O-N 3.29Å; G5-N7 VanDerWaalsContact O-N 3.13Å; N7-A9 PolarHBondContact O-N 3.45Å
8	V	43.8	Very low	32.9	Very low	155 Å²	155	73.2 Å²	73.2	94%	0.939	39%	0.394	S	S	*	.	S	Bend	trans	-79.3	-9.5	-179.4	175.7	0	0	0	0	111.5
9	A	38.2	Very low	32.8	Very low	71 Å²	71	73.5 Å²	73.5	59%	0.587	40%	0.395	S	S	*	.	S	Bend	trans	-130.3	98.6	-178.9	0	0	0	0	0	111.6	N7	N7-A9 PolarHBondContact O-N 3.45Å
10	K	39.7	Very low	33	Very low	165 Å²	165	71.5 Å²	71.5	72%	0.717	38%	0.384	S	S	*	.	S	Bend	trans	60.3	115.5	159.2	-64.2	176.6	177.8	173.7	0	117
11	S	31.5	Very low	33.1	Very low	51 Å²	51	71.6 Å²	71.6	36%	0.357	39%	0.388	S	S	.	.			trans	85.1	93.9	177.5	-160.5	0	0	0	0	114.4
12	M	31.8	Very low	33.5	Very low	79 Å²	79	72.9 Å²	72.9	39%	0.389	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.8	162.6	-74.2	-155.2	178.9	0	0	109	G5 R632	G5-M12 WeakPolarHBondContact O-CE 3.43Å; M12-R632 PolarHBondContact O-N 2.76Å
13	D	31.3	Very low	34.1	Very low	24 Å²	24	73.1 Å²	73.1	13%	0.128	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	107.5	164.9	-64.1	-15.2	0	0	0	106.7	I15 R581 T631	D13-I15 PolarHBondContact O-N 3.27Å; D13-R581 IonicContact OD2-NH2 3.97Å; D13-R581 PolarHBondContact OD2-NH2 3.47Å; D13-T631 WeakPolarHBondContact OD1-CA 3.42Å; D13-T631 VanDerWaalsContact OD1-CB 3.23Å; D13-T631 WeakPolarHBondContact OD1-CB 3.27Å; D13-T631 WeakPolarHBondContact OD1-CG2 3.23Å
14	E	28.9	Very low	34.2	Very low	87 Å²	87	79.2 Å²	79.2	41%	0.407	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	99.9	174.2	-74.3	179	-171.9	0	0	108.4	R628 R630	E14-R628 VanDerWaalsContact O-O 3.12Å; E14-R630 PolarHBondContact N-O 3.32Å
15	I	32.7	Very low	34.3	Very low	16 Å²	16	80.5 Å²	80.5	8%	0.082	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	108.8	168.9	-58.7	179.3	0	0	0	107.8	D13 V17 V626	D13-I15 PolarHBondContact O-N 3.27Å; I15-V17 HydrophobicContact CG2-CG2 3.73Å; I15-V626 HydrophobicContact CG2-CB 4.47Å; I15-V626 HydrophobicContact CG2-CG1 4.08Å; I15-V626 HydrophobicContact CG2-CG2 4.16Å
16	V	27.7	Very low	34.3	Very low	32 Å²	32	85.7 Å²	85.7	19%	0.194	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	114.2	172.4	-179.4	0	0	0	0	108	V2 L627	V2-V16 HydrophobicContact CG1-CG2 4.3Å; V2-V16 HydrophobicContact CG2-CG1 4.11Å; V2-V16 HydrophobicContact CG2-CG2 4.05Å; V16-L627 WeakPolarHBondContact O-CB 3.42Å; V16-L627 PolarHBondContact O-N 3.23Å
17	V	36.8	Very low	34.8	Very low	2 Å²	2	81.9 Å²	81.9	1%	0.012	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	122.3	174	-178.6	0	0	0	0	109.6	M1 I15 L19 F591 L624 Q625	M1-V17 CarbonylContact C-O 3.17Å; M1-V17 PolarHBondContact N-O 3.38Å; M1-V17 PolarHBondContact O-N 3.37Å; I15-V17 HydrophobicContact CG2-CG2 3.73Å; V17-L19 PolarHBondContact O-N 3.32Å; V17-F591 HydrophobicContact CB-CE1 4.05Å; V17-F591 HydrophobicContact CG2-CE1 3.61Å; V17-F591 HydrophobicContact CG2-CZ 3.66Å; V17-L624 HydrophobicContact CG1-CB 3.75Å; V17-L624 HydrophobicContact CG1-CD2 3.57Å; V17-L624 HydrophobicContact CG1-CG 4.21Å; V17-Q625 WeakPolarHBondContact CA-O 3.45Å; V17-Q625 WeakPolarHBondContact CG1-O 3.31Å; V17-Q625 WeakPolarHBondContact CG2-O 3.38Å
18	V	29.5	Very low	34.7	Very low	64 Å²	64	87.7 Å²	87.7	39%	0.388	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	113.2	171.1	171.6	0	0	0	0	107.4	M20 L627	V18-M20 HydrophobicContact CG1-CG 4.42Å; V18-M20 PolarHBondContact O-N 3.16Å; V18-L627 HydrophobicContact CB-CD1 3.83Å; V18-L627 HydrophobicContact CG2-CD1 3.28Å
19	L	30.9	Very low	34.4	Very low	79 Å²	79	84.6 Å²	84.6	41%	0.414	45%	0.45	S	S	.	.			trans	-69.3	114.2	158.1	-79.3	157.4	0	0	0	105.1	M1 V17 P21 L624	M1-L19 HydrophobicContact CB-CD1 4.05Å; M1-L19 HydrophobicContact SD-CD1 4.17Å; V17-L19 PolarHBondContact O-N 3.32Å; L19-P21 VanDerWaalsContact O-CD 3.27Å; L19-P21 WeakPolarHBondContact O-CD 3.09Å; L19-L624 HydrophobicContact CD2-CD2 4.06Å
20	M	38.2	Very low	34.4	Very low	34 Å²	34	89 Å²	89	17%	0.167	46%	0.464	C	S	.	.			trans	-70.5	118.4	-177.6	-66.5	178.8	-176.3	0	0	109.5	V18 E22 L23 S288 G289	V18-M20 HydrophobicContact CG1-CG 4.42Å; V18-M20 PolarHBondContact O-N 3.16Å; M20-E22 VanDerWaalsContact C-N 3.27Å; M20-E22 PolarHBondContact O-N 3.07Å; M20-L23 PolarHBondContact O-N 3.35Å; M20-S288 VanDerWaalsContact CE-C 3.45Å; M20-S288 VanDerWaalsContact CE-O 3.26Å; M20-S288 WeakPolarHBondContact CE-O 3.2Å; M20-G289 VanDerWaalsContact SD-CA 3.56Å
21	P	34.9	Very low	34.4	Very low	73 Å²	73	87.1 Å²	87.1	47%	0.474	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-75.1	-13.7	-177.7	29.5	-33.6	0	0	0	113.3	L19 L23 L24 K25	L19-P21 VanDerWaalsContact O-CD 3.27Å; L19-P21 WeakPolarHBondContact O-CD 3.09Å; P21-L23 PolarHBondContact O-N 3.33Å; P21-L24 CarbonylContact O-C 3.53Å; P21-L24 WeakPolarHBondContact O-CA 3.17Å; P21-L24 WeakPolarHBondContact O-CB 3.32Å; P21-L24 PolarHBondContact O-N 3.13Å; P21-K25 PolarHBondContact O-N 2.83Å; P21-K25 VanDerWaalsContact O-N 3.1Å
22	E	38.2	Very low	34.8	Very low	120 Å²	120	90 Å²	90	56%	0.561	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-62.6	-27.4	174.2	-63.2	-59.3	152.5	0	0	111.8	M20 L24 K25	M20-E22 VanDerWaalsContact C-N 3.27Å; M20-E22 PolarHBondContact O-N 3.07Å; E22-L24 VanDerWaalsContact C-N 3.27Å; E22-L24 PolarHBondContact O-N 3.28Å; E22-K25 IonicContact OE1-NZ 3.77Å; E22-K25 PolarHBondContact OE1-NZ 3.42Å; E22-K25 WeakPolarHBondContact OE2-CD 3.32Å; E22-K25 WeakPolarHBondContact OE2-CE 3.33Å; E22-K25 IonicContact OE2-NZ 2.81Å; E22-K25 PolarHBondContact OE2-NZ 2.92Å
23	L	38.5	Very low	35.2	Very low	92 Å²	92	93.8 Å²	93.8	48%	0.482	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-78.7	-8.2	171.5	-67.5	168.5	0	0	0	113.6	M20 P21	M20-L23 PolarHBondContact O-N 3.35Å; P21-L23 PolarHBondContact O-N 3.33Å
24	L	36.9	Very low	35.6	Very low	136 Å²	136	99.7 Å²	99.7	71%	0.712	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-103.8	-10	175.8	-67.8	168.8	0	0	0	112.5	P21 E22 P26	P21-L24 CarbonylContact O-C 3.53Å; P21-L24 WeakPolarHBondContact O-CA 3.17Å; P21-L24 WeakPolarHBondContact O-CB 3.32Å; P21-L24 PolarHBondContact O-N 3.13Å; E22-L24 VanDerWaalsContact C-N 3.27Å; E22-L24 PolarHBondContact O-N 3.28Å; L24-P26 VanDerWaalsContact O-CD 3.26Å; L24-P26 WeakPolarHBondContact O-CD 3.13Å
25	K	32.7	Very low	36.2	Very low	116 Å²	116	104.8 Å²	104.8	50%	0.504	55%	0.552	S	S	.	*	S	Bend	trans	-77.5	117.4	174	-70.1	-174.1	-163.5	160.1	0	108.2	P21 E22 I27	P21-K25 PolarHBondContact O-N 2.83Å; P21-K25 VanDerWaalsContact O-N 3.1Å; E22-K25 IonicContact OE1-NZ 3.77Å; E22-K25 PolarHBondContact OE1-NZ 3.42Å; E22-K25 WeakPolarHBondContact OE2-CD 3.32Å; E22-K25 WeakPolarHBondContact OE2-CE 3.33Å; E22-K25 IonicContact OE2-NZ 2.81Å; E22-K25 PolarHBondContact OE2-NZ 2.92Å; K25-I27 PolarHBondContact O-N 3.27Å; K25-I27 VanDerWaalsContact O-N 3.14Å
26	P	31.6	Very low	36.6	Very low	117 Å²	117	109.7 Å²	109.7	76%	0.76	59%	0.585	S	S	*	*			trans	-56.4	125.8	160.6	24.3	-30.1	0	0	0	106.6	L24 K28	L24-P26 VanDerWaalsContact O-CD 3.26Å; L24-P26 WeakPolarHBondContact O-CD 3.13Å; P26-K28 PolarHBondContact O-N 3.34Å
27	I	40.6	Very low	37.1	Very low	139 Å²	139	115.8 Å²	115.8	71%	0.713	62%	0.615	S	S	*	*			trans	-52.1	113.3	174.7	-62.1	163.2	0	0	0	105.5	K25 P29	K25-I27 PolarHBondContact O-N 3.27Å; K25-I27 VanDerWaalsContact O-N 3.14Å; I27-P29 WeakPolarHBondContact O-CD 3.46Å; I27-P29 VanDerWaalsContact O-N 3.09Å
28	K	34.9	Very low	37.2	Very low	190 Å²	190	120.1 Å²	120.1	83%	0.826	64%	0.644	S	S	*	*			trans	-62.5	115.4	168.4	-87.8	-177.3	175.4	-178.5	0	105	P26 N30	P26-K28 PolarHBondContact O-N 3.34Å; K28-N30 PolarHBondContact O-N 3.01Å
29	P	37.9	Very low	38.1	Very low	90 Å²	90	126.6 Å²	126.6	58%	0.584	67%	0.67	S	S	*	*			trans	-58.1	128.5	177.7	23.2	-30.6	0	0	0	107	I27 I31	I27-P29 WeakPolarHBondContact O-CD 3.46Å; I27-P29 VanDerWaalsContact O-N 3.09Å; P29-I31 HydrophobicContact CB-CG1 4.48Å; P29-I31 HydrophobicContact CG-CG1 4.27Å; P29-I31 PolarHBondContact O-N 3.23Å
30	N	37.2	Very low	38.5	Very low	164 Å²	164	128.4 Å²	128.4	88%	0.877	68%	0.684	S	S	*	*			trans	-63.6	89.3	156.9	-90.1	-10.7	0	0	0	105	K28 P32	K28-N30 PolarHBondContact O-N 3.01Å; N30-P32 WeakPolarHBondContact O-CD 3.42Å; N30-P32 VanDerWaalsContact O-N 3.1Å
31	I	40.3	Very low	38.9	Very low	125 Å²	125	133 Å²	133	64%	0.641	71%	0.709	S	S	*	*			trans	-60.7	111.4	165.6	-57.6	167.4	0	0	0	103.2	P29 D33	P29-I31 HydrophobicContact CB-CG1 4.48Å; P29-I31 HydrophobicContact CG-CG1 4.27Å; P29-I31 PolarHBondContact O-N 3.23Å; I31-D33 PolarHBondContact O-N 3.27Å
32	P	39.8	Very low	39	Very low	110 Å²	110	133.9 Å²	133.9	71%	0.714	71%	0.714	S	S	*	*			trans	-58.3	136.4	173.9	8.8	-3.6	0	0	0	107.2	N30 D34	N30-P32 WeakPolarHBondContact O-CD 3.42Å; N30-P32 VanDerWaalsContact O-N 3.1Å; P32-D34 PolarHBondContact O-N 3.02Å; P32-D34 VanDerWaalsContact O-N 3.13Å
33	D	39.4	Very low	38.9	Very low	159 Å²	159	136.5 Å²	136.5	85%	0.85	73%	0.732	S	S	*	*			trans	-42.8	124.2	178.8	-73.5	-38.8	0	0	0	109.6	I31 K35	I31-D33 PolarHBondContact O-N 3.27Å; D33-K35 PolarHBondContact O-N 3.1Å
34	D	40.4	Very low	38.9	Very low	149 Å²	149	135.7 Å²	135.7	80%	0.797	75%	0.746	S	S	*	*			trans	-47.9	105.1	-177.4	-78.1	-34.8	0	0	0	108.8	P32 P36	P32-D34 PolarHBondContact O-N 3.02Å; P32-D34 VanDerWaalsContact O-N 3.13Å; D34-P36 WeakPolarHBondContact O-CD 3.22Å
35	K	41.5	Very low	38.8	Very low	194 Å²	194	134.3 Å²	134.3	84%	0.843	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-60.9	124.5	168	-79.9	-179.6	-179.9	174.2	0	105.8	D33 L37	D33-K35 PolarHBondContact O-N 3.1Å; K35-L37 PolarHBondContact O-N 3.33Å
36	P	40.9	Very low	39	Very low	118 Å²	118	136.4 Å²	136.4	77%	0.766	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-56.7	133.9	178.7	22.2	-31.3	0	0	0	108.7	D34	D34-P36 WeakPolarHBondContact O-CD 3.22Å
37	L	38	Very low	39.1	Very low	160 Å²	160	135.2 Å²	135.2	84%	0.838	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-48	129.8	171.9	-83.7	142.7	0	0	0	108.6	K35 E39	K35-L37 PolarHBondContact O-N 3.33Å; L37-E39 PolarHBondContact O-N 3.42Å
38	P	39.8	Very low	38.6	Very low	94 Å²	94	133 Å²	133	61%	0.61	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-61.7	129.2	178.9	23.3	-30.8	0	0	0	109.8	V40	P38-V40 PolarHBondContact O-N 2.99Å
39	E	46.8	Very low	38.3	Very low	200 Å²	200	127 Å²	127	94%	0.935	75%	0.751	S	S	*	*	S	Bend	trans	-63.9	-22.9	178.5	-72.5	-177.2	163.5	0	0	112.8	L37	L37-E39 PolarHBondContact O-N 3.42Å
40	V	40.1	Very low	38.1	Very low	116 Å²	116	127.9 Å²	127.9	70%	0.703	75%	0.754	S	S	*	*	S	Bend	trans	-136	122.3	-176.7	-175.2	0	0	0	0	108.9	P38	P38-V40 PolarHBondContact O-N 2.99Å
41	L	45.9	Very low	38	Very low	132 Å²	132	126.3 Å²	126.3	69%	0.691	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-70.1	133.6	171.6	-74.3	164.8	0	0	0	109.2
42	P	37	Very low	37.6	Very low	91 Å²	91	127 Å²	127	59%	0.591	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-60.9	140.2	176	-19.9	30.4	0	0	0	112	G44	P42-G44 PolarHBondContact O-N 3.43Å
43	D	36.2	Very low	37.3	Very low	174 Å²	174	126.6 Å²	126.6	93%	0.93	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	123.8	176.1	-67.1	-35.9	0	0	0	110.8
44	G	39.4	Very low	36.9	Very low	76 Å²	76	122 Å²	122	78%	0.784	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	124.6	-1.8	175	0	0	0	0	0	116.6	P42	P42-G44 PolarHBondContact O-N 3.43Å
45	I	34.1	Very low	36.5	Very low	107 Å²	107	123.9 Å²	123.9	55%	0.549	75%	0.749	S	S	.	*			trans	-95.2	104.1	178.1	-57.8	174.6	0	0	0	110.5	S47	I45-S47 WeakPolarHBondContact CG2-OG 3.38Å; I45-S47 PolarHBondContact O-N 2.61Å
46	I	37.1	Very low	36.2	Very low	159 Å²	159	118.2 Å²	118.2	82%	0.815	75%	0.746	S	S	*	*			trans	-90.4	70.5	169.3	32.1	169	0	0	0	109.7
47	S	34.4	Very low	35.9	Very low	93 Å²	93	118 Å²	118	65%	0.65	74%	0.743	S	S	*	*			trans	-156.6	95	164.3	47.8	0	0	0	0	109.9	I45 G49	I45-S47 WeakPolarHBondContact CG2-OG 3.38Å; I45-S47 PolarHBondContact O-N 2.61Å; S47-G49 PolarHBondContact O-N 2.78Å; S47-G49 VanDerWaalsContact O-N 3.07Å
48	G	28.6	Very low	35.7	Very low	91 Å²	91	122 Å²	122	94%	0.938	75%	0.747	S	S	*	*			trans	-69	98.8	173.2	0	0	0	0	0	110.6
49	G	28.9	Very low	35.5	Very low	64 Å²	64	123.1 Å²	123.1	66%	0.66	75%	0.747	S	S	*	*			trans	-99.3	108.6	161.9	0	0	0	0	0	109.3	S47 V51	S47-G49 PolarHBondContact O-N 2.78Å; S47-G49 VanDerWaalsContact O-N 3.07Å; G49-V51 PolarHBondContact O-N 3.46Å
50	V	33.8	Very low	35.2	Very low	109 Å²	109	122.3 Å²	122.3	66%	0.661	74%	0.744	S	S	*	*			trans	-74.8	108.9	164.5	172	0	0	0	0	107.2	M52	V50-M52 HydrophobicContact CG1-CE 4.28Å; V50-M52 HydrophobicContact CG1-CG 4.05Å; V50-M52 PolarHBondContact O-N 2.91Å
51	V	34.6	Very low	35.2	Very low	132 Å²	132	123.7 Å²	123.7	80%	0.8	75%	0.747	S	S	*	*			trans	-78.8	102.9	171.9	-178.5	0	0	0	0	107.7	G49	G49-V51 PolarHBondContact O-N 3.46Å
52	M	32.3	Very low	34.7	Very low	139 Å²	139	124.9 Å²	124.9	69%	0.685	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-84.2	124.7	168.9	-63.1	-174.5	-176.3	0	0	108.5	V50 G54	V50-M52 HydrophobicContact CG1-CE 4.28Å; V50-M52 HydrophobicContact CG1-CG 4.05Å; V50-M52 PolarHBondContact O-N 2.91Å; M52-G54 PolarHBondContact O-N 2.8Å
53	P	33.9	Very low	34.6	Very low	102 Å²	102	124.1 Å²	124.1	66%	0.662	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-62.1	125.7	172.3	24.8	-29.9	0	0	0	108.6	L55	P53-L55 PolarHBondContact O-N 3.17Å
54	G	31.8	Very low	34.5	Very low	62 Å²	62	118.8 Å²	118.8	64%	0.639	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-54.9	126	-170.4	0	0	0	0	0	113.2	M52 G56	M52-G54 PolarHBondContact O-N 2.8Å; G54-G56 PolarHBondContact O-N 2.81Å
55	L	31.9	Very low	34	Very low	188 Å²	188	124.4 Å²	124.4	98%	0.984	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	106.6	161.4	-85	106	0	0	0	108.6	P53	P53-L55 PolarHBondContact O-N 3.17Å
56	G	33.8	Very low	34.3	Very low	75 Å²	75	125 Å²	125	77%	0.773	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	162.1	-22.7	175.6	0	0	0	0	0	114.7	G54 R58	G54-G56 PolarHBondContact O-N 2.81Å; G56-R58 PolarHBondContact O-N 3.03Å
57	T	35.6	Very low	33.9	Very low	114 Å²	114	125.8 Å²	125.8	70%	0.699	75%	0.75	S	S	*	*			trans	-84.9	112.1	167.5	67.9	0	0	0	0	107.8	N59	T57-N59 PolarHBondContact O-N 3.32Å
58	R	34.1	Very low	33.9	Very low	244 Å²	244	128.6 Å²	128.6	92%	0.921	76%	0.756	S	S	*	*			trans	-71.9	36	-179.8	-155.3	179.6	178.8	-176.4	-0.6	112.1	G56	G56-R58 PolarHBondContact O-N 3.03Å
59	N	35.1	Very low	34	Very low	117 Å²	117	129.6 Å²	129.6	63%	0.626	75%	0.749	S	S	*	*			trans	-100.7	97.2	178.4	-84.1	-5.9	0	0	0	108.4	T57 D61	T57-N59 PolarHBondContact O-N 3.32Å; N59-D61 PolarHBondContact O-N 3.15Å; N59-D61 VanDerWaalsContact O-N 3.1Å
60	E	40	Very low	34	Very low	184 Å²	184	134.6 Å²	134.6	86%	0.86	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-60.6	-16.4	-179.6	-63.8	-178	166.2	0	0	113.1
61	D	40.7	Very low	33.7	Very low	145 Å²	145	132.5 Å²	132.5	78%	0.775	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-93.7	1.7	-168.2	-66.3	-31	0	0	0	116.4	N59	N59-D61 PolarHBondContact O-N 3.15Å; N59-D61 VanDerWaalsContact O-N 3.1Å
62	H	35.9	Very low	33.4	Very low	156 Å²	156	133.8 Å²	133.8	72%	0.722	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-122.1	25.1	-177.7	-67.3	73	0	0	0	114.6	G64	H62-G64 PolarHBondContact O-N 2.76Å
63	G	34.8	Very low	33.1	Very low	75 Å²	75	135.5 Å²	135.5	77%	0.773	77%	0.774	S	S	*	*			trans	-74.5	81.6	172.5	0	0	0	0	0	113
64	G	33	Very low	32.8	Very low	63 Å²	63	140.6 Å²	140.6	65%	0.649	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-65.7	139	172.9	0	0	0	0	0	113.1	H62 I66	H62-G64 PolarHBondContact O-N 2.76Å; G64-I66 PolarHBondContact O-N 3.32Å
65	K	28.9	Very low	32.5	Very low	194 Å²	194	140.6 Å²	140.6	84%	0.843	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.4	120.8	179	-101.3	179.7	175.7	177.5	0	112.3	H67	K65-H67 PolarHBondContact O-N 3.3Å; K65-H67 PolarHBondContact O-ND1 3.43Å
66	I	40.2	Very low	32.2	Very low	119 Å²	119	136.9 Å²	136.9	61%	0.61	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-65.8	117.4	173.4	-58.8	169.9	0	0	0	109.4	G64 I68	G64-I66 PolarHBondContact O-N 3.32Å; I66-I68 HydrophobicContact CG2-CG1 4.32Å
67	H	29.2	Very low	31.8	Very low	176 Å²	176	137.2 Å²	137.2	82%	0.815	78%	0.781	S	S	*	*			trans	-90.2	115.5	171.1	-83.2	48.3	0	0	0	109.5	K65	K65-H67 PolarHBondContact O-N 3.3Å; K65-H67 PolarHBondContact O-ND1 3.43Å
68	I	33.9	Very low	31.4	Very low	151 Å²	151	136.2 Å²	136.2	77%	0.774	78%	0.784	S	S	*	*			trans	-95.5	110.5	168.2	-57.6	170	0	0	0	105.3	I66 D70	I66-I68 HydrophobicContact CG2-CG1 4.32Å; I68-D70 PolarHBondContact O-N 3.4Å
69	S	31.9	Very low	31	Very low	113 Å²	113	131.6 Å²	131.6	79%	0.79	78%	0.783	S	S	*	*			trans	-69.3	126.4	178	53.1	0	0	0	0	110.6	G71	S69-G71 PolarHBondContact O-N 2.95Å
70	D	28.8	Very low	30.6	Very low	168 Å²	168	129.4 Å²	129.4	90%	0.898	79%	0.789	S	S	*	*	S	Bend	trans	-62.4	125.8	177.1	-71.4	-41.5	0	0	0	111.6	I68	I68-D70 PolarHBondContact O-N 3.4Å
71	G	28.2	Very low	30	Very low	66 Å²	66	127.7 Å²	127.7	68%	0.68	78%	0.784	S	S	*	*	S	Bend	trans	89	74	159.9	0	0	0	0	0	116.5	S69	S69-G71 PolarHBondContact O-N 2.95Å
72	N	27.7	Very low	29.4	Very low	158 Å²	158	126.3 Å²	126.3	85%	0.845	78%	0.776	S	S	*	*			trans	-174.1	115.3	130.8	-92.3	-25.9	0	0	0	109.1	Y74	N72-Y74 PolarHBondContact O-N 2.62Å; N72-Y74 VanDerWaalsContact O-N 3.16Å
73	I	24.8	Very low	29.4	Very low	176 Å²	176	123.2 Å²	123.2	90%	0.903	78%	0.778	S	S	*	*			trans	-74.3	101.9	-178.9	-59.3	163.2	0	0	0	107.2
74	Y	27.7	Very low	29.2	Very low	208 Å²	208	122.5 Å²	122.5	82%	0.816	77%	0.771	S	S	*	*			trans	-86.9	118.1	170.2	-120.5	-92.7	0	0	0	109.9	N72	N72-Y74 PolarHBondContact O-N 2.62Å; N72-Y74 VanDerWaalsContact O-N 3.16Å
75	G	25.9	Very low	29.6	Very low	62 Å²	62	126.3 Å²	126.3	64%	0.639	78%	0.781	S	S	*	*			trans	-72.9	135.8	-177.1	0	0	0	0	0	113.4
76	A	26.1	Very low	30	Very low	110 Å²	110	120.2 Å²	120.2	91%	0.909	77%	0.774	S	S	*	*			trans	36.6	105.5	142.4	0	0	0	0	0	117.9
77	G	24.2	Very low	29.4	Very low	83 Å²	83	118.7 Å²	118.7	86%	0.856	77%	0.766	S	S	*	*			trans	-172.4	2.8	168.7	0	0	0	0	0	118.5
78	A	27.5	Very low	29.5	Very low	92 Å²	92	117.2 Å²	117.2	76%	0.76	76%	0.763	S	S	*	*			trans	-169.8	123.3	160.2	0	0	0	0	0	107.9	G80	A78-G80 PolarHBondContact O-N 2.9Å
79	T	26.7	Very low	29.5	Very low	147 Å²	147	117.7 Å²	117.7	90%	0.902	77%	0.766	S	S	*	*			trans	-63.2	72.9	167.3	48	0	0	0	0	109.7	I81	T79-I81 PolarHBondContact O-N 2.76Å; T79-I81 VanDerWaalsContact O-N 3.15Å
80	G	26	Very low	29.6	Very low	72 Å²	72	116.1 Å²	116.1	74%	0.742	76%	0.755	S	S	*	*			trans	-81.4	66.2	166.6	0	0	0	0	0	109.8	A78	A78-G80 PolarHBondContact O-N 2.9Å
81	I	28.3	Very low	29.7	Very low	147 Å²	147	115.6 Å²	115.6	75%	0.754	75%	0.748	S	S	*	*			trans	-141.3	93.2	168.5	-55.3	-178.6	0	0	0	109.6	T79	T79-I81 PolarHBondContact O-N 2.76Å; T79-I81 VanDerWaalsContact O-N 3.15Å
82	N	28.5	Very low	30.1	Very low	116 Å²	116	115.9 Å²	115.9	62%	0.62	74%	0.743	S	S	*	*				169.1	102.7	125.6	-100.3	-20	0	0	0	106.5	G84	N82-G84 PolarHBondContact O-N 2.76Å; N82-G84 VanDerWaalsContact O-N 3.16Å
83	A	33.9	Very low	30.1	Very low	92 Å²	92	111.6 Å²	111.6	76%	0.76	74%	0.737	S	S	*	*				33	53.1	70	0	0	0	0	0	111.9	T85	A83-T85 VanDerWaalsContact C-N 3.35Å; A83-T85 PolarHBondContact O-N 2.83Å
84	G	32.2	Very low	30.2	Very low	60 Å²	60	106 Å²	106	62%	0.619	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	95.9	165.4	0	0	0	0	0	109.7	N82	N82-G84 PolarHBondContact O-N 2.76Å; N82-G84 VanDerWaalsContact O-N 3.16Å
85	T	41.3	Very low	30.8	Very low	142 Å²	142	104 Å²	104	87%	0.871	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.8	-2.3	144.3	32.7	0	0	0	0	114	A83	A83-T85 VanDerWaalsContact C-N 3.35Å; A83-T85 PolarHBondContact O-N 2.83Å
86	G	35.8	Very low	31.4	Very low	66 Å²	66	109.6 Å²	109.6	68%	0.68	73%	0.732	S	S	*	*	S	Bend	trans	-91.4	-27.7	-180	0	0	0	0	0	117.5
87	L	29.3	Very low	31.9	Very low	88 Å²	88	108.5 Å²	108.5	46%	0.461	73%	0.731	S	S	.	*	S	Bend	trans	-115.8	-5.3	-165.7	-110	134.4	0	0	0	115.9	L89 S90 Q91	L87-L89 PolarHBondContact O-N 2.96Å; L87-S90 WeakPolarHBondContact CD2-OG 3.17Å; L87-S90 WeakPolarHBondContact CG-OG 3.41Å; L87-S90 PolarHBondContact O-N 3.43Å; L87-S90 VanDerWaalsContact O-N 3.08Å; L87-Q91 HydrophobicContact CD2-CG 4.22Å; L87-Q91 PolarHBondContact O-N 2.84Å
88	I	31.6	Very low	32.2	Very low	144 Å²	144	112.3 Å²	112.3	74%	0.738	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-20.7	172.7	-66.5	176.2	0	0	0	111.2
89	L	32	Very low	32.5	Very low	161 Å²	161	111.8 Å²	111.8	84%	0.843	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-10.7	170.6	-87.6	159.5	0	0	0	114.6	L87	L87-L89 PolarHBondContact O-N 2.96Å
90	S	35.6	Very low	32.8	Very low	81 Å²	81	108.4 Å²	108.4	57%	0.566	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-2.2	173.2	75.2	0	0	0	0	114.4	L87	L87-S90 WeakPolarHBondContact CD2-OG 3.17Å; L87-S90 WeakPolarHBondContact CG-OG 3.41Å; L87-S90 PolarHBondContact O-N 3.43Å; L87-S90 VanDerWaalsContact O-N 3.08Å
91	Q	31.4	Very low	33.4	Very low	157 Å²	157	109.2 Å²	109.2	73%	0.734	73%	0.728	S	S	*	*	S	Bend	trans	-108.9	2.3	169.4	-77.8	-172.3	-5	0	0	114.5	L87 G93	L87-Q91 HydrophobicContact CD2-CG 4.22Å; L87-Q91 PolarHBondContact O-N 2.84Å; Q91-G93 PolarHBondContact O-N 3.24Å
92	A	34.7	Very low	33.9	Very low	72 Å²	72	110.3 Å²	110.3	60%	0.595	73%	0.732	S	S	*	*			trans	-69.8	12.3	163	0	0	0	0	0	113.3
93	G	29.3	Very low	35.1	Very low	68 Å²	68	110.2 Å²	110.2	70%	0.701	73%	0.73	S	S	*	*	S	Bend	trans	-91.4	98.9	166.2	0	0	0	0	0	111.2	Q91	Q91-G93 PolarHBondContact O-N 3.24Å
94	G	26.8	Very low	36.3	Very low	57 Å²	57	110.6 Å²	110.6	59%	0.588	72%	0.72	S	S	*	*			trans	87.5	78.8	148.3	0	0	0	0	0	117.6
95	L	40.4	Very low	38	Very low	167 Å²	167	110.6 Å²	110.6	87%	0.874	72%	0.72	S	S	*	*	S	Bend	trans	-78.9	-3.9	150.1	-156.8	74.7	0	0	0	112.2
96	F	37.8	Very low	39.4	Very low	180 Å²	180	109.6 Å²	109.6	79%	0.789	71%	0.708	S	S	*	*	S	Bend	trans	-138.1	113.3	165	-74.2	-82.7	0	0	0	107.8	L98	F96-L98 PolarHBondContact O-N 2.81Å
97	G	36	Very low	41.3	Very low	86 Å²	86	111.4 Å²	111.4	89%	0.887	70%	0.702	S	S	*	*			trans	-67.2	58.2	-168.2	0	0	0	0	0	116.5
98	L	31.4	Very low	43.6	Very low	164 Å²	164	109.3 Å²	109.3	86%	0.859	70%	0.697	S	S	*	*			trans	-111.5	113.1	159.8	-78.8	160.3	0	0	0	107.3	F96	F96-L98 PolarHBondContact O-N 2.81Å
99	G	33.3	Very low	46	Very low	80 Å²	80	104.3 Å²	104.3	83%	0.825	68%	0.681	S	S	*	*			trans	-64.5	159	-175.2	0	0	0	0	0	113.8
100	G	33.5	Very low	48.6	Very low	76 Å²	76	101.6 Å²	101.6	78%	0.784	67%	0.667	S	S	*	*			trans	99.6	122.2	150.8	0	0	0	0	0	115.8
101	A	37.5	Very low	50.8	Low	89 Å²	89	102.8 Å²	102.8	74%	0.736	67%	0.666	S	S	*	*			trans	82.8	109.9	148.3	0	0	0	0	0	117.4
102	M	40.1	Very low	53.4	Low	170 Å²	170	100.9 Å²	100.9	84%	0.837	66%	0.66	S	S	*	*			trans	53.2	101	136.8	-45	-59.1	178.7	0	0	114.2	D104	M102-D104 PolarHBondContact O-N 3.28Å
103	I	53.7	Low	55.8	Low	114 Å²	114	100 Å²	100	59%	0.585	65%	0.654	S	S	*	*	S	Bend	trans	-50.2	106.1	142.2	-63.6	166.2	0	0	0	103.7	G105 L107 A108	I103-G105 PolarHBondContact O-N 2.79Å; I103-G105 VanDerWaalsContact O-N 3.14Å; I103-L107 HydrophobicContact CG2-CB 4.35Å; I103-L107 HydrophobicContact CG2-CD2 4.37Å; I103-A108 HydrophobicContact CG2-CB 4.06Å
104	D	58.5	Low	58.7	Low	101 Å²	101	101.4 Å²	101.4	54%	0.54	64%	0.644	S	S	.	*			trans	-44.9	126.6	-176	-170.2	-15.7	0	0	0	106.8	M102 L106 L107 A108	M102-D104 PolarHBondContact O-N 3.28Å; D104-L106 CarbonylContact O-C 3.54Å; D104-L106 PolarHBondContact O-N 2.86Å; D104-L106 WeakPolarHBondContact OD1-CB 3.47Å; D104-L106 PolarHBondContact OD1-N 2.97Å; D104-L107 HydrophobicContact CB-CB 4.3Å; D104-L107 WeakPolarHBondContact O-CA 3.08Å; D104-L107 PolarHBondContact O-N 3.18Å; D104-A108 PolarHBondContact O-N 2.85Å
105	G	68.8	Low	61.7	Low	60 Å²	60	103.5 Å²	103.5	62%	0.619	64%	0.642	S	S	*	*	H	α-helix	trans	-52.4	-24.9	-179.5	0	0	0	0	0	111.1	I103 G109	I103-G105 PolarHBondContact O-N 2.79Å; I103-G105 VanDerWaalsContact O-N 3.14Å; G105-G109 PolarHBondContact O-N 2.71Å
106	L	69.8	Low	63.9	Low	121 Å²	121	101.1 Å²	101.1	63%	0.634	63%	0.629	S	S	*	*	H	α-helix	trans	-67	-43.3	172	-151.7	134.7	0	0	0	113.5	D104 G109 L110	D104-L106 CarbonylContact O-C 3.54Å; D104-L106 PolarHBondContact O-N 2.86Å; D104-L106 WeakPolarHBondContact OD1-CB 3.47Å; D104-L106 PolarHBondContact OD1-N 2.97Å; L106-G109 PolarHBondContact O-N 3.47Å; L106-L110 HydrophobicContact CD2-CD1 4.23Å; L106-L110 WeakPolarHBondContact O-CB 3.48Å; L106-L110 PolarHBondContact O-N 2.68Å
107	L	76.3	Confident	66.4	Low	103 Å²	103	97.8 Å²	97.8	54%	0.539	62%	0.619	S	S	.	*	H	α-helix	trans	-69.2	-42.4	176.6	-174.4	64.1	0	0	0	111.5	I103 D104 G109 L110 L111	I103-L107 HydrophobicContact CG2-CB 4.35Å; I103-L107 HydrophobicContact CG2-CD2 4.37Å; D104-L107 HydrophobicContact CB-CB 4.3Å; D104-L107 WeakPolarHBondContact O-CA 3.08Å; D104-L107 PolarHBondContact O-N 3.18Å; L107-G109 VanDerWaalsContact C-N 3.35Å; L107-L110 PolarHBondContact O-N 2.65Å; L107-L111 WeakPolarHBondContact O-CB 3.2Å; L107-L111 PolarHBondContact O-N 3.19Å
108	A	76.3	Confident	68.6	Low	44 Å²	44	97.4 Å²	97.4	36%	0.364	60%	0.596	S	S	.	*	H	α-helix	trans	-62.6	-42.6	174.8	0	0	0	0	0	111.5	I103 D104 L111 L112	I103-A108 HydrophobicContact CG2-CB 4.06Å; D104-A108 PolarHBondContact O-N 2.85Å; A108-L111 PolarHBondContact O-N 3.22Å; A108-L112 PolarHBondContact O-N 3.5Å; A108-L112 VanDerWaalsContact O-N 3.09Å
109	G	82.5	Confident	71	Confident	39 Å²	39	92.6 Å²	92.6	40%	0.402	58%	0.576	S	S	.	*	H	α-helix	trans	-63.3	-42.1	175	0	0	0	0	0	113	G105 L106 L107 L111 L112 A113	G105-G109 PolarHBondContact O-N 2.71Å; L106-G109 PolarHBondContact O-N 3.47Å; L107-G109 VanDerWaalsContact C-N 3.35Å; G109-L111 VanDerWaalsContact C-N 3.32Å; G109-L111 PolarHBondContact O-N 3.48Å; G109-L112 PolarHBondContact O-N 2.92Å; G109-A113 WeakPolarHBondContact O-CB 3.23Å; G109-A113 PolarHBondContact O-N 3.42Å
110	L	86.1	Confident	73.1	Confident	104 Å²	104	91.6 Å²	91.6	55%	0.545	56%	0.56	S	S	.	*	H	α-helix	trans	-61	-40.8	175.2	-114.9	158.3	0	0	0	112	L106 L107 A113 L114	L106-L110 HydrophobicContact CD2-CD1 4.23Å; L106-L110 WeakPolarHBondContact O-CB 3.48Å; L106-L110 PolarHBondContact O-N 2.68Å; L107-L110 PolarHBondContact O-N 2.65Å; L110-A113 PolarHBondContact O-N 3.16Å; L110-L114 WeakPolarHBondContact O-CB 3.08Å; L110-L114 PolarHBondContact O-N 2.96Å
111	L	83.3	Confident	75.2	Confident	107 Å²	107	91.6 Å²	91.6	56%	0.56	54%	0.541	S	S	*	.	H	α-helix	trans	-68.9	-39	-179.5	-150.7	126.9	0	0	0	111.8	L107 A108 G109 L114 L115	L107-L111 WeakPolarHBondContact O-CB 3.2Å; L107-L111 PolarHBondContact O-N 3.19Å; A108-L111 PolarHBondContact O-N 3.22Å; G109-L111 VanDerWaalsContact C-N 3.32Å; G109-L111 PolarHBondContact O-N 3.48Å; L111-L114 PolarHBondContact O-N 2.9Å; L111-L115 HydrophobicContact CD2-CD1 4.29Å; L111-L115 WeakPolarHBondContact O-CG 3.37Å; L111-L115 PolarHBondContact O-N 3.5Å
112	L	85.1	Confident	77.1	Confident	116 Å²	116	92.2 Å²	92.2	61%	0.607	53%	0.531	S	S	*	.	H	α-helix	trans	-66.9	-41.4	173.6	-116.1	145.5	0	0	0	112.1	A108 G109 L115 L116	A108-L112 PolarHBondContact O-N 3.5Å; A108-L112 VanDerWaalsContact O-N 3.09Å; G109-L112 PolarHBondContact O-N 2.92Å; L112-L115 PolarHBondContact O-N 3.14Å; L112-L116 PolarHBondContact O-N 3.05Å; L112-L116 VanDerWaalsContact O-N 3.11Å
113	A	85.8	Confident	78.5	Confident	55 Å²	55	92.7 Å²	92.7	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-65.1	-39.6	174.7	0	0	0	0	0	112	G109 L110 L116 L117	G109-A113 WeakPolarHBondContact O-CB 3.23Å; G109-A113 PolarHBondContact O-N 3.42Å; L110-A113 PolarHBondContact O-N 3.16Å; A113-L116 PolarHBondContact O-N 3.34Å; A113-L117 WeakPolarHBondContact O-CB 3.25Å; A113-L117 PolarHBondContact O-N 2.73Å
114	L	90.7	Very high	79.2	Confident	96 Å²	96	89.8 Å²	89.8	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-62.9	-42.7	175.2	-170.9	81.1	0	0	0	111.4	L110 L111 L116 L117 I118	L110-L114 WeakPolarHBondContact O-CB 3.08Å; L110-L114 PolarHBondContact O-N 2.96Å; L111-L114 PolarHBondContact O-N 2.9Å; L114-L116 PolarHBondContact O-N 2.97Å; L114-L117 PolarHBondContact O-N 2.94Å; L114-I118 HydrophobicContact CD2-CD1 4.17Å; L114-I118 HydrophobicContact CG-CD1 3.93Å; L114-I118 HydrophobicContact CG-CG1 4.49Å; L114-I118 WeakPolarHBondContact O-CB 3.43Å; L114-I118 VanDerWaalsContact O-CG1 3.26Å; L114-I118 WeakPolarHBondContact O-CG1 3.39Å; L114-I118 PolarHBondContact O-N 3.2Å
115	L	88.2	Confident	79.7	Confident	102 Å²	102	87.5 Å²	87.5	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-61.1	-43.1	176.2	-81.8	163.6	0	0	0	112.1	L111 L112 I118 S119	L111-L115 HydrophobicContact CD2-CD1 4.29Å; L111-L115 WeakPolarHBondContact O-CG 3.37Å; L111-L115 PolarHBondContact O-N 3.5Å; L112-L115 PolarHBondContact O-N 3.14Å; L115-I118 PolarHBondContact O-N 2.88Å; L115-S119 PolarHBondContact O-N 3.23Å
116	L	88.2	Confident	79.2	Confident	117 Å²	117	94.7 Å²	94.7	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-63.7	-41.6	174.4	-71.4	173.5	0	0	0	111.6	L112 A113 L114 S119 A120	L112-L116 PolarHBondContact O-N 3.05Å; L112-L116 VanDerWaalsContact O-N 3.11Å; A113-L116 PolarHBondContact O-N 3.34Å; L114-L116 PolarHBondContact O-N 2.97Å; L116-S119 PolarHBondContact O-N 3.16Å; L116-S119 PolarHBondContact O-OG 3.36Å; L116-A120 PolarHBondContact O-N 2.89Å
117	L	88.5	Confident	78.5	Confident	109 Å²	109	98.6 Å²	98.6	57%	0.571	52%	0.523	S	S	*	.	H	α-helix	trans	-65.7	-40.6	177.6	-166.4	145.1	0	0	0	112.1	A113 L114 S119 A120 L121	A113-L117 WeakPolarHBondContact O-CB 3.25Å; A113-L117 PolarHBondContact O-N 2.73Å; L114-L117 PolarHBondContact O-N 2.94Å; L117-S119 VanDerWaalsContact C-N 3.34Å; L117-A120 PolarHBondContact O-N 2.84Å; L117-L121 WeakPolarHBondContact O-CB 3.23Å; L117-L121 PolarHBondContact O-N 3.17Å
118	I	83.4	Confident	77	Confident	79 Å²	79	96.3 Å²	96.3	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-62.1	-43.4	173.3	-70.4	164.8	0	0	0	110.2	L114 L115 A120 L121 I122	L114-I118 HydrophobicContact CD2-CD1 4.17Å; L114-I118 HydrophobicContact CG-CD1 3.93Å; L114-I118 HydrophobicContact CG-CG1 4.49Å; L114-I118 WeakPolarHBondContact O-CB 3.43Å; L114-I118 VanDerWaalsContact O-CG1 3.26Å; L114-I118 WeakPolarHBondContact O-CG1 3.39Å; L114-I118 PolarHBondContact O-N 3.2Å; L115-I118 PolarHBondContact O-N 2.88Å; I118-A120 VanDerWaalsContact C-N 3.35Å; I118-A120 PolarHBondContact O-N 3.47Å; I118-L121 PolarHBondContact O-N 3.15Å; I118-I122 HydrophobicContact CG2-CD1 3.77Å; I118-I122 HydrophobicContact CG2-CG1 4.38Å; I118-I122 VanDerWaalsContact O-CG1 3.26Å; I118-I122 WeakPolarHBondContact O-CG1 3.33Å; I118-I122 PolarHBondContact O-N 2.69Å
119	S	80.4	Confident	75.4	Confident	62 Å²	62	102.6 Å²	102.6	43%	0.434	53%	0.534	S	S	.	.	H	α-helix	trans	-62.4	-41.6	177.4	79	0	0	0	0	112.2	L115 L116 L117 I122 W123	L115-S119 PolarHBondContact O-N 3.23Å; L116-S119 PolarHBondContact O-N 3.16Å; L116-S119 PolarHBondContact O-OG 3.36Å; L117-S119 VanDerWaalsContact C-N 3.34Å; S119-I122 PolarHBondContact O-N 2.87Å; S119-W123 WeakPolarHBondContact O-CB 3.37Å; S119-W123 PolarHBondContact O-N 2.81Å
120	A	78.4	Confident	73.7	Confident	59 Å²	59	106.7 Å²	106.7	49%	0.488	55%	0.554	S	S	.	*	H	α-helix	trans	-66.4	-37.8	176.1	0	0	0	0	0	111.8	L116 L117 I118 W123 A124	L116-A120 PolarHBondContact O-N 2.89Å; L117-A120 PolarHBondContact O-N 2.84Å; I118-A120 VanDerWaalsContact C-N 3.35Å; I118-A120 PolarHBondContact O-N 3.47Å; A120-W123 PolarHBondContact O-N 2.9Å; A120-A124 WeakPolarHBondContact O-CB 3.45Å; A120-A124 PolarHBondContact O-N 3.37Å
121	L	78.6	Confident	72	Confident	76 Å²	76	104.7 Å²	104.7	40%	0.398	56%	0.558	S	S	.	*	H	α-helix	trans	-70.3	-39.3	178.4	-161.1	138.1	0	0	0	111.7	L117 I118 W123 A124 C125	L117-L121 WeakPolarHBondContact O-CB 3.23Å; L117-L121 PolarHBondContact O-N 3.17Å; I118-L121 PolarHBondContact O-N 3.15Å; L121-W123 VanDerWaalsContact C-N 3.33Å; L121-W123 PolarHBondContact O-N 3.39Å; L121-A124 PolarHBondContact O-N 2.78Å; L121-C125 WeakPolarHBondContact O-CB 3.33Å; L121-C125 PolarHBondContact O-N 2.81Å; L121-C125 PolarHBondContact O-SG 3.12Å; L121-C125 VanDerWaalsContact O-SG 3.34Å
122	I	76.4	Confident	70.6	Confident	102 Å²	102	103.5 Å²	103.5	52%	0.523	56%	0.558	S	S	.	*	H	α-helix	trans	-59.6	-45.3	170.8	-69.2	165.1	0	0	0	110.2	I118 S119 C125 W126	I118-I122 HydrophobicContact CG2-CD1 3.77Å; I118-I122 HydrophobicContact CG2-CG1 4.38Å; I118-I122 VanDerWaalsContact O-CG1 3.26Å; I118-I122 WeakPolarHBondContact O-CG1 3.33Å; I118-I122 PolarHBondContact O-N 2.69Å; S119-I122 PolarHBondContact O-N 2.87Å; I122-C125 PolarHBondContact O-N 3.33Å; I122-W126 PolarHBondContact O-N 2.94Å
123	W	68.6	Low	68.5	Low	180 Å²	180	100 Å²	100	68%	0.682	54%	0.543	S	S	*	.	H	α-helix	trans	-66.3	-39.4	179.1	-132.8	79.7	0	0	0	112.6	S119 A120 L121 W126 R127	S119-W123 WeakPolarHBondContact O-CB 3.37Å; S119-W123 PolarHBondContact O-N 2.81Å; A120-W123 PolarHBondContact O-N 2.9Å; L121-W123 VanDerWaalsContact C-N 3.33Å; L121-W123 PolarHBondContact O-N 3.39Å; W123-W126 PolarHBondContact O-N 2.81Å; W123-R127 PolarHBondContact O-N 3.17Å
124	A	68.7	Low	66.5	Low	54 Å²	54	100.9 Å²	100.9	45%	0.446	56%	0.557	S	S	.	*	H	α-helix	trans	-65.2	-44.2	174.3	0	0	0	0	0	111.5	A120 L121 W126 R127 C128	A120-A124 WeakPolarHBondContact O-CB 3.45Å; A120-A124 PolarHBondContact O-N 3.37Å; L121-A124 PolarHBondContact O-N 2.78Å; A124-W126 VanDerWaalsContact C-N 3.26Å; A124-W126 PolarHBondContact O-N 2.9Å; A124-R127 PolarHBondContact O-N 2.76Å; A124-R127 VanDerWaalsContact O-N 3.16Å; A124-C128 PolarHBondContact O-N 3.35Å; A124-C128 PolarHBondContact O-SG 3.46Å
125	C	69.1	Low	64.1	Low	52 Å²	52	106.6 Å²	106.6	35%	0.351	57%	0.572	S	S	.	*	H	α-helix	trans	-60.6	-34.7	174.7	-76.6	0	0	0	0	112.4	L121 I122 R127 C128	L121-C125 WeakPolarHBondContact O-CB 3.33Å; L121-C125 PolarHBondContact O-N 2.81Å; L121-C125 PolarHBondContact O-SG 3.12Å; L121-C125 VanDerWaalsContact O-SG 3.34Å; I122-C125 PolarHBondContact O-N 3.33Å; C125-R127 VanDerWaalsContact C-N 3.31Å; C125-R127 PolarHBondContact O-N 2.84Å; C125-C128 PolarHBondContact O-N 2.93Å
126	W	59.4	Low	61.9	Low	211 Å²	211	103 Å²	103	80%	0.799	56%	0.555	S	S	*	*	H	α-helix	trans	-68.2	-27.7	177	-117.6	55	0	0	0	113.8	I122 W123 A124	I122-W126 PolarHBondContact O-N 2.94Å; W123-W126 PolarHBondContact O-N 2.81Å; A124-W126 VanDerWaalsContact C-N 3.26Å; A124-W126 PolarHBondContact O-N 2.9Å
127	R	54.7	Low	59.6	Low	203 Å²	203	100.5 Å²	100.5	77%	0.766	55%	0.551	S	S	*	*	H	α-helix	trans	-90.6	-11.3	179.6	-156	167.8	-178.2	128.5	-2.2	113.3	W123 A124 C125	W123-R127 PolarHBondContact O-N 3.17Å; A124-R127 PolarHBondContact O-N 2.76Å; A124-R127 VanDerWaalsContact O-N 3.16Å; C125-R127 VanDerWaalsContact C-N 3.31Å; C125-R127 PolarHBondContact O-N 2.84Å
128	C	44.3	Very low	57	Low	55 Å²	55	97.6 Å²	97.6	37%	0.372	55%	0.548	S	S	.	.	S	Bend	trans	-80.5	127.5	-179.9	-82.3	0	0	0	0	111	A124 C125 C132	A124-C128 PolarHBondContact O-N 3.35Å; A124-C128 PolarHBondContact O-SG 3.46Å; C125-C128 PolarHBondContact O-N 2.93Å; C128-C132 WeakPolarHBondContact CB-SG 3.5Å; C128-C132 PolarHBondContact SG-SG 3.09Å
129	K	43.7	Very low	54.5	Low	177 Å²	177	103.5 Å²	103.5	77%	0.77	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-54.8	141.2	166.6	-104.8	-177.4	174.4	-179.1	0	109.3	G131 C132	K129-G131 PolarHBondContact O-N 3.05Å; K129-G131 VanDerWaalsContact O-N 3.17Å; K129-C132 PolarHBondContact O-N 3.21Å
130	P	46	Very low	52.4	Low	125 Å²	125	104.9 Å²	104.9	81%	0.812	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	126	175.9	19.7	-29.5	0	0	0	109.8
131	G	51.2	Low	50.1	Low	61 Å²	61	105.9 Å²	105.9	63%	0.629	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	105.2	-2.3	177.5	0	0	0	0	0	117.9	K129	K129-G131 PolarHBondContact O-N 3.05Å; K129-G131 VanDerWaalsContact O-N 3.17Å
132	C	54.4	Low	47.7	Very low	82 Å²	82	106.5 Å²	106.5	55%	0.554	60%	0.602	S	S	*	*	S	Bend	trans	-83.8	-11.9	-173.8	77.2	0	0	0	0	116.2	C128 K129	C128-C132 WeakPolarHBondContact CB-SG 3.5Å; C128-C132 PolarHBondContact SG-SG 3.09Å; K129-C132 PolarHBondContact O-N 3.21Å
133	C	39	Very low	45.4	Very low	43 Å²	43	106.6 Å²	106.6	29%	0.291	60%	0.603	S	S	.	*	S	Bend	trans	-137.4	149.9	-173	89.6	0	0	0	0	112.6	W135 C136 A137	C133-W135 PolarHBondContact O-N 3.4Å; C133-C136 HydrophobicContact CB-CB 4.15Å; C133-C136 WeakPolarHBondContact CB-SG 3.49Å; C133-C136 CarbonylContact O-C 3.51Å; C133-C136 WeakPolarHBondContact O-CA 3.15Å; C133-C136 WeakPolarHBondContact O-CB 3.49Å; C133-C136 PolarHBondContact O-N 2.77Å; C133-C136 WeakPolarHBondContact SG-CB 3.27Å; C133-C136 PolarHBondContact SG-N 2.8Å; C133-C136 CovalentContact SG-SG 2.08Å; C133-C136 PolarHBondContact SG-SG 3.48Å; C133-A137 PolarHBondContact O-N 3.26Å
134	G	44.7	Very low	43.4	Very low	73 Å²	73	102.9 Å²	102.9	75%	0.753	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-27.4	-179.6	0	0	0	0	0	114.4
135	W	40.1	Very low	41.4	Very low	216 Å²	216	104 Å²	104	82%	0.818	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-27	173.2	-138.7	-42.4	0	0	0	112.7	C133	C133-W135 PolarHBondContact O-N 3.4Å
136	C	42.9	Very low	39.6	Very low	28 Å²	28	109.1 Å²	109.1	19%	0.189	64%	0.639	C	S	.	*	G	3₁₀ helix	trans	-78.2	-24.7	175.3	-48.2	0	0	0	0	111.1	C133 G138	C133-C136 HydrophobicContact CB-CB 4.15Å; C133-C136 WeakPolarHBondContact CB-SG 3.49Å; C133-C136 CarbonylContact O-C 3.51Å; C133-C136 WeakPolarHBondContact O-CA 3.15Å; C133-C136 WeakPolarHBondContact O-CB 3.49Å; C133-C136 PolarHBondContact O-N 2.77Å; C133-C136 WeakPolarHBondContact SG-CB 3.27Å; C133-C136 PolarHBondContact SG-N 2.8Å; C133-C136 CovalentContact SG-SG 2.08Å; C133-C136 PolarHBondContact SG-SG 3.48Å; C136-G138 PolarHBondContact O-N 2.59Å
137	A	39.4	Very low	38.5	Very low	64 Å²	64	102.9 Å²	102.9	53%	0.529	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-66.5	-1.6	179.1	0	0	0	0	0	114.4	C133	C133-A137 PolarHBondContact O-N 3.26Å
138	G	33.8	Very low	37.6	Very low	48 Å²	48	97 Å²	97	50%	0.495	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-115.4	-9.1	-177.3	0	0	0	0	0	116.7	C136	C136-G138 PolarHBondContact O-N 2.59Å
139	K	30.6	Very low	37.1	Very low	203 Å²	203	104.2 Å²	104.2	88%	0.883	64%	0.642	S	S	*	*	S	Bend	trans	-105.1	-0.4	-176	-84.1	-169.3	176.2	-175.4	0	116.1
140	S	36.5	Very low	36.9	Very low	91 Å²	91	97.6 Å²	97.6	64%	0.636	62%	0.618	S	S	*	*	S	Bend	trans	-100.2	62.3	157.2	63.7	0	0	0	0	108.9
141	N	29.5	Very low	36.5	Very low	79 Å²	79	100.3 Å²	100.3	42%	0.422	61%	0.612	S	S	.	*			trans	-161.8	86.8	171.9	-92.8	-32.3	0	0	0	109.3	L143	N141-L143 HydrophobicContact CB-CB 4.11Å; N141-L143 HydrophobicContact CB-CD1 3.55Å; N141-L143 HydrophobicContact CB-CG 3.58Å; N141-L143 VanDerWaalsContact CG-CG 3.42Å; N141-L143 VanDerWaalsContact ND2-CD1 3.28Å; N141-L143 WeakPolarHBondContact ND2-CD1 3.41Å; N141-L143 PolarHBondContact O-N 3Å; N141-L143 WeakPolarHBondContact OD1-CG 3.34Å
142	G	28	Very low	35.5	Very low	89 Å²	89	102.7 Å²	102.7	92%	0.918	61%	0.61	S	S	*	*			trans	-64.7	71.5	141.9	0	0	0	0	0	108.1	A144	G142-A144 PolarHBondContact O-N 3Å
143	L	28.2	Very low	34.7	Very low	105 Å²	105	100.7 Å²	100.7	55%	0.55	60%	0.6	S	S	.	*			trans	-79.4	74.3	179.1	-96.2	165.2	0	0	0	109.2	N141 R146	N141-L143 HydrophobicContact CB-CB 4.11Å; N141-L143 HydrophobicContact CB-CD1 3.55Å; N141-L143 HydrophobicContact CB-CG 3.58Å; N141-L143 VanDerWaalsContact CG-CG 3.42Å; N141-L143 VanDerWaalsContact ND2-CD1 3.28Å; N141-L143 WeakPolarHBondContact ND2-CD1 3.41Å; N141-L143 PolarHBondContact O-N 3Å; N141-L143 WeakPolarHBondContact OD1-CG 3.34Å; L143-R146 HydrophobicContact CD2-CB 4.33Å
144	A	26.7	Very low	34.7	Very low	101 Å²	101	102 Å²	102	84%	0.835	61%	0.613	S	S	*	*	S	Bend	trans	-103.3	96.6	146	0	0	0	0	0	106.9	G142	G142-A144 PolarHBondContact O-N 3Å
145	G	27.2	Very low	34.3	Very low	77 Å²	77	104.8 Å²	104.8	79%	0.794	61%	0.609	S	S	*	*			trans	88.3	50.5	156.3	0	0	0	0	0	119.1
146	R	30.6	Very low	33.8	Very low	161 Å²	161	98.9 Å²	98.9	61%	0.608	60%	0.6	S	S	*	*			trans	-84.9	112.9	155.6	-89.2	-171.3	173	-173.6	-1.2	110.4	L143 E512	L143-R146 HydrophobicContact CD2-CB 4.33Å; R146-E512 IonicContact NH2-OE1 3.42Å
147	S	36.7	Very low	33.2	Very low	80 Å²	80	102.9 Å²	102.9	56%	0.559	63%	0.627	S	S	*	*			trans	-69.1	150.7	168	70.9	0	0	0	0	110.1	W149 S150	S147-W149 PolarHBondContact O-N 3.03Å; S147-S150 PolarHBondContact O-N 3.22Å; S147-S150 PolarHBondContact O-OG 3.02Å
148	A	36.9	Very low	32.8	Very low	80 Å²	80	103.1 Å²	103.1	66%	0.661	63%	0.629	S	S	*	*	H	α-helix	trans	-52.2	-22.1	-179.3	0	0	0	0	0	114	S150 R151 L152	A148-S150 PolarHBondContact O-N 3.13Å; A148-R151 PolarHBondContact O-N 3.08Å; A148-L152 PolarHBondContact O-N 3.3Å
149	W	32.9	Very low	32.4	Very low	205 Å²	205	105 Å²	105	78%	0.777	64%	0.64	S	S	*	*	H	α-helix	trans	-62	-36.5	176.1	-114.7	102.2	0	0	0	113.7	S147 R151 L152 A153	S147-W149 PolarHBondContact O-N 3.03Å; W149-R151 VanDerWaalsContact C-N 3.31Å; W149-R151 PolarHBondContact O-N 3.25Å; W149-L152 PolarHBondContact O-N 3.14Å; W149-A153 PolarHBondContact O-N 3.45Å
150	S	40.8	Very low	32.3	Very low	39 Å²	39	101.2 Å²	101.2	27%	0.273	64%	0.636	S	S	.	*	H	α-helix	trans	-66	-32	178	60.9	0	0	0	0	113.1	S147 A148 A154	S147-S150 PolarHBondContact O-N 3.22Å; S147-S150 PolarHBondContact O-OG 3.02Å; A148-S150 PolarHBondContact O-N 3.13Å; S150-A154 PolarHBondContact O-N 3.25Å
151	R	36.9	Very low	32.1	Very low	181 Å²	181	105.8 Å²	105.8	68%	0.683	65%	0.647	S	S	*	*	H	α-helix	trans	-71.2	-34.6	175.7	-69	-178.1	170.3	-175.4	-3.1	111.8	A148 W149 I155	A148-R151 PolarHBondContact O-N 3.08Å; W149-R151 VanDerWaalsContact C-N 3.31Å; W149-R151 PolarHBondContact O-N 3.25Å; R151-I155 VanDerWaalsContact O-CD1 3.27Å; R151-I155 WeakPolarHBondContact O-CD1 3.4Å; R151-I155 VanDerWaalsContact O-CG1 3.23Å; R151-I155 WeakPolarHBondContact O-CG1 3.28Å; R151-I155 PolarHBondContact O-N 3.07Å
152	L	30.6	Very low	31.9	Very low	111 Å²	111	107.5 Å²	107.5	58%	0.581	67%	0.665	S	S	*	*	H	α-helix	trans	-76.9	-40.2	-178.5	-131.5	138.6	0	0	0	111.3	A148 W149 A154 I155 C156	A148-L152 PolarHBondContact O-N 3.3Å; W149-L152 PolarHBondContact O-N 3.14Å; L152-A154 PolarHBondContact O-N 3.23Å; L152-I155 PolarHBondContact O-N 3.45Å; L152-C156 PolarHBondContact O-N 3.01Å; L152-C156 PolarHBondContact O-SG 3.33Å; L152-C156 VanDerWaalsContact O-SG 3.34Å
153	A	37.3	Very low	31.8	Very low	41 Å²	41	108.1 Å²	108.1	34%	0.339	66%	0.662	S	S	.	*	H	α-helix	trans	-62.5	-40.8	176.4	0	0	0	0	0	112.8	W149 I155 C156 C157	W149-A153 PolarHBondContact O-N 3.45Å; A153-I155 VanDerWaalsContact C-N 3.3Å; A153-I155 PolarHBondContact O-N 3.36Å; A153-C156 PolarHBondContact O-N 3.32Å; A153-C157 WeakPolarHBondContact O-CB 3.29Å; A153-C157 PolarHBondContact O-N 3.49Å; A153-C157 PolarHBondContact O-SG 3.48Å
154	A	38.4	Very low	31.5	Very low	69 Å²	69	109.9 Å²	109.9	57%	0.57	67%	0.67	S	S	*	*	H	α-helix	trans	-65.9	-31.2	176.5	0	0	0	0	0	113	S150 L152	S150-A154 PolarHBondContact O-N 3.25Å; L152-A154 PolarHBondContact O-N 3.23Å
155	I	37	Very low	31.3	Very low	132 Å²	132	112.9 Å²	112.9	68%	0.677	67%	0.671	S	S	*	*	H	α-helix	trans	-76	-37.6	175.7	-65.4	165.8	0	0	0	110.7	R151 L152 A153	R151-I155 VanDerWaalsContact O-CD1 3.27Å; R151-I155 WeakPolarHBondContact O-CD1 3.4Å; R151-I155 VanDerWaalsContact O-CG1 3.23Å; R151-I155 WeakPolarHBondContact O-CG1 3.28Å; R151-I155 PolarHBondContact O-N 3.07Å; L152-I155 PolarHBondContact O-N 3.45Å; A153-I155 VanDerWaalsContact C-N 3.3Å; A153-I155 PolarHBondContact O-N 3.36Å
156	C	28.4	Very low	31.2	Very low	93 Å²	93	115.3 Å²	115.3	63%	0.628	67%	0.67	S	S	*	*	H	α-helix	trans	-76.7	-26.8	-178.8	-69.3	0	0	0	0	114	L152 A153	L152-C156 PolarHBondContact O-N 3.01Å; L152-C156 PolarHBondContact O-SG 3.33Å; L152-C156 VanDerWaalsContact O-SG 3.34Å; A153-C156 PolarHBondContact O-N 3.32Å
157	C	30.3	Very low	30.8	Very low	112 Å²	112	117.1 Å²	117.1	76%	0.757	68%	0.682	S	S	*	*	S	Bend	trans	-96.6	0.4	-178.5	-63.2	0	0	0	0	114.1	A153 A159	A153-C157 WeakPolarHBondContact O-CB 3.29Å; A153-C157 PolarHBondContact O-N 3.49Å; A153-C157 PolarHBondContact O-SG 3.48Å; C157-A159 PolarHBondContact O-N 2.88Å
158	A	31.1	Very low	30.2	Very low	69 Å²	69	122.7 Å²	122.7	57%	0.57	70%	0.7	S	S	*	*	S	Bend	trans	-76.1	109.5	172.3	0	0	0	0	0	109.8
159	A	26.6	Very low	29.7	Very low	86 Å²	86	128.4 Å²	128.4	71%	0.711	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-56.9	137.6	171	0	0	0	0	0	110.2	C157 E161	C157-A159 PolarHBondContact O-N 2.88Å; A159-E161 PolarHBondContact O-N 2.87Å
160	P	27.7	Very low	29.2	Very low	125 Å²	125	127.8 Å²	127.8	81%	0.812	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-67	123.1	-171.5	25.5	-32.3	0	0	0	110.9	S162	P160-S162 PolarHBondContact O-N 2.8Å
161	E	31.5	Very low	28.2	Very low	187 Å²	187	135.2 Å²	135.2	87%	0.874	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-55.8	125.5	171.7	-73.6	-175.2	153.4	0	0	109.6	A159 A163	A159-E161 PolarHBondContact O-N 2.87Å; E161-A163 VanDerWaalsContact C-N 3.3Å; E161-A163 PolarHBondContact O-N 3.09Å
162	S	26.4	Very low	27.5	Very low	114 Å²	114	134.3 Å²	134.3	80%	0.797	75%	0.75	S	S	*	*			trans	-67.2	91.9	175.2	3.2	0	0	0	0	108.3	P160 I164	P160-S162 PolarHBondContact O-N 2.8Å; S162-I164 VanDerWaalsContact C-N 3.28Å; S162-I164 PolarHBondContact O-N 2.8Å
163	A	25.3	Very low	27.2	Very low	103 Å²	103	137 Å²	137	85%	0.851	76%	0.764	S	S	*	*			trans	-68.4	84.4	174.2	0	0	0	0	0	110	E161	E161-A163 VanDerWaalsContact C-N 3.3Å; E161-A163 PolarHBondContact O-N 3.09Å
164	I	21.7	Very low	26.4	Very low	141 Å²	141	139.6 Å²	139.6	72%	0.723	78%	0.78	S	S	*	*			trans	-120.7	97.4	161.8	-55.9	175.1	0	0	0	106.1	S162	S162-I164 VanDerWaalsContact C-N 3.28Å; S162-I164 PolarHBondContact O-N 2.8Å
165	I	24.2	Very low	25.6	Very low	165 Å²	165	142.7 Å²	142.7	85%	0.846	79%	0.787	S	S	*	*			trans	-160	105.6	138.9	-85.8	135.7	0	0	0	108.3
166	V	24.8	Very low	24.9	Very low	127 Å²	127	143.6 Å²	143.6	77%	0.77	79%	0.793	S	S	*	*			trans	7.1	125.2	141.8	-174	0	0	0	0	117.6	E168	V166-E168 PolarHBondContact O-N 2.88Å
167	K	21.9	Very low	24.6	Very low	200 Å²	200	142.7 Å²	142.7	87%	0.87	80%	0.799	S	S	*	*			trans	-42.6	112.8	166.4	-68.1	172.2	174.9	173.9	0	113.2	K169	K167-K169 PolarHBondContact O-N 2.87Å
168	E	24	Very low	24.2	Very low	197 Å²	197	145 Å²	145	92%	0.921	80%	0.804	S	S	*	*			trans	-79.2	111.6	164.6	-134.3	172.6	-168.4	0	0	109.4	V166 K170	V166-E168 PolarHBondContact O-N 2.88Å; E168-K170 PolarHBondContact O-N 3.18Å
169	K	25	Very low	23.9	Very low	200 Å²	200	149.7 Å²	149.7	87%	0.87	82%	0.818	S	S	*	*			trans	-78.7	106.8	172.2	-90.8	-178	175.8	178.5	0	109.1	K167	K167-K169 PolarHBondContact O-N 2.87Å
170	K	22.4	Very low	23.6	Very low	192 Å²	192	148.7 Å²	148.7	84%	0.835	82%	0.816	S	S	*	*			trans	20.9	108.7	143	-74.6	-177.3	173.5	-177.4	0	117	E168 L172	E168-K170 PolarHBondContact O-N 3.18Å; K170-L172 PolarHBondContact O-N 2.78Å
171	H	20.7	Very low	23.2	Very low	194 Å²	194	150.2 Å²	150.2	90%	0.898	82%	0.816	S	S	*	*			trans	-17	110.1	135.3	-77.3	-95.4	0	0	0	114.2
172	L	21.8	Very low	22.7	Very low	162 Å²	162	148 Å²	148	85%	0.848	81%	0.814	S	S	*	*			trans	-132	102.4	149.2	-82	170.7	0	0	0	106	K170	K170-L172 PolarHBondContact O-N 2.78Å
173	L	23.9	Very low	22.4	Very low	168 Å²	168	149.7 Å²	149.7	88%	0.88	82%	0.815	S	S	*	*				173.1	100.4	124.7	-87.6	154.5	0	0	0	107.2
174	S	21.9	Very low	22.2	Very low	96 Å²	96	148.5 Å²	148.5	67%	0.671	81%	0.813	S	S	*	*			trans	-59.6	151.1	163.1	50.8	0	0	0	0	111.3
175	D	21	Very low	22.1	Very low	133 Å²	133	146.3 Å²	146.3	71%	0.711	82%	0.816	S	S	*	*			trans	80.6	116.9	138.1	-83.4	14.9	0	0	0	120.3
176	N	22	Very low	22.2	Very low	151 Å²	151	143 Å²	143	81%	0.807	81%	0.812	S	S	*	*			trans	87.4	110.3	133.6	-62	-23	0	0	0	117.6
177	G	23.4	Very low	22	Very low	74 Å²	74	143.5 Å²	143.5	76%	0.763	82%	0.816	S	S	*	*			trans	169.1	78.5	161.7	0	0	0	0	0	113	I179	G177-I179 PolarHBondContact O-N 2.93Å
178	N	22.1	Very low	22.1	Very low	160 Å²	160	137.9 Å²	137.9	86%	0.856	82%	0.815	S	S	*	*			trans	-41.7	133.4	156.7	-74.8	-28.5	0	0	0	111
179	I	23.2	Very low	21.9	Very low	169 Å²	169	131.8 Å²	131.8	87%	0.867	81%	0.805	S	S	*	*			trans	-174.8	114.1	144.6	-80.6	133.2	0	0	0	102.5	G177	G177-I179 PolarHBondContact O-N 2.93Å
180	G	21	Very low	21.8	Very low	65 Å²	65	131.7 Å²	131.7	67%	0.67	81%	0.81	S	S	*	*				106.4	104.5	56	0	0	0	0	0	107.2
181	I	19.2	Very low	21.6	Very low	157 Å²	157	129.2 Å²	129.2	81%	0.805	81%	0.811	S	S	*	*			trans	-44.2	133.5	173	-63.4	158.1	0	0	0	111.1
182	V	21.4	Very low	21.7	Very low	139 Å²	139	124 Å²	124	84%	0.842	80%	0.802	S	S	*	*			trans	-139.6	117.1	153.3	-170.1	0	0	0	0	108.8
183	D	19	Very low	21.6	Very low	150 Å²	150	122.6 Å²	122.6	80%	0.802	80%	0.8	S	S	*	*			trans	-57.6	148.2	167.5	-75.4	-52.2	0	0	0	112.4
184	G	21.8	Very low	21.5	Very low	79 Å²	79	118.9 Å²	118.9	81%	0.814	79%	0.789	S	S	*	*			trans	-155.7	80.9	174.3	0	0	0	0	0	111.2
185	A	20	Very low	21.6	Very low	95 Å²	95	123 Å²	123	79%	0.785	80%	0.802	S	S	*	*			trans	-65	145	172.6	0	0	0	0	0	113
186	A	25.9	Very low	21.6	Very low	94 Å²	94	124.3 Å²	124.3	78%	0.777	80%	0.804	S	S	*	*			trans	-154.3	84.8	151.6	0	0	0	0	0	106.7
187	T	20.5	Very low	21.6	Very low	139 Å²	139	121.2 Å²	121.2	85%	0.853	79%	0.794	S	S	*	*				31.2	102.6	92.4	56.3	0	0	0	0	115
188	G	24.3	Very low	21.7	Very low	81 Å²	81	126.2 Å²	126.2	84%	0.835	80%	0.802	S	S	*	*			trans	-156.9	72.6	165.7	0	0	0	0	0	108.4
189	G	19.4	Very low	21.6	Very low	70 Å²	70	126.4 Å²	126.4	72%	0.722	80%	0.798	S	S	*	*			trans	-76.3	150	169.8	0	0	0	0	0	111.1
190	M	22.5	Very low	21.7	Very low	197 Å²	197	124.3 Å²	124.3	97%	0.97	79%	0.794	S	S	*	*			trans	-162.6	120.1	136.4	-104.7	-165.1	-77	0	0	109.7
191	T	18.1	Very low	21.7	Very low	140 Å²	140	130 Å²	130	86%	0.859	80%	0.803	S	S	*	*			trans	-89.3	137.6	167.3	47	0	0	0	0	109.8
192	A	22.5	Very low	21.9	Very low	86 Å²	86	127.8 Å²	127.8	71%	0.711	80%	0.801	S	S	*	*			trans	-168.8	95.9	154	0	0	0	0	0	108
193	T	20.6	Very low	21.9	Very low	131 Å²	131	132 Å²	132	80%	0.804	80%	0.801	S	S	*	*				72.3	113.2	95.7	53.2	0	0	0	0	116.2
194	S	21	Very low	21.9	Very low	91 Å²	91	132 Å²	132	64%	0.636	80%	0.8	S	S	*	*			trans	63.4	104.5	130.3	-159.1	0	0	0	0	119
195	L	24.2	Very low	22	Very low	182 Å²	182	135 Å²	135	95%	0.953	80%	0.802	S	S	*	*			trans	-122.2	102.2	145.9	-105.8	155.4	0	0	0	108.1
196	Q	21.3	Very low	21.9	Very low	160 Å²	160	139.4 Å²	139.4	75%	0.748	80%	0.804	S	S	*	*			trans	-76.3	154.9	173.7	-71.7	173.1	-26.9	0	0	111.3
197	S	21.8	Very low	21.7	Very low	86 Å²	86	139.3 Å²	139.3	60%	0.601	80%	0.803	S	S	*	*			trans	64.9	101.1	135.3	170.8	0	0	0	0	118.5
198	L	25.7	Very low	22.3	Very low	179 Å²	179	138.1 Å²	138.1	94%	0.937	80%	0.798	S	S	*	*				-110.3	106.3	129.8	-108.6	98.6	0	0	0	109.3
199	Q	20.2	Very low	22.1	Very low	164 Å²	164	142.6 Å²	142.6	77%	0.766	80%	0.801	S	S	*	*			trans	-90.2	138.9	158.7	-68.9	177.2	-32.4	0	0	108.8
200	T	25.6	Very low	22.1	Very low	126 Å²	126	144.2 Å²	144.2	77%	0.773	80%	0.802	S	S	*	*			trans	-173.1	97.3	144.2	40.9	0	0	0	0	107.6
201	Q	21.4	Very low	22	Very low	185 Å²	185	140.8 Å²	140.8	86%	0.864	79%	0.792	S	S	*	*				58.5	108.6	100.2	-74.6	-168.3	1.6	0	0	115.8
202	S	22.8	Very low	22.1	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	79%	0.786	S	S	*	*				138.2	141.3	100.8	65.9	0	0	0	0	116.2
203	R	22	Very low	21.9	Very low	227 Å²	227	141.1 Å²	141.1	86%	0.857	79%	0.789	S	S	*	*			trans	72.5	92.9	147.9	-87	179.2	166.4	169.6	-4.1	120.3
204	I	19.1	Very low	21.8	Very low	151 Å²	151	145.7 Å²	145.7	77%	0.774	79%	0.794	S	S	*	*				22.8	110.6	108.4	-51.4	170.2	0	0	0	115.6
205	V	24	Very low	21.8	Very low	142 Å²	142	147.2 Å²	147.2	86%	0.861	80%	0.801	S	S	*	*			trans	-137.7	121.1	133.3	178.3	0	0	0	0	107.8
206	K	17.8	Very low	21.9	Very low	188 Å²	188	146.9 Å²	146.9	82%	0.817	80%	0.798	S	S	*	*			trans	-89.2	143.2	169.6	-80.1	-179.8	172.8	-179.8	0	109.4
207	A	21.3	Very low	21.8	Very low	91 Å²	91	142.1 Å²	142.1	75%	0.752	79%	0.792	S	S	*	*			trans	74.2	162.3	148.4	0	0	0	0	0	118.8
208	P	32.5	Very low	21.8	Very low	115 Å²	115	146 Å²	146	75%	0.747	80%	0.801	S	S	*	*			cis	-130.4	171.3	-18.6	22.7	0.4	0	0	0	114.7
209	L	19.7	Very low	21.7	Very low	174 Å²	174	143.9 Å²	143.9	91%	0.911	79%	0.79	S	S	*	*			trans	-38.5	126.9	157	-69.4	135.3	0	0	0	114.2
210	S	20.3	Very low	22	Very low	105 Å²	105	145.7 Å²	145.7	73%	0.734	80%	0.798	S	S	*	*			trans	-172.9	109.1	146.1	45.9	0	0	0	0	107.9
211	V	19.5	Very low	21.8	Very low	125 Å²	125	150.3 Å²	150.3	76%	0.758	80%	0.801	S	S	*	*				65.4	103	92.2	177.7	0	0	0	0	112.8
212	T	20.4	Very low	21.9	Very low	121 Å²	121	148.3 Å²	148.3	74%	0.742	80%	0.796	S	S	*	*			trans	51.6	120.6	148.3	62.7	0	0	0	0	119.7
213	S	18.9	Very low	21.9	Very low	111 Å²	111	150 Å²	150	78%	0.776	80%	0.796	S	S	*	*				163.2	137.7	109.6	50.7	0	0	0	0	111.3
214	Y	18.6	Very low	22.1	Very low	228 Å²	228	146.6 Å²	146.6	89%	0.894	80%	0.795	S	S	*	*			trans	-63.5	143.9	167.2	-77.1	-98.1	0	0	0	111
215	P	21.5	Very low	22.9	Very low	122 Å²	122	145.6 Å²	145.6	79%	0.792	80%	0.796	S	S	*	*			trans	-126.1	127.4	140.1	30.3	-15.6	0	0	0	111.9
216	I	24.8	Very low	23	Very low	175 Å²	175	145.6 Å²	145.6	90%	0.897	79%	0.791	S	S	*	*			trans	-51.8	138.8	163.5	-65	155.5	0	0	0	110.3
217	G	19.7	Very low	23.5	Very low	60 Å²	60	144.4 Å²	144.4	62%	0.619	79%	0.788	S	S	*	*			trans	177.3	96.3	169.2	0	0	0	0	0	117.9
218	H	21.4	Very low	23.7	Very low	168 Å²	168	148.5 Å²	148.5	78%	0.778	80%	0.796	S	S	*	*			trans	76	110.5	140.5	-68	-64.5	0	0	0	123.3
219	N	23.4	Very low	23.3	Very low	135 Å²	135	146.4 Å²	146.4	72%	0.722	79%	0.794	S	S	*	*				57.8	102.3	124.3	-63.9	-14.7	0	0	0	119.6
220	H	28.2	Very low	23.6	Very low	202 Å²	202	142.7 Å²	142.7	94%	0.935	79%	0.789	S	S	*	*				-137.6	127.7	127.1	-106.6	-82.8	0	0	0	110.7
221	R	19.8	Very low	23.8	Very low	222 Å²	222	143 Å²	143	84%	0.838	79%	0.791	S	S	*	*			trans	-91.5	154	177.8	-169.3	-179.2	-176.1	178.8	1.2	108.1
222	L	23.3	Very low	24	Very low	143 Å²	143	141.1 Å²	141.1	75%	0.749	80%	0.797	S	S	*	*			trans	87.8	127.7	174.5	-62.8	108.6	0	0	0	115.4
223	D	23.3	Very low	24.2	Very low	144 Å²	144	142.1 Å²	142.1	77%	0.77	80%	0.796	S	S	*	*			cis	-147.6	137.4	5.9	-107.2	-23.6	0	0	0	110.6
224	L	26.1	Very low	24.6	Very low	157 Å²	157	141.2 Å²	141.2	82%	0.822	79%	0.79	S	S	*	*			trans	-110	133.6	171.1	-78	155.9	0	0	0	107.5
225	T	36.1	Very low	24.8	Very low	130 Å²	130	136.1 Å²	136.1	80%	0.798	78%	0.783	S	S	*	*			trans	63.3	111.9	166.2	48.6	0	0	0	0	118
226	D	27.3	Very low	25	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	77%	0.771	S	S	*	*			trans	-167.2	131.1	132	-106.8	-15.7	0	0	0	113.7
227	Q	27.3	Very low	25	Very low	164 Å²	164	137.5 Å²	137.5	77%	0.766	77%	0.768	S	S	*	*			trans	66	101.8	154.1	-55.3	173.8	23	0	0	116.3
228	I	26.3	Very low	25.5	Very low	177 Å²	177	138 Å²	138	91%	0.908	76%	0.756	S	S	*	*				-166.2	120.8	73.5	-70.7	144.6	0	0	0	103.3
229	G	23.7	Very low	25.6	Very low	70 Å²	70	136.1 Å²	136.1	72%	0.722	75%	0.751	S	S	*	*				128.1	109.6	54	0	0	0	0	0	107.2
230	A	24.7	Very low	25.8	Very low	97 Å²	97	137.5 Å²	137.5	80%	0.802	75%	0.753	S	S	*	*			trans	74	111.4	166.8	0	0	0	0	0	120
231	S	25.7	Very low	25.7	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	75%	0.747	S	S	*	*	S	Bend	trans	60.9	85.9	158.3	60.7	0	0	0	0	118.8	I233	S231-I233 PolarHBondContact O-N 2.71Å
232	G	24.4	Very low	26.2	Very low	85 Å²	85	127.4 Å²	127.4	88%	0.876	73%	0.733	S	S	*	*				72.1	41.5	122	0	0	0	0	0	118.1
233	I	24	Very low	26.3	Very low	142 Å²	142	127.3 Å²	127.3	73%	0.728	73%	0.73	S	S	*	*			trans	-114.2	100.9	163.8	-56.9	175.1	0	0	0	107.7	S231 T235	S231-I233 PolarHBondContact O-N 2.71Å; I233-T235 VanDerWaalsContact C-N 3.29Å; I233-T235 HydrophobicContact CG2-CG2 4.17Å; I233-T235 PolarHBondContact O-N 2.86Å
234	S	26.7	Very low	26.6	Very low	93 Å²	93	127.9 Å²	127.9	65%	0.65	73%	0.733	S	S	*	*			trans	-64.5	89.9	169.6	47.2	0	0	0	0	109.2	I236	S234-I236 PolarHBondContact O-N 2.97Å; S234-I236 VanDerWaalsContact O-N 3.14Å
235	T	22.8	Very low	26.9	Very low	121 Å²	121	124.6 Å²	124.6	74%	0.742	72%	0.716	S	S	*	*			trans	-77.3	95.7	169.5	38.3	0	0	0	0	108.6	I233 R237	I233-T235 VanDerWaalsContact C-N 3.29Å; I233-T235 HydrophobicContact CG2-CG2 4.17Å; I233-T235 PolarHBondContact O-N 2.86Å; T235-R237 PolarHBondContact O-N 2.96Å
236	I	25.8	Very low	26.7	Very low	104 Å²	104	122 Å²	122	53%	0.533	70%	0.697	S	S	.	*			trans	-66.9	116.3	175.2	-64	168.7	0	0	0	108.4	S234 I238 A345	S234-I236 PolarHBondContact O-N 2.97Å; S234-I236 VanDerWaalsContact O-N 3.14Å; I236-I238 PolarHBondContact O-N 3Å; I236-A345 HydrophobicContact CG2-CB 4.3Å
237	R	24.1	Very low	27	Very low	221 Å²	221	120.9 Å²	120.9	83%	0.834	70%	0.7	S	S	*	*			trans	-77.6	117.2	176.4	-74	-175.5	179.2	169.6	-1.4	110.2	T235	T235-R237 PolarHBondContact O-N 2.96Å
238	I	30.4	Very low	27	Very low	72 Å²	72	116.3 Å²	116.3	37%	0.369	69%	0.691	S	S	.	*			trans	-107.3	78.1	164.6	-51.2	173.9	0	0	0	106.3	I236 Y271	I236-I238 PolarHBondContact O-N 3Å; I238-Y271 HydrophobicContact CD1-CE2 4.03Å
239	D	24.6	Very low	27.1	Very low	128 Å²	128	114.1 Å²	114.1	68%	0.684	67%	0.671	S	S	*	*			trans	-117.6	73.8	171.5	-75.7	-28.9	0	0	0	108.3
240	Q	26.3	Very low	27.4	Very low	164 Å²	164	119.8 Å²	119.8	77%	0.766	68%	0.679	S	S	*	*			trans	-149.4	106.2	155.8	-101.5	177.7	4.3	0	0	108.1	V242	Q240-V242 PolarHBondContact O-N 3.35Å
241	P	27.6	Very low	27.9	Very low	122 Å²	122	117.1 Å²	117.1	79%	0.792	65%	0.651	S	S	*	*			trans	-73.9	93.7	171.1	29.9	-30.2	0	0	0	108	M243	P241-M243 PolarHBondContact O-N 2.8Å
242	V	29.2	Very low	28.2	Very low	90 Å²	90	116.1 Å²	116.1	55%	0.545	64%	0.64	S	S	.	*			trans	-78.1	76.1	167.2	-174.7	0	0	0	0	107.3	Q240 D244 D245	Q240-V242 PolarHBondContact O-N 3.35Å; V242-D244 VanDerWaalsContact C-N 3.27Å; V242-D245 HydrophobicContact CG1-CB 3.94Å
243	M	26.9	Very low	28.8	Very low	141 Å²	141	116.7 Å²	116.7	70%	0.695	62%	0.617	S	S	*	*			trans	-76.8	-12.5	174.2	-89.8	-70.9	-165.3	0	0	112.9	P241	P241-M243 PolarHBondContact O-N 2.8Å
244	D	29	Very low	29.2	Very low	155 Å²	155	114.7 Å²	114.7	83%	0.829	61%	0.608	S	S	*	*	S	Bend	trans	-94.8	-4.7	-171.2	-79.8	-13	0	0	0	115.8	V242	V242-D244 VanDerWaalsContact C-N 3.27Å
245	D	31.8	Very low	29.5	Very low	88 Å²	88	118 Å²	118	47%	0.471	62%	0.615	S	S	.	*	S	Bend	trans	-118.9	-1.7	-175.4	-147.3	25.4	0	0	0	115	V242 S247 A248	V242-D245 HydrophobicContact CG1-CB 3.94Å; D245-S247 VanDerWaalsContact C-N 3.27Å; D245-S247 PolarHBondContact O-N 3.2Å; D245-A248 PolarHBondContact O-N 3.13Å; D245-A248 WeakPolarHBondContact OD1-CB 2.94Å
246	L	33.2	Very low	30.1	Very low	75 Å²	75	120.9 Å²	120.9	39%	0.393	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	-26.1	179.2	-81	157.5	0	0	0	113	I294	L246-I294 HydrophobicContact CD2-CD1 4.31Å
247	S	31.8	Very low	30.9	Very low	118 Å²	118	117 Å²	117	83%	0.825	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-16.2	177.4	57.6	0	0	0	0	114.3	D245	D245-S247 VanDerWaalsContact C-N 3.27Å; D245-S247 PolarHBondContact O-N 3.2Å
248	A	28.8	Very low	32.2	Very low	69 Å²	69	111.3 Å²	111.3	57%	0.57	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-18.4	-174.7	0	0	0	0	0	113.4	D245 Q250	D245-A248 PolarHBondContact O-N 3.13Å; D245-A248 WeakPolarHBondContact OD1-CB 2.94Å; A248-Q250 PolarHBondContact O-N 2.79Å
249	R	28.4	Very low	33.8	Very low	131 Å²	131	112.1 Å²	112.1	49%	0.494	59%	0.59	S	S	.	*			trans	-87.5	100.7	177	-72.4	179.5	166.7	-165.4	-14.3	109.7	N251 D296	R249-N251 PolarHBondContact O-N 2.92Å; R249-D296 IonicContact CZ-OD1 3.49Å; R249-D296 IonicContact CZ-OD2 3.59Å; R249-D296 VanDerWaalsContact NH1-CG 3.33Å; R249-D296 IonicContact NH1-OD1 2.61Å; R249-D296 PolarHBondContact NH1-OD1 3.44Å; R249-D296 IonicContact NH1-OD2 3.43Å; R249-D296 PolarHBondContact NH1-OD2 2.83Å; R249-D296 IonicContact NH2-OD1 3.6Å; R249-D296 IonicContact NH2-OD2 2.92Å; R249-D296 PolarHBondContact NH2-OD2 2.85Å
250	Q	29.6	Very low	35.9	Very low	188 Å²	188	106.9 Å²	106.9	88%	0.879	56%	0.563	S	S	*	*			trans	-63.3	77.1	165	-84.5	-176.4	-41.1	0	0	109.7	A248 V252	A248-Q250 PolarHBondContact O-N 2.79Å; Q250-V252 PolarHBondContact O-N 2.85Å
251	N	35.2	Very low	38.2	Very low	41 Å²	41	101 Å²	101	22%	0.219	54%	0.536	C	S	.	.			trans	-72.1	124.4	160.3	-74.5	-10.1	0	0	0	106.8	R249 Y253 I294	R249-N251 PolarHBondContact O-N 2.92Å; N251-Y253 HydrophobicContact CB-CD2 4.29Å; N251-Y253 HydrophobicContact CB-CE2 3.75Å; N251-Y253 WeakPolarHBondContact O-CD2 3.09Å; N251-Y253 PolarHBondContact O-N 2.9Å; N251-I294 VanDerWaalsContact ND2-CG2 3.32Å; N251-I294 WeakPolarHBondContact ND2-CG2 3.4Å
252	V	32.4	Very low	40.6	Very low	91 Å²	91	96 Å²	96	55%	0.552	50%	0.504	S	S	*	.			trans	-69	92.8	-178.2	179.7	0	0	0	0	107.9	Q250 F300	Q250-V252 PolarHBondContact O-N 2.85Å; V252-F300 HydrophobicContact CB-CZ 4.12Å; V252-F300 HydrophobicContact CG1-CE1 4.4Å; V252-F300 HydrophobicContact CG1-CZ 3.97Å
253	Y	36.7	Very low	43.3	Very low	97 Å²	97	91.7 Å²	91.7	38%	0.38	48%	0.478	S	S	.	.			trans	-90.5	124.6	171.9	-68.1	-78	0	0	0	109.6	N251 I294	N251-Y253 HydrophobicContact CB-CD2 4.29Å; N251-Y253 HydrophobicContact CB-CE2 3.75Å; N251-Y253 WeakPolarHBondContact O-CD2 3.09Å; N251-Y253 PolarHBondContact O-N 2.9Å; Y253-I294 WeakPolarHBondContact OH-CD1 3.3Å
254	N	32.6	Very low	46.1	Very low	100 Å²	100	85.7 Å²	85.7	54%	0.535	45%	0.449	S	S	.	.			trans	-81.3	111.2	151.7	-82.9	-16.7	0	0	0	107.4	E256 M278	N254-E256 PolarHBondContact O-N 3.32Å; N254-M278 HydrophobicContact CB-CE 3.61Å
255	M	32.7	Very low	48.8	Very low	163 Å²	163	79.6 Å²	79.6	80%	0.803	42%	0.416	S	S	*	.			trans	-66	-13.3	179	-89.8	-164.9	175.7	0	0	113.6	G257	M255-G257 PolarHBondContact O-N 2.74Å; M255-G257 VanDerWaalsContact O-N 3.13Å
256	E	35.3	Very low	51.4	Low	180 Å²	180	75.4 Å²	75.4	84%	0.841	39%	0.394	S	S	*	.	S	Bend	trans	-77.7	97.6	175.6	-69.8	-169.9	166.1	0	0	110.6	N254	N254-E256 PolarHBondContact O-N 3.32Å
257	G	42.9	Very low	53.8	Low	22 Å²	22	76.1 Å²	76.1	23%	0.227	39%	0.394	C	S	.	.			trans	82.1	64.1	163.4	0	0	0	0	0	115.3	M255 K259	M255-G257 PolarHBondContact O-N 2.74Å; M255-G257 VanDerWaalsContact O-N 3.13Å; G257-K259 PolarHBondContact O-N 2.88Å
258	M	51.4	Low	56.3	Low	102 Å²	102	75 Å²	75	50%	0.502	38%	0.379	S	S	.	.			trans	-53.2	101	160.8	-68	-177.1	70	0	0	109.4
259	K	63	Low	58.9	Low	90 Å²	90	71.9 Å²	71.9	39%	0.391	35%	0.353	S	S	.	.			trans	-100.3	114.8	173	-69.1	-176	-171.9	-165.7	0	107.7	G257 D261 S276 G617 R619	G257-K259 PolarHBondContact O-N 2.88Å; K259-D261 PolarHBondContact O-N 2.65Å; K259-S276 VanDerWaalsContact O-CA 3.27Å; K259-S276 WeakPolarHBondContact O-CA 3.22Å; K259-S276 VanDerWaalsContact O-CB 3.24Å; K259-S276 WeakPolarHBondContact O-CB 3.34Å; K259-S276 PolarHBondContact O-OG 2.99Å; K259-G617 WeakPolarHBondContact CE-O 3.46Å; K259-G617 PolarHBondContact NZ-O 3.11Å; K259-R619 HydrophobicContact CB-CB 4.21Å
260	V	69.4	Low	61.6	Low	17 Å²	17	69.2 Å²	69.2	10%	0.103	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	113.3	169.7	-176.1	0	0	0	0	107.9	T274 L612 R619 L621	V260-T274 HydrophobicContact CG1-CG2 3.99Å; V260-L612 HydrophobicContact CB-CD2 4.01Å; V260-L612 HydrophobicContact CG1-CD2 3.44Å; V260-L612 VanDerWaalsContact CG1-CD2 3.44Å; V260-R619 WeakPolarHBondContact O-CB 3.42Å; V260-R619 WeakPolarHBondContact O-CD 3.43Å; V260-L621 HydrophobicContact CG2-CB 4.32Å
261	D	74	Confident	64.3	Low	41 Å²	41	61.1 Å²	61.1	22%	0.219	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-30.8	-173.5	-69.7	-47.2	0	0	0	112.8	K259 G275 G277 T303 R619	K259-D261 PolarHBondContact O-N 2.65Å; D261-G275 PolarHBondContact N-O 2.64Å; D261-G277 VanDerWaalsContact OD2-CA 3.3Å; D261-G277 WeakPolarHBondContact OD2-CA 3.5Å; D261-G277 PolarHBondContact OD2-N 3.1Å; D261-T303 HydrophobicContact CB-CG2 4.01Å; D261-R619 WeakPolarHBondContact OD1-CD 3.38Å; D261-R619 IonicContact OD1-CZ 2.8Å; D261-R619 IonicContact OD1-NE 3.3Å; D261-R619 IonicContact OD1-NH1 2.83Å; D261-R619 PolarHBondContact OD1-NH1 3.27Å
262	C	79.4	Confident	66.7	Low	16 Å²	16	59.2 Å²	59.2	11%	0.108	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	156.6	179.3	61.8	0	0	0	0	111.3	T274 G275 D304 L305	C262-T274 WeakPolarHBondContact O-CA 3.41Å; C262-G275 PolarHBondContact N-O 3.49Å; C262-G275 PolarHBondContact O-N 2.77Å; C262-D304 PolarHBondContact SG-N 3.21Å; C262-D304 VanDerWaalsContact SG-N 3.44Å; C262-L305 VanDerWaalsContact SG-CG 3.55Å
263	V	85.5	Confident	69.3	Low	1 Å²	1	54.9 Å²	54.9	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	139.3	-178.8	68.6	0	0	0	0	111.4	V272 V273 T274 K601 V610 L612 L621	V263-V272 HydrophobicContact CG2-CG1 3.48Å; V263-V272 VanDerWaalsContact CG2-CG1 3.48Å; V263-V273 CarbonylContact C-O 3.57Å; V263-V273 WeakPolarHBondContact CA-O 3.33Å; V263-T274 HydrophobicContact CG2-CG2 4.05Å; V263-K601 HydrophobicContact CG1-CD 4.23Å; V263-K601 VanDerWaalsContact O-CE 3.24Å; V263-K601 WeakPolarHBondContact O-CE 3.28Å; V263-K601 PolarHBondContact O-NZ 3.31Å; V263-V610 HydrophobicContact CG1-CG1 4.28Å; V263-V610 HydrophobicContact CG2-CG1 3.64Å; V263-L612 HydrophobicContact CB-CD1 4.16Å; V263-L612 HydrophobicContact CB-CD2 4.19Å; V263-L612 HydrophobicContact CB-CG 4.26Å; V263-L612 HydrophobicContact CG1-CD1 3.77Å; V263-L612 HydrophobicContact CG1-CD2 4.21Å; V263-L612 HydrophobicContact CG1-CG 3.77Å; V263-L621 HydrophobicContact CG2-CD1 4.02Å
264	V	85.5	Confident	71.5	Confident	15 Å²	15	50.5 Å²	50.5	9%	0.091	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	144.7	175.7	-176.4	0	0	0	0	108.7	V272 V273 L305 L307	V264-V272 CarbonylContact O-C 3.54Å; V264-V272 WeakPolarHBondContact O-CA 3.38Å; V264-V273 PolarHBondContact N-O 3.29Å; V264-V273 PolarHBondContact O-N 3.44Å; V264-L305 VanDerWaalsContact CG2-C 3.49Å; V264-L305 HydrophobicContact CG2-CB 3.63Å; V264-L305 WeakPolarHBondContact CG2-O 3.24Å; V264-L307 HydrophobicContact CG1-CB 4.27Å; V264-L307 HydrophobicContact CG1-CD1 3.75Å; V264-L307 HydrophobicContact CG1-CG 3.91Å
265	I	86.4	Confident	73.7	Confident	26 Å²	26	45.7 Å²	45.7	13%	0.133	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.6	172.5	-49.8	-178.8	0	0	0	106.5	V272 K601 V610	I265-V272 HydrophobicContact CG1-CG2 4.18Å; I265-V272 HydrophobicContact CG2-CG2 4.49Å; I265-K601 HydrophobicContact CD1-CB 3.83Å; I265-K601 HydrophobicContact CG1-CB 4.39Å; I265-V610 HydrophobicContact CD1-CB 4.29Å; I265-V610 HydrophobicContact CD1-CG2 3.86Å; I265-V610 HydrophobicContact CG1-CG2 4.29Å
266	T	86.3	Confident	75.7	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.195	C	C	.	.			trans	-57.5	147	172.9	48.2	0	0	0	0	111.1	N268 S269 K270 Y271 L307 D311 F344	T266-N268 WeakPolarHBondContact CB-OD1 3.27Å; T266-N268 PolarHBondContact O-N 3.46Å; T266-N268 VanDerWaalsContact O-N 3.15Å; T266-N268 PolarHBondContact OG1-OD1 2.84Å; T266-S269 WeakPolarHBondContact O-CA 3.34Å; T266-S269 PolarHBondContact O-N 2.89Å; T266-K270 PolarHBondContact OG1-N 2.73Å; T266-Y271 HydrophobicContact CG2-CD2 4.25Å; T266-Y271 PolarHBondContact N-O 2.88Å; T266-Y271 PolarHBondContact OG1-N 3.08Å; T266-Y271 PolarHBondContact OG1-O 3.4Å; T266-L307 HydrophobicContact CG2-CD1 3.62Å; T266-D311 WeakPolarHBondContact CB-OD2 3.42Å; T266-D311 HydrophobicContact CG2-CB 4.38Å; T266-F344 HydrophobicContact CG2-CE1 3.99Å; T266-F344 HydrophobicContact CG2-CZ 3.87Å
267	K	82.8	Confident	77.2	Confident	89 Å²	89	31.3 Å²	31.3	39%	0.387	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-36.3	176.1	-68.5	-175	-173.9	179	0	112	S269 D310 D311 S367 N604	K267-S269 PolarHBondContact O-N 2.97Å; K267-D310 IonicContact NZ-OD1 3.09Å; K267-D310 PolarHBondContact NZ-OD1 3.03Å; K267-D311 WeakPolarHBondContact CB-OD2 3.42Å; K267-D311 VanDerWaalsContact N-CG 3.35Å; K267-D311 PolarHBondContact N-OD1 2.9Å; K267-D311 VanDerWaalsContact N-OD1 3.09Å; K267-D311 PolarHBondContact N-OD2 3.32Å; K267-S367 PolarHBondContact NZ-OG 2.9Å; K267-N604 PolarHBondContact O-ND2 3.4Å
268	N	83.9	Confident	78.2	Confident	94 Å²	94	33.3 Å²	33.3	50%	0.503	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-1	177.3	70.9	21.4	0	0	0	114.8	T266 K270	T266-N268 WeakPolarHBondContact CB-OD1 3.27Å; T266-N268 PolarHBondContact O-N 3.46Å; T266-N268 VanDerWaalsContact O-N 3.15Å; T266-N268 PolarHBondContact OG1-OD1 2.84Å; N268-K270 PolarHBondContact O-N 3.04Å; N268-K270 VanDerWaalsContact O-N 3.11Å; N268-K270 WeakPolarHBondContact OD1-CB 3.34Å; N268-K270 PolarHBondContact OD1-N 3.42Å
269	S	83.5	Confident	79.2	Confident	4 Å²	4	28.6 Å²	28.6	3%	0.028	15%	0.149	C	C	.	.	S	Bend	trans	60.8	11	-179.1	-57	0	0	0	0	116.1	T266 K267 T286 N604 D605	T266-S269 WeakPolarHBondContact O-CA 3.34Å; T266-S269 PolarHBondContact O-N 2.89Å; K267-S269 PolarHBondContact O-N 2.97Å; S269-T286 WeakPolarHBondContact O-CB 3.34Å; S269-T286 WeakPolarHBondContact O-CG2 3.22Å; S269-T286 PolarHBondContact O-OG1 2.73Å; S269-N604 WeakPolarHBondContact OG-CB 3.26Å; S269-N604 PolarHBondContact OG-N 3.18Å; S269-D605 PolarHBondContact OG-N 2.75Å
270	K	84.2	Confident	80	Confident	75 Å²	75	24.9 Å²	24.9	33%	0.326	13%	0.133	S	C	.	.	S	Bend	trans	-87	-35.2	-177.1	-168.8	178.7	178.8	-164.6	0	112.9	T266 N268 T286	T266-K270 PolarHBondContact OG1-N 2.73Å; N268-K270 PolarHBondContact O-N 3.04Å; N268-K270 VanDerWaalsContact O-N 3.11Å; N268-K270 WeakPolarHBondContact OD1-CB 3.34Å; N268-K270 PolarHBondContact OD1-N 3.42Å; K270-T286 WeakPolarHBondContact CA-OG1 3.39Å; K270-T286 PolarHBondContact O-N 3.18Å; K270-T286 PolarHBondContact O-OG1 2.99Å
271	Y	87.1	Confident	80.7	Confident	19 Å²	19	24 Å²	24	8%	0.075	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.2	-176	-50.5	-70.7	0	0	0	112.8	I238 T266 V283 W284 F344	I238-Y271 HydrophobicContact CD1-CE2 4.03Å; T266-Y271 HydrophobicContact CG2-CD2 4.25Å; T266-Y271 PolarHBondContact N-O 2.88Å; T266-Y271 PolarHBondContact OG1-N 3.08Å; T266-Y271 PolarHBondContact OG1-O 3.4Å; Y271-V283 HydrophobicContact CD1-CG1 4.18Å; Y271-V283 HydrophobicContact CG-CG1 4.04Å; Y271-W284 CarbonylContact C-O 3.59Å; Y271-W284 VanDerWaalsContact CA-O 3.25Å; Y271-W284 WeakPolarHBondContact CA-O 3.03Å; Y271-F344 HydrophobicContact CD2-CE1 4.21Å; Y271-F344 HydrophobicContact CD2-CZ 4.35Å
272	V	85.8	Confident	81	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.1	172	167.9	0	0	0	0	107.7	V263 V264 I265 T274 V283 W284 T286 V610 M623	V263-V272 HydrophobicContact CG2-CG1 3.48Å; V263-V272 VanDerWaalsContact CG2-CG1 3.48Å; V264-V272 CarbonylContact O-C 3.54Å; V264-V272 WeakPolarHBondContact O-CA 3.38Å; I265-V272 HydrophobicContact CG1-CG2 4.18Å; I265-V272 HydrophobicContact CG2-CG2 4.49Å; V272-T274 HydrophobicContact CG1-CG2 4.17Å; V272-V283 CarbonylContact O-C 3.55Å; V272-V283 WeakPolarHBondContact O-CA 3.5Å; V272-W284 HydrophobicContact CB-CB 4.33Å; V272-W284 PolarHBondContact N-O 3.25Å; V272-W284 PolarHBondContact O-N 2.83Å; V272-T286 HydrophobicContact CB-CG2 4.49Å; V272-T286 HydrophobicContact CG2-CG2 3.48Å; V272-T286 VanDerWaalsContact CG2-CG2 3.48Å; V272-V610 HydrophobicContact CG1-CG1 4.3Å; V272-V610 HydrophobicContact CG1-CG2 4.46Å; V272-V610 HydrophobicContact CG2-CG2 3.7Å; V272-M623 HydrophobicContact CB-CE 3.91Å; V272-M623 HydrophobicContact CG1-CE 4.2Å; V272-M623 HydrophobicContact CG2-CE 3.91Å
273	V	86.4	Confident	81.3	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.8	176.2	-165.4	0	0	0	0	108.6	V263 V264 P281 Q282 V283 L305 L307 L314 F344	V263-V273 CarbonylContact C-O 3.57Å; V263-V273 WeakPolarHBondContact CA-O 3.33Å; V264-V273 PolarHBondContact N-O 3.29Å; V264-V273 PolarHBondContact O-N 3.44Å; V273-P281 HydrophobicContact CG1-CB 4.14Å; V273-Q282 CarbonylContact C-O 3.53Å; V273-Q282 VanDerWaalsContact CA-O 3.28Å; V273-Q282 WeakPolarHBondContact CA-O 3.42Å; V273-V283 HydrophobicContact CG1-CG2 4.38Å; V273-V283 HydrophobicContact CG2-CG2 4.35Å; V273-L305 HydrophobicContact CB-CD1 4.45Å; V273-L305 HydrophobicContact CG1-CD1 3.87Å; V273-L307 HydrophobicContact CG2-CD1 4.22Å; V273-L314 HydrophobicContact CG1-CD1 4.02Å; V273-L314 HydrophobicContact CG1-CD2 4.06Å; V273-F344 HydrophobicContact CG2-CE2 3.53Å; V273-F344 HydrophobicContact CG2-CZ 4.04Å
274	T	82.9	Confident	81.2	Confident	5 Å²	5	24.2 Å²	24.2	3%	0.031	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.1	177	58.7	0	0	0	0	111.2	V260 C262 V263 V272 P281 Q282 W284 L621	V260-T274 HydrophobicContact CG1-CG2 3.99Å; C262-T274 WeakPolarHBondContact O-CA 3.41Å; V263-T274 HydrophobicContact CG2-CG2 4.05Å; V272-T274 HydrophobicContact CG1-CG2 4.17Å; T274-P281 WeakPolarHBondContact O-CA 3.34Å; T274-Q282 PolarHBondContact N-O 3.24Å; T274-Q282 PolarHBondContact O-N 3.02Å; T274-Q282 PolarHBondContact OG1-O 3.45Å; T274-W284 PolarHBondContact OG1-NE1 2.91Å; T274-L621 HydrophobicContact CG2-CD1 3.91Å; T274-L621 HydrophobicContact CG2-CD2 3.76Å; T274-L621 HydrophobicContact CG2-CG 4.4Å
275	G	80	Confident	80.9	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.7	173.5	0	0	0	0	0	109.6	D261 C262 C302 L305	D261-G275 PolarHBondContact N-O 2.64Å; C262-G275 PolarHBondContact N-O 3.49Å; C262-G275 PolarHBondContact O-N 2.77Å; G275-C302 CarbonylContact C-O 3.52Å; G275-C302 VanDerWaalsContact CA-O 3.28Å; G275-C302 WeakPolarHBondContact CA-O 3.5Å; G275-L305 VanDerWaalsContact CA-CD1 3.49Å
276	S	74.1	Confident	80.5	Confident	17 Å²	17	23.5 Å²	23.5	12%	0.119	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.4	178.9	-177.6	0	0	0	0	110.9	K259 M278 G279 G301 C302	K259-S276 VanDerWaalsContact O-CA 3.27Å; K259-S276 WeakPolarHBondContact O-CA 3.22Å; K259-S276 VanDerWaalsContact O-CB 3.24Å; K259-S276 WeakPolarHBondContact O-CB 3.34Å; K259-S276 PolarHBondContact O-OG 2.99Å; S276-M278 PolarHBondContact O-N 2.9Å; S276-M278 PolarHBondContact OG-N 2.84Å; S276-G279 PolarHBondContact O-N 2.94Å; S276-G301 CarbonylContact O-C 3.51Å; S276-C302 CarbonylContact C-O 3.53Å; S276-C302 PolarHBondContact N-O 2.95Å; S276-C302 VanDerWaalsContact N-O 3.08Å; S276-C302 PolarHBondContact O-N 2.88Å
277	G	66.7	Low	80	Confident	23 Å²	23	28.6 Å²	28.6	24%	0.237	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-23.4	165.5	0	0	0	0	0	114.8	D261 G301	D261-G277 VanDerWaalsContact OD2-CA 3.3Å; D261-G277 WeakPolarHBondContact OD2-CA 3.5Å; D261-G277 PolarHBondContact OD2-N 3.1Å; G277-G301 VanDerWaalsContact O-CA 3.22Å; G277-G301 WeakPolarHBondContact O-CA 3.19Å; G277-G301 PolarHBondContact O-N 3.29Å
278	M	64.3	Low	79.4	Confident	64 Å²	64	26.7 Å²	26.7	32%	0.315	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	9	-165.6	-57.2	-61	-66.8	0	0	114.4	N254 S276	N254-M278 HydrophobicContact CB-CE 3.61Å; S276-M278 PolarHBondContact O-N 2.9Å; S276-M278 PolarHBondContact OG-N 2.84Å
279	G	72.4	Confident	78.8	Confident	4 Å²	4	22.6 Å²	22.6	4%	0.041	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.1	-176.4	177.8	0	0	0	0	0	115.2	S276 E299	S276-G279 PolarHBondContact O-N 2.94Å; G279-E299 CarbonylContact C-O 3.38Å
280	P	78.6	Confident	78.3	Confident	11 Å²	11	26.7 Å²	26.7	7%	0.071	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	160.1	-176.2	27.9	-35.8	0	0	0	112.1	I294 M295	P280-I294 HydrophobicContact CB-CG2 4.3Å; P280-I294 HydrophobicContact CG-CG2 3.59Å; P280-M295 WeakPolarHBondContact CB-O 3.5Å
281	P	83.9	Confident	77.8	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	141.3	178.3	-20	31.6	0	0	0	111.9	V273 T274 M295 C302 L305 L314 W342	V273-P281 HydrophobicContact CG1-CB 4.14Å; T274-P281 WeakPolarHBondContact O-CA 3.34Å; P281-M295 HydrophobicContact CB-CB 4.39Å; P281-M295 HydrophobicContact CB-CG 3.88Å; P281-M295 HydrophobicContact CG-CB 4.47Å; P281-M295 HydrophobicContact CG-CG 4.35Å; P281-M295 WeakPolarHBondContact O-CG 3.26Å; P281-M295 PolarHBondContact O-N 2.52Å; P281-C302 VanDerWaalsContact CD-SG 3.55Å; P281-C302 HydrophobicContact CG-CB 3.98Å; P281-L305 HydrophobicContact CB-CD1 4.44Å; P281-L305 HydrophobicContact CB-CD2 4.17Å; P281-L305 HydrophobicContact CG-CD2 3.98Å; P281-L314 HydrophobicContact CB-CD2 3.82Å; P281-L314 HydrophobicContact CG-CD2 3.99Å; P281-W342 HydrophobicContact CG-CH2 4.41Å; P281-W342 HydrophobicContact CG-CZ2 4.46Å
282	Q	82.2	Confident	77.4	Confident	17 Å²	17	27.7 Å²	27.7	8%	0.079	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.6	-178.9	-64.1	-178.1	-3.3	0	0	110.1	V273 T274 W284 L291 I294	V273-Q282 CarbonylContact C-O 3.53Å; V273-Q282 VanDerWaalsContact CA-O 3.28Å; V273-Q282 WeakPolarHBondContact CA-O 3.42Å; T274-Q282 PolarHBondContact N-O 3.24Å; T274-Q282 PolarHBondContact O-N 3.02Å; T274-Q282 PolarHBondContact OG1-O 3.45Å; Q282-W284 HydrophobicContact CB-CZ2 4.38Å; Q282-L291 HydrophobicContact CB-CD1 3.76Å; Q282-L291 HydrophobicContact CG-CD1 4.25Å; Q282-I294 HydrophobicContact CG-CG1 4.35Å
283	V	85.4	Confident	77	Confident	6 Å²	6	29.9 Å²	29.9	4%	0.036	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.4	-179.4	-172.3	0	0	0	0	108.8	Y271 V272 V273 C292 K293 M295 F344	Y271-V283 HydrophobicContact CD1-CG1 4.18Å; Y271-V283 HydrophobicContact CG-CG1 4.04Å; V272-V283 CarbonylContact O-C 3.55Å; V272-V283 WeakPolarHBondContact O-CA 3.5Å; V273-V283 HydrophobicContact CG1-CG2 4.38Å; V273-V283 HydrophobicContact CG2-CG2 4.35Å; V283-C292 WeakPolarHBondContact O-CB 3.34Å; V283-C292 PolarHBondContact O-N 2.79Å; V283-K293 HydrophobicContact CB-CB 4.12Å; V283-K293 HydrophobicContact CG2-CB 4.39Å; V283-K293 PolarHBondContact N-O 2.96Å; V283-K293 PolarHBondContact O-N 2.83Å; V283-M295 HydrophobicContact CG2-SD 4.21Å; V283-F344 HydrophobicContact CG1-CE2 4.11Å; V283-F344 HydrophobicContact CG1-CZ 3.84Å; V283-F344 HydrophobicContact CG2-CE2 3.71Å; V283-F344 HydrophobicContact CG2-CZ 4.29Å
284	W	82	Confident	76.9	Confident	38 Å²	38	30.8 Å²	30.8	14%	0.144	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	141.7	-177.3	-51.5	82.4	0	0	0	109.6	Y271 V272 T274 Q282 D290 L291 M623	Y271-W284 CarbonylContact C-O 3.59Å; Y271-W284 VanDerWaalsContact CA-O 3.25Å; Y271-W284 WeakPolarHBondContact CA-O 3.03Å; V272-W284 HydrophobicContact CB-CB 4.33Å; V272-W284 PolarHBondContact N-O 3.25Å; V272-W284 PolarHBondContact O-N 2.83Å; T274-W284 PolarHBondContact OG1-NE1 2.91Å; Q282-W284 HydrophobicContact CB-CZ2 4.38Å; W284-D290 CarbonylContact C-O 3.56Å; W284-D290 WeakPolarHBondContact CA-O 3.25Å; W284-L291 HydrophobicContact CD2-CD1 4.21Å; W284-L291 HydrophobicContact CE3-CB 4.05Å; W284-L291 HydrophobicContact CE3-CD1 4.38Å; W284-L291 HydrophobicContact CH2-CD1 4.45Å; W284-L291 HydrophobicContact CZ2-CD1 4.29Å; W284-L291 HydrophobicContact CZ3-CB 3.98Å; W284-L291 HydrophobicContact CZ3-CD1 4.49Å; W284-M623 HydrophobicContact CB-CE 4.08Å
285	D	80.6	Confident	76.9	Confident	21 Å²	21	30.6 Å²	30.6	11%	0.112	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	132.7	169.6	-171	44.7	0	0	0	109.7	Q287 S288 G289 D290 C292	D285-Q287 VanDerWaalsContact C-N 3.27Å; D285-Q287 PolarHBondContact O-N 3.34Å; D285-Q287 WeakPolarHBondContact OD2-CB 3.36Å; D285-Q287 PolarHBondContact OD2-N 3.19Å; D285-S288 WeakPolarHBondContact OD2-CB 3.44Å; D285-S288 PolarHBondContact OD2-N 3.06Å; D285-S288 PolarHBondContact OD2-OG 3.11Å; D285-G289 WeakPolarHBondContact O-CA 3.13Å; D285-G289 PolarHBondContact O-N 2.99Å; D285-D290 PolarHBondContact N-O 3.18Å; D285-C292 VanDerWaalsContact CB-SG 3.54Å; D285-C292 PolarHBondContact N-SG 2.9Å; D285-C292 VanDerWaalsContact N-SG 3.39Å
286	T	78	Confident	76.8	Confident	6 Å²	6	32.3 Å²	32.3	4%	0.037	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-24	177.5	54.6	0	0	0	0	112.9	S269 K270 V272 A608	S269-T286 WeakPolarHBondContact O-CB 3.34Å; S269-T286 WeakPolarHBondContact O-CG2 3.22Å; S269-T286 PolarHBondContact O-OG1 2.73Å; K270-T286 WeakPolarHBondContact CA-OG1 3.39Å; K270-T286 PolarHBondContact O-N 3.18Å; K270-T286 PolarHBondContact O-OG1 2.99Å; V272-T286 HydrophobicContact CB-CG2 4.49Å; V272-T286 HydrophobicContact CG2-CG2 3.48Å; V272-T286 VanDerWaalsContact CG2-CG2 3.48Å; T286-A608 HydrophobicContact CG2-CB 4.27Å
287	Q	74.9	Confident	76.5	Confident	108 Å²	108	32.4 Å²	32.4	51%	0.505	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-46.6	-175.5	-58.5	-173.9	9.8	0	0	112.1	D285 Q625	D285-Q287 VanDerWaalsContact C-N 3.27Å; D285-Q287 PolarHBondContact O-N 3.34Å; D285-Q287 WeakPolarHBondContact OD2-CB 3.36Å; D285-Q287 PolarHBondContact OD2-N 3.19Å; Q287-Q625 PolarHBondContact O-NE2 3.26Å; Q287-Q625 PolarHBondContact O-OE1 2.85Å; Q287-Q625 VanDerWaalsContact O-OE1 3.13Å
288	S	71.4	Confident	76.3	Confident	48 Å²	48	40 Å²	40	34%	0.336	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-23.8	179.1	82.7	0	0	0	0	113.2	M20 D285 D290	M20-S288 VanDerWaalsContact CE-C 3.45Å; M20-S288 VanDerWaalsContact CE-O 3.26Å; M20-S288 WeakPolarHBondContact CE-O 3.2Å; D285-S288 WeakPolarHBondContact OD2-CB 3.44Å; D285-S288 PolarHBondContact OD2-N 3.06Å; D285-S288 PolarHBondContact OD2-OG 3.11Å; S288-D290 WeakPolarHBondContact CB-OD2 3.49Å; S288-D290 PolarHBondContact O-N 2.75Å; S288-D290 VanDerWaalsContact OG-CB 3.27Å; S288-D290 WeakPolarHBondContact OG-CB 3.43Å; S288-D290 PolarHBondContact OG-N 3.15Å; S288-D290 VanDerWaalsContact OG-N 3.12Å; S288-D290 PolarHBondContact OG-OD2 2.93Å
289	G	69.4	Low	76.4	Confident	9 Å²	9	38.1 Å²	38.1	9%	0.093	20%	0.204	C	C	.	.			trans	69.9	7.6	-171.8	0	0	0	0	0	113.7	M20 D285	M20-G289 VanDerWaalsContact SD-CA 3.56Å; D285-G289 WeakPolarHBondContact O-CA 3.13Å; D285-G289 PolarHBondContact O-N 2.99Å
290	D	73.1	Confident	75.9	Confident	89 Å²	89	40.9 Å²	40.9	48%	0.476	22%	0.215	S	C	.	.			trans	-77.6	150.1	177.8	-59.4	-48.9	0	0	0	110.5	W284 D285 S288 C292	W284-D290 CarbonylContact C-O 3.56Å; W284-D290 WeakPolarHBondContact CA-O 3.25Å; D285-D290 PolarHBondContact N-O 3.18Å; S288-D290 WeakPolarHBondContact CB-OD2 3.49Å; S288-D290 PolarHBondContact O-N 2.75Å; S288-D290 VanDerWaalsContact OG-CB 3.27Å; S288-D290 WeakPolarHBondContact OG-CB 3.43Å; S288-D290 PolarHBondContact OG-N 3.15Å; S288-D290 VanDerWaalsContact OG-N 3.12Å; S288-D290 PolarHBondContact OG-OD2 2.93Å; D290-C292 PolarHBondContact O-N 2.8Å
291	L	74.8	Confident	75.3	Confident	56 Å²	56	40.5 Å²	40.5	29%	0.293	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	110.9	168.9	-179.1	67.2	0	0	0	108.9	Q282 W284 I294	Q282-L291 HydrophobicContact CB-CD1 3.76Å; Q282-L291 HydrophobicContact CG-CD1 4.25Å; W284-L291 HydrophobicContact CD2-CD1 4.21Å; W284-L291 HydrophobicContact CE3-CB 4.05Å; W284-L291 HydrophobicContact CE3-CD1 4.38Å; W284-L291 HydrophobicContact CH2-CD1 4.45Å; W284-L291 HydrophobicContact CZ2-CD1 4.29Å; W284-L291 HydrophobicContact CZ3-CB 3.98Å; W284-L291 HydrophobicContact CZ3-CD1 4.49Å; L291-I294 HydrophobicContact CD1-CG1 4.29Å; L291-I294 HydrophobicContact CD2-CD1 3.97Å; L291-I294 HydrophobicContact CD2-CG1 3.88Å; L291-I294 HydrophobicContact CG-CG1 4.4Å
292	C	77.6	Confident	74.7	Confident	59 Å²	59	40.5 Å²	40.5	40%	0.399	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-41.7	176.2	-64.5	0	0	0	0	111.9	V283 D285 D290	V283-C292 WeakPolarHBondContact O-CB 3.34Å; V283-C292 PolarHBondContact O-N 2.79Å; D285-C292 VanDerWaalsContact CB-SG 3.54Å; D285-C292 PolarHBondContact N-SG 2.9Å; D285-C292 VanDerWaalsContact N-SG 3.39Å; D290-C292 PolarHBondContact O-N 2.8Å
293	K	79.2	Confident	74.5	Confident	46 Å²	46	40.6 Å²	40.6	20%	0.2	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	144.7	-165.8	-171.8	176.2	178	-174.3	0	111.5	V283 F344 A345 T346	V283-K293 HydrophobicContact CB-CB 4.12Å; V283-K293 HydrophobicContact CG2-CB 4.39Å; V283-K293 PolarHBondContact N-O 2.96Å; V283-K293 PolarHBondContact O-N 2.83Å; K293-F344 PolarHBondContact NZ-O 3.31Å; K293-A345 VanDerWaalsContact NZ-C 3.31Å; K293-A345 PolarHBondContact NZ-O 2.86Å; K293-T346 PolarHBondContact NZ-O 2.99Å
294	I	82.9	Confident	74.2	Confident	20 Å²	20	43 Å²	43	10%	0.103	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131	167	-56.5	155.9	0	0	0	106.1	L246 N251 Y253 P280 Q282 L291	L246-I294 HydrophobicContact CD2-CD1 4.31Å; N251-I294 VanDerWaalsContact ND2-CG2 3.32Å; N251-I294 WeakPolarHBondContact ND2-CG2 3.4Å; Y253-I294 WeakPolarHBondContact OH-CD1 3.3Å; P280-I294 HydrophobicContact CB-CG2 4.3Å; P280-I294 HydrophobicContact CG-CG2 3.59Å; Q282-I294 HydrophobicContact CG-CG1 4.35Å; L291-I294 HydrophobicContact CD1-CG1 4.29Å; L291-I294 HydrophobicContact CD2-CD1 3.97Å; L291-I294 HydrophobicContact CD2-CG1 3.88Å; L291-I294 HydrophobicContact CG-CG1 4.4Å
295	M	83.2	Confident	74.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.222	C	C	.	.			trans	-67.9	148.3	179.1	-58.9	-60.6	-73.6	0	0	110.6	P280 P281 V283 L314 W342	P280-M295 WeakPolarHBondContact CB-O 3.5Å; P281-M295 HydrophobicContact CB-CB 4.39Å; P281-M295 HydrophobicContact CB-CG 3.88Å; P281-M295 HydrophobicContact CG-CB 4.47Å; P281-M295 HydrophobicContact CG-CG 4.35Å; P281-M295 WeakPolarHBondContact O-CG 3.26Å; P281-M295 PolarHBondContact O-N 2.52Å; V283-M295 HydrophobicContact CG2-SD 4.21Å; M295-L314 HydrophobicContact CE-CD2 4.1Å; M295-L314 HydrophobicContact CG-CD2 4.07Å; M295-W342 HydrophobicContact CE-CB 3.21Å; M295-W342 HydrophobicContact CE-CG 3.61Å
296	D	77.5	Confident	74.7	Confident	37 Å²	37	42.3 Å²	42.3	20%	0.198	23%	0.225	C	C	.	.	S	Bend	trans	-77.7	132.7	-177.5	-63.2	7.9	0	0	0	109.4	R249 W342 G347	R249-D296 IonicContact CZ-OD1 3.49Å; R249-D296 IonicContact CZ-OD2 3.59Å; R249-D296 VanDerWaalsContact NH1-CG 3.33Å; R249-D296 IonicContact NH1-OD1 2.61Å; R249-D296 PolarHBondContact NH1-OD1 3.44Å; R249-D296 IonicContact NH1-OD2 3.43Å; R249-D296 PolarHBondContact NH1-OD2 2.83Å; R249-D296 IonicContact NH2-OD1 3.6Å; R249-D296 IonicContact NH2-OD2 2.92Å; R249-D296 PolarHBondContact NH2-OD2 2.85Å; D296-W342 PolarHBondContact O-NE1 2.88Å; D296-G347 WeakPolarHBondContact CB-O 3.45Å; D296-G347 PolarHBondContact N-O 3.32Å
297	G	67.7	Low	75.1	Confident	19 Å²	19	42.9 Å²	42.9	20%	0.196	23%	0.228	C	C	.	.			trans	154.9	150.5	178.1	0	0	0	0	0	111.6	E299	G297-E299 PolarHBondContact O-N 3.27Å
298	Q	63.4	Low	75.5	Confident	183 Å²	183	37.7 Å²	37.7	86%	0.855	20%	0.204	S	C	*	.			trans	-94.5	32.2	170.7	-67.6	-172.3	-19.8	0	0	111.2
299	E	66	Low	76	Confident	23 Å²	23	37 Å²	37	11%	0.107	20%	0.198	C	C	.	.			trans	-92.5	128	-168.7	-72.2	-173.5	175.1	0	0	111.5	G279 G297 V318 Q340 W342 Q349	G279-E299 CarbonylContact C-O 3.38Å; G297-E299 PolarHBondContact O-N 3.27Å; E299-V318 HydrophobicContact CB-CG1 3.63Å; E299-V318 HydrophobicContact CB-CG2 4.5Å; E299-V318 HydrophobicContact CG-CG1 3.92Å; E299-V318 WeakPolarHBondContact OE2-CG2 3.4Å; E299-Q340 WeakPolarHBondContact OE1-CG 3.28Å; E299-Q340 WeakPolarHBondContact OE2-CG 3.49Å; E299-W342 WeakPolarHBondContact OE2-CH2 3.48Å; E299-W342 WeakPolarHBondContact OE2-CZ2 3.43Å; E299-Q349 PolarHBondContact OE1-NE2 2.87Å
300	F	63.1	Low	76.5	Confident	62 Å²	62	41.6 Å²	41.6	27%	0.272	22%	0.221	S	C	.	.			trans	-96	149.8	173.3	-62.4	-74.1	0	0	0	109.8	V252 V318 L319	V252-F300 HydrophobicContact CB-CZ 4.12Å; V252-F300 HydrophobicContact CG1-CE1 4.4Å; V252-F300 HydrophobicContact CG1-CZ 3.97Å; F300-V318 VanDerWaalsContact O-CG1 3.28Å; F300-V318 WeakPolarHBondContact O-CG1 3.43Å; F300-L319 PolarHBondContact O-N 3.5Å; F300-L319 VanDerWaalsContact O-N 3.09Å; F300-L319 VanDerWaalsContact O-O 3.11Å
301	G	65.8	Low	76.9	Confident	3 Å²	3	38 Å²	38	3%	0.031	20%	0.202	C	C	.	.			trans	78.4	34.5	169.3	0	0	0	0	0	117.2	S276 G277 T303 Q317 L319	S276-G301 CarbonylContact O-C 3.51Å; G277-G301 VanDerWaalsContact O-CA 3.22Å; G277-G301 WeakPolarHBondContact O-CA 3.19Å; G277-G301 PolarHBondContact O-N 3.29Å; G301-T303 PolarHBondContact O-N 3.21Å; G301-Q317 VanDerWaalsContact O-O 3.11Å; G301-L319 PolarHBondContact O-N 3.41Å
302	C	71.6	Confident	77.4	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.			trans	-67.7	112.9	175.7	-70.1	0	0	0	0	111.5	G275 S276 P281 Q317	G275-C302 CarbonylContact C-O 3.52Å; G275-C302 VanDerWaalsContact CA-O 3.28Å; G275-C302 WeakPolarHBondContact CA-O 3.5Å; S276-C302 CarbonylContact C-O 3.53Å; S276-C302 PolarHBondContact N-O 2.95Å; S276-C302 VanDerWaalsContact N-O 3.08Å; S276-C302 PolarHBondContact O-N 2.88Å; P281-C302 VanDerWaalsContact CD-SG 3.55Å; P281-C302 HydrophobicContact CG-CB 3.98Å; C302-Q317 CarbonylContact C-O 3.6Å; C302-Q317 WeakPolarHBondContact CA-O 3.44Å
303	T	77.6	Confident	77.8	Confident	19 Å²	19	35.1 Å²	35.1	12%	0.117	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	163.8	-177.1	55.6	0	0	0	0	109.9	D261 G301 Q317 K337	D261-T303 HydrophobicContact CB-CG2 4.01Å; G301-T303 PolarHBondContact O-N 3.21Å; T303-Q317 PolarHBondContact N-O 2.76Å; T303-Q317 WeakPolarHBondContact O-CA 3.26Å; T303-Q317 WeakPolarHBondContact O-CB 3.15Å; T303-Q317 PolarHBondContact O-N 2.77Å; T303-Q317 VanDerWaalsContact O-O 3.12Å; T303-Q317 PolarHBondContact OG1-O 2.98Å; T303-K337 WeakPolarHBondContact OG1-CD 3.43Å; T303-K337 WeakPolarHBondContact OG1-CE 3.27Å; T303-K337 PolarHBondContact OG1-NZ 2.85Å
304	D	78.2	Confident	78.3	Confident	56 Å²	56	32.9 Å²	32.9	30%	0.299	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	50.8	59.6	-178.7	-154.3	25.7	0	0	0	113.7	C262 H306 Q317 T361	C262-D304 PolarHBondContact SG-N 3.21Å; C262-D304 VanDerWaalsContact SG-N 3.44Å; D304-H306 PolarHBondContact O-CD2 2.77Å; D304-H306 VanDerWaalsContact O-CD2 3.27Å; D304-H306 IonicContact OD1-NE2 3.19Å; D304-H306 PolarHBondContact OD1-NE2 3.37Å; D304-H306 IonicContact OD2-NE2 3.22Å; D304-Q317 HydrophobicContact CB-CG 4.04Å; D304-Q317 PolarHBondContact OD2-NE2 2.82Å; D304-T361 PolarHBondContact OD2-N 3.2Å; D304-T361 PolarHBondContact OD2-OG1 3.27Å
305	L	86.1	Confident	78.5	Confident	7 Å²	7	32 Å²	32	4%	0.037	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	146.1	179.1	-71.1	173.8	0	0	0	112.4	C262 V264 V273 G275 P281 L314 V315 A316	C262-L305 VanDerWaalsContact SG-CG 3.55Å; V264-L305 VanDerWaalsContact CG2-C 3.49Å; V264-L305 HydrophobicContact CG2-CB 3.63Å; V264-L305 WeakPolarHBondContact CG2-O 3.24Å; V273-L305 HydrophobicContact CB-CD1 4.45Å; V273-L305 HydrophobicContact CG1-CD1 3.87Å; G275-L305 VanDerWaalsContact CA-CD1 3.49Å; P281-L305 HydrophobicContact CB-CD1 4.44Å; P281-L305 HydrophobicContact CB-CD2 4.17Å; P281-L305 HydrophobicContact CG-CD2 3.98Å; L305-L314 HydrophobicContact CD2-CD1 4.05Å; L305-L314 HydrophobicContact CD2-CD2 4.25Å; L305-L314 HydrophobicContact CD2-CG 4.24Å; L305-V315 WeakPolarHBondContact CA-O 3.48Å; L305-A316 HydrophobicContact CD2-CB 3.39Å
306	H	87.6	Confident	78.8	Confident	39 Å²	39	32 Å²	32	18%	0.181	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	129.8	-172.3	-83.7	-55.4	0	0	0	109.5	D304 V315 T361 I363	D304-H306 PolarHBondContact O-CD2 2.77Å; D304-H306 VanDerWaalsContact O-CD2 3.27Å; D304-H306 IonicContact OD1-NE2 3.19Å; D304-H306 PolarHBondContact OD1-NE2 3.37Å; D304-H306 IonicContact OD2-NE2 3.22Å; H306-V315 HydrophobicContact CB-CB 3.88Å; H306-V315 PolarHBondContact N-O 3.17Å; H306-V315 PolarHBondContact O-N 2.92Å; H306-T361 PolarHBondContact CD2-OG1 2.71Å; H306-T361 VanDerWaalsContact CD2-OG1 3.29Å; H306-T361 PolarHBondContact NE2-O 3.43Å; H306-T361 PolarHBondContact NE2-OG1 3.21Å; H306-I363 HydrophobicContact CB-CD1 3.37Å; H306-I363 HydrophobicContact CB-CG1 3.82Å
307	L	85.2	Confident	79.1	Confident	17 Å²	17	30.3 Å²	30.3	9%	0.089	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.7	174.8	-75	172.8	0	0	0	109.6	V264 T266 V273 L314 F344 I363	V264-L307 HydrophobicContact CG1-CB 4.27Å; V264-L307 HydrophobicContact CG1-CD1 3.75Å; V264-L307 HydrophobicContact CG1-CG 3.91Å; T266-L307 HydrophobicContact CG2-CD1 3.62Å; V273-L307 HydrophobicContact CG2-CD1 4.22Å; L307-L314 HydrophobicContact CD2-CB 4.22Å; L307-L314 HydrophobicContact CD2-CD1 3.62Å; L307-L314 HydrophobicContact CG-CD1 4.16Å; L307-F344 HydrophobicContact CD2-CD2 3.93Å; L307-F344 HydrophobicContact CD2-CE2 4.22Å; L307-F344 HydrophobicContact CD2-CG 4.26Å; L307-I363 VanDerWaalsContact O-CD1 3.26Å; L307-I363 WeakPolarHBondContact O-CD1 3.27Å
308	A	83.7	Confident	79.7	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	172.3	-176.7	0	0	0	0	0	111.9	D310 D311 S312 V313 V315 I363 L387	A308-D310 VanDerWaalsContact C-N 3.34Å; A308-D310 PolarHBondContact O-N 3.19Å; A308-D311 PolarHBondContact O-N 3.4Å; A308-S312 PolarHBondContact O-N 2.77Å; A308-S312 VanDerWaalsContact O-N 3.15Å; A308-V313 PolarHBondContact N-O 2.95Å; A308-V313 PolarHBondContact O-N 2.81Å; A308-V315 HydrophobicContact CB-CG2 4.48Å; A308-I363 HydrophobicContact CB-CD1 3.9Å; A308-I363 HydrophobicContact CB-CG1 4.45Å; A308-I363 HydrophobicContact CB-CG2 4.13Å; A308-L387 HydrophobicContact CB-CD1 3.2Å
309	C	81.7	Confident	80.1	Confident	33 Å²	33	24.1 Å²	24.1	22%	0.223	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	50.9	-178.8	-55.1	0	0	0	0	113.2	D311 S312 V313 S367	C309-D311 PolarHBondContact O-N 3Å; C309-S312 VanDerWaalsContact CB-OG 3.23Å; C309-S312 WeakPolarHBondContact CB-OG 3.48Å; C309-S312 WeakPolarHBondContact O-CB 3.3Å; C309-S312 PolarHBondContact O-N 2.77Å; C309-S312 PolarHBondContact O-OG 3.44Å; C309-S312 VanDerWaalsContact O-OG 3.05Å; C309-V313 HydrophobicContact CB-CG2 4.37Å; C309-S367 PolarHBondContact N-O 2.93Å; C309-S367 PolarHBondContact SG-O 3.07Å
310	D	80.3	Confident	79.7	Confident	105 Å²	105	24.3 Å²	24.3	56%	0.561	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	48.8	-177	-63.9	-30.3	0	0	0	114.7	K267 A308 S312	K267-D310 IonicContact NZ-OD1 3.09Å; K267-D310 PolarHBondContact NZ-OD1 3.03Å; A308-D310 VanDerWaalsContact C-N 3.34Å; A308-D310 PolarHBondContact O-N 3.19Å; D310-S312 PolarHBondContact O-N 2.88Å
311	D	82.3	Confident	78.9	Confident	15 Å²	15	27 Å²	27	8%	0.08	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	16	-179.4	-50	-36.8	0	0	0	113.9	T266 K267 A308 C309 F344	T266-D311 WeakPolarHBondContact CB-OD2 3.42Å; T266-D311 HydrophobicContact CG2-CB 4.38Å; K267-D311 WeakPolarHBondContact CB-OD2 3.42Å; K267-D311 VanDerWaalsContact N-CG 3.35Å; K267-D311 PolarHBondContact N-OD1 2.9Å; K267-D311 VanDerWaalsContact N-OD1 3.09Å; K267-D311 PolarHBondContact N-OD2 3.32Å; A308-D311 PolarHBondContact O-N 3.4Å; C309-D311 PolarHBondContact O-N 3Å; D311-F344 VanDerWaalsContact O-CB 3.23Å; D311-F344 WeakPolarHBondContact O-CB 3.41Å; D311-F344 WeakPolarHBondContact O-CD1 3.45Å; D311-F344 WeakPolarHBondContact O-CG 3.4Å
312	S	84.6	Confident	77.8	Confident	35 Å²	35	32.9 Å²	32.9	25%	0.245	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-31.6	177.8	80.2	0	0	0	0	113.1	A308 C309 D310 F344	A308-S312 PolarHBondContact O-N 2.77Å; A308-S312 VanDerWaalsContact O-N 3.15Å; C309-S312 VanDerWaalsContact CB-OG 3.23Å; C309-S312 WeakPolarHBondContact CB-OG 3.48Å; C309-S312 WeakPolarHBondContact O-CB 3.3Å; C309-S312 PolarHBondContact O-N 2.77Å; C309-S312 PolarHBondContact O-OG 3.44Å; C309-S312 VanDerWaalsContact O-OG 3.05Å; D310-S312 PolarHBondContact O-N 2.88Å; S312-F344 WeakPolarHBondContact O-CB 3.22Å; S312-F344 PolarHBondContact O-N 2.82Å
313	V	87.3	Confident	76.2	Confident	18 Å²	18	37.3 Å²	37.3	11%	0.109	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.3	-179.2	-175.6	0	0	0	0	109.7	A308 C309 V315 L341 W342 L350 L387	A308-V313 PolarHBondContact N-O 2.95Å; A308-V313 PolarHBondContact O-N 2.81Å; C309-V313 HydrophobicContact CB-CG2 4.37Å; V313-V315 HydrophobicContact CG1-CG2 4.42Å; V313-L341 HydrophobicContact CG1-CB 4.47Å; V313-L341 HydrophobicContact CG1-CD2 4.21Å; V313-W342 WeakPolarHBondContact CA-O 3.49Å; V313-L350 HydrophobicContact CG1-CD1 4.22Å; V313-L387 HydrophobicContact CG1-CD2 4.21Å
314	L	88.1	Confident	74.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	127.2	169.2	-178.6	71.4	0	0	0	108.9	V273 P281 M295 L305 L307 L341 W342 F344	V273-L314 HydrophobicContact CG1-CD1 4.02Å; V273-L314 HydrophobicContact CG1-CD2 4.06Å; P281-L314 HydrophobicContact CB-CD2 3.82Å; P281-L314 HydrophobicContact CG-CD2 3.99Å; M295-L314 HydrophobicContact CE-CD2 4.1Å; M295-L314 HydrophobicContact CG-CD2 4.07Å; L305-L314 HydrophobicContact CD2-CD1 4.05Å; L305-L314 HydrophobicContact CD2-CD2 4.25Å; L305-L314 HydrophobicContact CD2-CG 4.24Å; L307-L314 HydrophobicContact CD2-CB 4.22Å; L307-L314 HydrophobicContact CD2-CD1 3.62Å; L307-L314 HydrophobicContact CG-CD1 4.16Å; L314-L341 CarbonylContact O-C 3.58Å; L314-L341 WeakPolarHBondContact O-CA 3.37Å; L314-W342 HydrophobicContact CB-CB 4.28Å; L314-W342 HydrophobicContact CD2-CE3 4.46Å; L314-W342 PolarHBondContact N-O 2.71Å; L314-W342 PolarHBondContact O-N 2.89Å; L314-F344 HydrophobicContact CB-CD2 4.47Å
315	V	88.6	Confident	72.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	131.2	175.8	-172.7	0	0	0	0	107.4	L305 H306 A308 V313 L339 L341 V370 L387	L305-V315 WeakPolarHBondContact CA-O 3.48Å; H306-V315 HydrophobicContact CB-CB 3.88Å; H306-V315 PolarHBondContact N-O 3.17Å; H306-V315 PolarHBondContact O-N 2.92Å; A308-V315 HydrophobicContact CB-CG2 4.48Å; V313-V315 HydrophobicContact CG1-CG2 4.42Å; V315-L339 HydrophobicContact CG1-CD1 3.68Å; V315-L341 HydrophobicContact CB-CD2 3.94Å; V315-L341 HydrophobicContact CG1-CD2 3.8Å; V315-L341 HydrophobicContact CG2-CD2 3.59Å; V315-V370 HydrophobicContact CG1-CG1 4.29Å; V315-V370 HydrophobicContact CG1-CG2 4.43Å; V315-V370 HydrophobicContact CG2-CG2 3.94Å; V315-L387 HydrophobicContact CG2-CD2 4.11Å
316	A	87.8	Confident	69.6	Low	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	156.8	174.1	0	0	0	0	0	111.4	L305 Q340 W342	L305-A316 HydrophobicContact CD2-CB 3.39Å; A316-Q340 PolarHBondContact N-O 3.15Å; A316-Q340 PolarHBondContact O-N 2.93Å; A316-W342 HydrophobicContact CB-CE3 4.42Å; A316-W342 HydrophobicContact CB-CH2 3.93Å; A316-W342 HydrophobicContact CB-CZ3 3.42Å; A316-W342 VanDerWaalsContact CB-CZ3 3.42Å
317	Q	84.3	Confident	67.1	Low	3 Å²	3	53.8 Å²	53.8	1%	0.014	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.1	162.9	-58.7	175.1	8	0	0	109.6	G301 C302 T303 D304 K337 R338 A360 T361	G301-Q317 VanDerWaalsContact O-O 3.11Å; C302-Q317 CarbonylContact C-O 3.6Å; C302-Q317 WeakPolarHBondContact CA-O 3.44Å; T303-Q317 PolarHBondContact N-O 2.76Å; T303-Q317 WeakPolarHBondContact O-CA 3.26Å; T303-Q317 WeakPolarHBondContact O-CB 3.15Å; T303-Q317 PolarHBondContact O-N 2.77Å; T303-Q317 VanDerWaalsContact O-O 3.12Å; T303-Q317 PolarHBondContact OG1-O 2.98Å; D304-Q317 HydrophobicContact CB-CG 4.04Å; D304-Q317 PolarHBondContact OD2-NE2 2.82Å; Q317-K337 HydrophobicContact CB-CB 3.86Å; Q317-K337 HydrophobicContact CB-CD 3.69Å; Q317-K337 HydrophobicContact CB-CG 4.47Å; Q317-R338 CarbonylContact C-O 3.58Å; Q317-R338 WeakPolarHBondContact CA-O 3.29Å; Q317-A360 VanDerWaalsContact NE2-C 3.28Å; Q317-A360 VanDerWaalsContact NE2-CA 3.28Å; Q317-T361 HydrophobicContact CG-CG2 4.16Å; Q317-T361 VanDerWaalsContact NE2-N 3.12Å; Q317-T361 PolarHBondContact NE2-OG1 3.4Å
318	V	80.3	Confident	64.7	Low	5 Å²	5	60.5 Å²	60.5	3%	0.03	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.2	-174.3	179.4	0	0	0	0	108.5	E299 F300 D320 K337 R338 Q340 W342	E299-V318 HydrophobicContact CB-CG1 3.63Å; E299-V318 HydrophobicContact CB-CG2 4.5Å; E299-V318 HydrophobicContact CG-CG1 3.92Å; E299-V318 WeakPolarHBondContact OE2-CG2 3.4Å; F300-V318 VanDerWaalsContact O-CG1 3.28Å; F300-V318 WeakPolarHBondContact O-CG1 3.43Å; V318-D320 PolarHBondContact O-N 3.06Å; V318-K337 CarbonylContact O-C 3.57Å; V318-K337 WeakPolarHBondContact O-CA 3.33Å; V318-K337 VanDerWaalsContact O-CB 3.27Å; V318-K337 WeakPolarHBondContact O-CB 3.25Å; V318-R338 HydrophobicContact CB-CB 4.49Å; V318-R338 PolarHBondContact N-O 2.88Å; V318-R338 PolarHBondContact O-N 2.83Å; V318-Q340 HydrophobicContact CG2-CB 3.62Å; V318-W342 HydrophobicContact CG2-CH2 3.76Å
319	L	71.3	Confident	62.3	Low	67 Å²	67	67.3 Å²	67.3	35%	0.351	39%	0.385	S	S	.	.			trans	-74.8	125.1	173.7	-171.7	68.6	0	0	0	108.1	F300 G301 K337	F300-L319 PolarHBondContact O-N 3.5Å; F300-L319 VanDerWaalsContact O-N 3.09Å; F300-L319 VanDerWaalsContact O-O 3.11Å; G301-L319 PolarHBondContact O-N 3.41Å; L319-K337 HydrophobicContact CD1-CG 4.5Å
320	D	58	Low	59.9	Low	26 Å²	26	73.7 Å²	73.7	14%	0.139	41%	0.412	C	S	.	.			trans	-88.3	121.2	169.7	-151.7	-24	0	0	0	108.5	V318 I322 R338	V318-D320 PolarHBondContact O-N 3.06Å; D320-I322 PolarHBondContact O-N 3.22Å; D320-I322 WeakPolarHBondContact OD1-CG1 3.41Å; D320-I322 PolarHBondContact OD1-N 3.02Å; D320-R338 IonicContact OD2-CZ 3.47Å; D320-R338 VanDerWaalsContact OD2-CZ 3.31Å; D320-R338 IonicContact OD2-NE 2.65Å; D320-R338 PolarHBondContact OD2-NE 3.27Å; D320-R338 IonicContact OD2-NH2 3.01Å; D320-R338 PolarHBondContact OD2-NH2 3.2Å
321	D	47	Very low	57.8	Low	118 Å²	118	75 Å²	75	63%	0.631	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-62.9	-8.7	176.2	-79.3	-26.3	0	0	0	112.1
322	I	42.2	Very low	56	Low	128 Å²	128	77.9 Å²	77.9	66%	0.656	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-91.8	-17.5	-164	-61.8	174.9	0	0	0	114.7	D320 G324	D320-I322 PolarHBondContact O-N 3.22Å; D320-I322 WeakPolarHBondContact OD1-CG1 3.41Å; D320-I322 PolarHBondContact OD1-N 3.02Å; I322-G324 VanDerWaalsContact C-N 3.3Å; I322-G324 PolarHBondContact O-N 3.49Å
323	T	39.2	Very low	54.4	Low	93 Å²	93	83.4 Å²	83.4	57%	0.571	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-90.8	23.5	-177.2	60.6	0	0	0	0	115.3	M357	T323-M357 HydrophobicContact CG2-CE 4.46Å
324	G	36.3	Very low	52.9	Low	67 Å²	67	84.3 Å²	84.3	69%	0.691	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-101.2	-8.3	175.4	0	0	0	0	0	116.2	I322	I322-G324 VanDerWaalsContact C-N 3.3Å; I322-G324 PolarHBondContact O-N 3.49Å
325	L	33.2	Very low	51.8	Low	146 Å²	146	92.6 Å²	92.6	76%	0.764	50%	0.504	S	S	*	.	S	Bend	trans	-95.9	-18	-168	-160.1	60	0	0	0	116.2
326	D	33.3	Very low	51.1	Low	160 Å²	160	93.9 Å²	93.9	86%	0.856	51%	0.512	S	S	*	.	S	Bend	trans	-113	6.5	-171.8	-88.4	-8.8	0	0	0	116.9
327	T	34	Very low	50.9	Low	94 Å²	94	95.7 Å²	95.7	58%	0.577	52%	0.52	S	S	*	.			trans	-116.8	75	167.7	57	0	0	0	0	110.8	N329	T327-N329 PolarHBondContact O-N 2.95Å
328	L	35.8	Very low	51	Low	157 Å²	157	98.9 Å²	98.9	82%	0.822	53%	0.532	S	S	*	.			trans	-61.8	8.7	173.9	-99.8	158.6	0	0	0	115.3
329	N	34	Very low	51.3	Low	143 Å²	143	98.7 Å²	98.7	77%	0.765	53%	0.531	S	S	*	.	S	Bend	trans	-148.3	119.1	-180	-70.5	-52	0	0	0	109.2	T327	T327-N329 PolarHBondContact O-N 2.95Å
330	E	31.3	Very low	52.1	Low	168 Å²	168	95.9 Å²	95.9	79%	0.785	52%	0.516	S	S	*	.			trans	77.8	111.8	-176.7	-60.9	-177.3	164.9	0	0	116	S332	E330-S332 PolarHBondContact O-N 3.25Å
331	P	35.6	Very low	53.7	Low	132 Å²	132	94.7 Å²	94.7	86%	0.857	51%	0.509	S	S	*	.			trans	-72.3	83	168.1	32.4	-31	0	0	0	107.5	E333	P331-E333 PolarHBondContact O-N 2.8Å
332	S	43.8	Very low	55.6	Low	76 Å²	76	89.1 Å²	89.1	53%	0.531	48%	0.479	S	S	.	.			trans	-64.4	109.3	165.3	44.9	0	0	0	0	106.7	E330 I334	E330-S332 PolarHBondContact O-N 3.25Å; S332-I334 PolarHBondContact O-N 3.38Å
333	E	50.3	Low	57.7	Low	151 Å²	151	85 Å²	85	71%	0.706	46%	0.459	S	S	*	.			trans	-68.6	25.2	-174.6	-152.4	-174.1	170	0	0	113.2	P331 R335	P331-E333 PolarHBondContact O-N 2.8Å; E333-R335 PolarHBondContact O-N 2.99Å
334	I	57.3	Low	60	Low	36 Å²	36	81.3 Å²	81.3	19%	0.185	44%	0.435	C	S	.	.			trans	-84	95.2	179.9	-51.5	168.8	0	0	0	107.3	S332 V336 L405 K406	S332-I334 PolarHBondContact O-N 3.38Å; I334-V336 VanDerWaalsContact C-N 3.29Å; I334-V336 HydrophobicContact CG2-CG2 3.68Å; I334-V336 PolarHBondContact O-N 3.18Å; I334-L405 WeakPolarHBondContact CD1-O 3.33Å; I334-K406 HydrophobicContact CD1-CB 4.43Å
335	R	65.1	Low	62.2	Low	175 Å²	175	79.9 Å²	79.9	66%	0.66	42%	0.417	S	S	*	.			trans	-76.8	81.5	172.2	-76.8	-175.2	-91.9	-166	-9.3	110	E333	E333-R335 PolarHBondContact O-N 2.99Å
336	V	73.2	Confident	64.5	Low	26 Å²	26	76.5 Å²	76.5	16%	0.158	40%	0.402	C	S	.	.			trans	-72.4	140.6	168.5	-167	0	0	0	0	108.9	I334 M357 V375	I334-V336 VanDerWaalsContact C-N 3.29Å; I334-V336 HydrophobicContact CG2-CG2 3.68Å; I334-V336 PolarHBondContact O-N 3.18Å; V336-M357 HydrophobicContact CB-CE 4.17Å; V336-M357 HydrophobicContact CG1-CB 3.69Å; V336-M357 HydrophobicContact CG1-CE 3.65Å; V336-M357 HydrophobicContact CG1-CG 4.47Å; V336-V375 HydrophobicContact CG1-CB 4.31Å
337	K	83.8	Confident	66.9	Low	38 Å²	38	68.9 Å²	68.9	17%	0.165	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	154.8	-177.3	-64.9	-179.4	-158.5	150.1	0	110.9	T303 Q317 V318 L319 M357 C358	T303-K337 WeakPolarHBondContact OG1-CD 3.43Å; T303-K337 WeakPolarHBondContact OG1-CE 3.27Å; T303-K337 PolarHBondContact OG1-NZ 2.85Å; Q317-K337 HydrophobicContact CB-CB 3.86Å; Q317-K337 HydrophobicContact CB-CD 3.69Å; Q317-K337 HydrophobicContact CB-CG 4.47Å; V318-K337 CarbonylContact O-C 3.57Å; V318-K337 WeakPolarHBondContact O-CA 3.33Å; V318-K337 VanDerWaalsContact O-CB 3.27Å; V318-K337 WeakPolarHBondContact O-CB 3.25Å; L319-K337 HydrophobicContact CD1-CG 4.5Å; K337-M357 CarbonylContact O-C 3.56Å; K337-M357 WeakPolarHBondContact O-CA 3.24Å; K337-C358 PolarHBondContact N-O 3.03Å; K337-C358 PolarHBondContact O-N 3.02Å; K337-C358 PolarHBondContact O-SG 3.13Å; K337-C358 VanDerWaalsContact O-SG 3.32Å
338	R	85.4	Confident	69.3	Low	70 Å²	70	72.7 Å²	72.7	26%	0.264	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	134.3	175.7	-177.3	-172.2	-65.8	-136.6	-1.1	110	Q317 V318 D320 E355 I356 M357	Q317-R338 CarbonylContact C-O 3.58Å; Q317-R338 WeakPolarHBondContact CA-O 3.29Å; V318-R338 HydrophobicContact CB-CB 4.49Å; V318-R338 PolarHBondContact N-O 2.88Å; V318-R338 PolarHBondContact O-N 2.83Å; D320-R338 IonicContact OD2-CZ 3.47Å; D320-R338 VanDerWaalsContact OD2-CZ 3.31Å; D320-R338 IonicContact OD2-NE 2.65Å; D320-R338 PolarHBondContact OD2-NE 3.27Å; D320-R338 IonicContact OD2-NH2 3.01Å; D320-R338 PolarHBondContact OD2-NH2 3.2Å; R338-E355 HydrophobicContact CG-CG 4.15Å; R338-E355 IonicContact CZ-OE1 3.82Å; R338-E355 IonicContact CZ-OE2 2.73Å; R338-E355 IonicContact NE-OE1 2.68Å; R338-E355 PolarHBondContact NE-OE1 3.14Å; R338-E355 IonicContact NH1-OE1 3.31Å; R338-E355 IonicContact NH1-OE2 3.75Å; R338-E355 IonicContact NH2-OE1 3.98Å; R338-E355 PolarHBondContact NH2-OE1 3.14Å; R338-E355 IonicContact NH2-OE2 3.51Å; R338-E355 PolarHBondContact NH2-OE2 3.22Å; R338-I356 CarbonylContact C-O 3.53Å; R338-I356 WeakPolarHBondContact CA-O 3Å; R338-M357 HydrophobicContact CB-SD 4.31Å
339	L	88	Confident	71.6	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	130.5	168.7	-172.7	81	0	0	0	109.7	V315 M352 I356 T361 I372	V315-L339 HydrophobicContact CG1-CD1 3.68Å; L339-M352 HydrophobicContact CD2-CE 3.97Å; L339-I356 HydrophobicContact CB-CB 4.04Å; L339-I356 HydrophobicContact CB-CG2 4.3Å; L339-I356 HydrophobicContact CD2-CD1 3.95Å; L339-I356 PolarHBondContact N-O 3.31Å; L339-T361 HydrophobicContact CD1-CG2 3.77Å; L339-I372 HydrophobicContact CD1-CD1 4.34Å; L339-I372 HydrophobicContact CD1-CG1 4.46Å; L339-I372 HydrophobicContact CD2-CD1 3.47Å; L339-I372 VanDerWaalsContact CD2-CD1 3.47Å; L339-I372 HydrophobicContact CD2-CG1 4.43Å; L339-I372 HydrophobicContact CG-CD1 4.47Å
340	Q	87.9	Confident	74.1	Confident	7 Å²	7	65.1 Å²	65.1	3%	0.033	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	143.3	172.3	-173.7	56.7	53.4	0	0	111.6	E299 A316 V318 W342 Q349 L350	E299-Q340 WeakPolarHBondContact OE1-CG 3.28Å; E299-Q340 WeakPolarHBondContact OE2-CG 3.49Å; A316-Q340 PolarHBondContact N-O 3.15Å; A316-Q340 PolarHBondContact O-N 2.93Å; V318-Q340 HydrophobicContact CG2-CB 3.62Å; Q340-W342 HydrophobicContact CB-CE3 4.36Å; Q340-W342 HydrophobicContact CB-CH2 3.46Å; Q340-W342 VanDerWaalsContact CB-CH2 3.46Å; Q340-W342 HydrophobicContact CB-CZ2 4.24Å; Q340-W342 HydrophobicContact CB-CZ3 3.51Å; Q340-W342 HydrophobicContact CG-CD2 4.2Å; Q340-W342 HydrophobicContact CG-CE3 3.97Å; Q340-W342 HydrophobicContact CG-CH2 3.31Å; Q340-W342 HydrophobicContact CG-CZ2 3.59Å; Q340-W342 HydrophobicContact CG-CZ3 3.49Å; Q340-W342 VanDerWaalsContact CG-CZ3 3.49Å; Q340-W342 VanDerWaalsContact O-CZ3 3.29Å; Q340-W342 WeakPolarHBondContact O-CZ3 3.26Å; Q340-Q349 VanDerWaalsContact CD-CG 3.48Å; Q340-Q349 HydrophobicContact CG-CG 3.99Å; Q340-L350 PolarHBondContact NE2-O 3.34Å
341	L	90.4	Very high	76.6	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	146.3	176.8	-60.1	-178.3	0	0	0	110.5	V313 L314 V315 L350 M352 L387 N390	V313-L341 HydrophobicContact CG1-CB 4.47Å; V313-L341 HydrophobicContact CG1-CD2 4.21Å; L314-L341 CarbonylContact O-C 3.58Å; L314-L341 WeakPolarHBondContact O-CA 3.37Å; V315-L341 HydrophobicContact CB-CD2 3.94Å; V315-L341 HydrophobicContact CG1-CD2 3.8Å; V315-L341 HydrophobicContact CG2-CD2 3.59Å; L341-L350 HydrophobicContact CB-CB 3.94Å; L341-L350 HydrophobicContact CB-CD1 4.01Å; L341-L350 PolarHBondContact O-N 3.25Å; L341-M352 HydrophobicContact CB-SD 4.02Å; L341-M352 HydrophobicContact CD1-CE 4.21Å; L341-M352 HydrophobicContact CD1-SD 3.5Å; L341-M352 WeakPolarHBondContact CD1-SD 3.43Å; L341-M352 HydrophobicContact CG-CE 4.39Å; L341-M352 HydrophobicContact CG-SD 3.53Å; L341-M352 VanDerWaalsContact CG-SD 3.53Å; L341-L387 HydrophobicContact CD1-CD2 4.02Å; L341-L387 HydrophobicContact CD2-CD2 3.85Å; L341-N390 WeakPolarHBondContact CD1-OD1 3.49Å
342	W	88.2	Confident	79	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.1	169.7	-66	-104.9	0	0	0	110.7	P281 M295 D296 E299 V313 L314 A316 V318 Q340 F344 R348	P281-W342 HydrophobicContact CG-CH2 4.41Å; P281-W342 HydrophobicContact CG-CZ2 4.46Å; M295-W342 HydrophobicContact CE-CB 3.21Å; M295-W342 HydrophobicContact CE-CG 3.61Å; D296-W342 PolarHBondContact O-NE1 2.88Å; E299-W342 WeakPolarHBondContact OE2-CH2 3.48Å; E299-W342 WeakPolarHBondContact OE2-CZ2 3.43Å; V313-W342 WeakPolarHBondContact CA-O 3.49Å; L314-W342 HydrophobicContact CB-CB 4.28Å; L314-W342 HydrophobicContact CD2-CE3 4.46Å; L314-W342 PolarHBondContact N-O 2.71Å; L314-W342 PolarHBondContact O-N 2.89Å; A316-W342 HydrophobicContact CB-CE3 4.42Å; A316-W342 HydrophobicContact CB-CH2 3.93Å; A316-W342 HydrophobicContact CB-CZ3 3.42Å; A316-W342 VanDerWaalsContact CB-CZ3 3.42Å; V318-W342 HydrophobicContact CG2-CH2 3.76Å; Q340-W342 HydrophobicContact CB-CE3 4.36Å; Q340-W342 HydrophobicContact CB-CH2 3.46Å; Q340-W342 VanDerWaalsContact CB-CH2 3.46Å; Q340-W342 HydrophobicContact CB-CZ2 4.24Å; Q340-W342 HydrophobicContact CB-CZ3 3.51Å; Q340-W342 HydrophobicContact CG-CD2 4.2Å; Q340-W342 HydrophobicContact CG-CE3 3.97Å; Q340-W342 HydrophobicContact CG-CH2 3.31Å; Q340-W342 HydrophobicContact CG-CZ2 3.59Å; Q340-W342 HydrophobicContact CG-CZ3 3.49Å; Q340-W342 VanDerWaalsContact CG-CZ3 3.49Å; Q340-W342 VanDerWaalsContact O-CZ3 3.29Å; Q340-W342 WeakPolarHBondContact O-CZ3 3.26Å; W342-F344 PolarHBondContact O-N 3.27Å; W342-R348 WeakPolarHBondContact CA-O 3.49Å
343	D	86.9	Confident	81	Confident	43 Å²	43	61.1 Å²	61.1	23%	0.23	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	114.4	160.9	172	4.9	0	0	0	108.1	A345 T346 G347 R348 L350	D343-A345 VanDerWaalsContact C-N 3.29Å; D343-A345 PolarHBondContact O-N 2.77Å; D343-A345 WeakPolarHBondContact OD1-CB 3.49Å; D343-A345 PolarHBondContact OD1-N 2.79Å; D343-T346 WeakPolarHBondContact CB-OG1 3.48Å; D343-T346 PolarHBondContact OD1-N 2.77Å; D343-T346 WeakPolarHBondContact OD2-CB 3.47Å; D343-T346 WeakPolarHBondContact OD2-CG2 3.45Å; D343-T346 PolarHBondContact OD2-OG1 2.89Å; D343-G347 VanDerWaalsContact O-CA 3.22Å; D343-G347 WeakPolarHBondContact O-CA 3.31Å; D343-G347 PolarHBondContact O-N 3.4Å; D343-R348 PolarHBondContact N-O 3.08Å; D343-L350 HydrophobicContact CB-CD2 4.21Å; D343-L350 HydrophobicContact CB-CG 4.41Å
344	F	86.9	Confident	82.6	Confident	15 Å²	15	58.9 Å²	58.9	7%	0.066	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-35.9	-177.2	-173.7	-109.7	0	0	0	111.9	T266 Y271 V273 V283 K293 L307 D311 S312 L314 W342	T266-F344 HydrophobicContact CG2-CE1 3.99Å; T266-F344 HydrophobicContact CG2-CZ 3.87Å; Y271-F344 HydrophobicContact CD2-CE1 4.21Å; Y271-F344 HydrophobicContact CD2-CZ 4.35Å; V273-F344 HydrophobicContact CG2-CE2 3.53Å; V273-F344 HydrophobicContact CG2-CZ 4.04Å; V283-F344 HydrophobicContact CG1-CE2 4.11Å; V283-F344 HydrophobicContact CG1-CZ 3.84Å; V283-F344 HydrophobicContact CG2-CE2 3.71Å; V283-F344 HydrophobicContact CG2-CZ 4.29Å; K293-F344 PolarHBondContact NZ-O 3.31Å; L307-F344 HydrophobicContact CD2-CD2 3.93Å; L307-F344 HydrophobicContact CD2-CE2 4.22Å; L307-F344 HydrophobicContact CD2-CG 4.26Å; D311-F344 VanDerWaalsContact O-CB 3.23Å; D311-F344 WeakPolarHBondContact O-CB 3.41Å; D311-F344 WeakPolarHBondContact O-CD1 3.45Å; D311-F344 WeakPolarHBondContact O-CG 3.4Å; S312-F344 WeakPolarHBondContact O-CB 3.22Å; S312-F344 PolarHBondContact O-N 2.82Å; L314-F344 HydrophobicContact CB-CD2 4.47Å; W342-F344 PolarHBondContact O-N 3.27Å
345	A	82.2	Confident	83.9	Confident	37 Å²	37	61.9 Å²	61.9	31%	0.306	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-51	-177.4	0	0	0	0	0	111.2	I236 K293 D343	I236-A345 HydrophobicContact CG2-CB 4.3Å; K293-A345 VanDerWaalsContact NZ-C 3.31Å; K293-A345 PolarHBondContact NZ-O 2.86Å; D343-A345 VanDerWaalsContact C-N 3.29Å; D343-A345 PolarHBondContact O-N 2.77Å; D343-A345 WeakPolarHBondContact OD1-CB 3.49Å; D343-A345 PolarHBondContact OD1-N 2.79Å
346	T	82.2	Confident	84.9	Confident	75 Å²	75	53.7 Å²	53.7	46%	0.46	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-27.1	-179.4	63.8	0	0	0	0	113.2	K293 D343 R348	K293-T346 PolarHBondContact NZ-O 2.99Å; D343-T346 WeakPolarHBondContact CB-OG1 3.48Å; D343-T346 PolarHBondContact OD1-N 2.77Å; D343-T346 WeakPolarHBondContact OD2-CB 3.47Å; D343-T346 WeakPolarHBondContact OD2-CG2 3.45Å; D343-T346 PolarHBondContact OD2-OG1 2.89Å; T346-R348 PolarHBondContact OG1-N 2.79Å
347	G	82.6	Confident	85.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.267	C	S	.	.			trans	86.9	-1.2	-178.6	0	0	0	0	0	112.9	D296 D343	D296-G347 WeakPolarHBondContact CB-O 3.45Å; D296-G347 PolarHBondContact N-O 3.32Å; D343-G347 VanDerWaalsContact O-CA 3.22Å; D343-G347 WeakPolarHBondContact O-CA 3.31Å; D343-G347 PolarHBondContact O-N 3.4Å
348	R	85.3	Confident	85.6	Confident	174 Å²	174	52.3 Å²	52.3	66%	0.657	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-78	139.1	-176.7	-66.4	-177.2	176.9	-173.2	-0.3	110.2	W342 D343 T346 L350	W342-R348 WeakPolarHBondContact CA-O 3.49Å; D343-R348 PolarHBondContact N-O 3.08Å; T346-R348 PolarHBondContact OG1-N 2.79Å; R348-L350 PolarHBondContact O-N 2.83Å
349	Q	84.4	Confident	85.6	Confident	81 Å²	81	49.9 Å²	49.9	38%	0.379	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	129.2	167.2	-170.2	173.5	-5.5	0	0	109.4	E299 Q340	E299-Q349 PolarHBondContact OE1-NE2 2.87Å; Q340-Q349 VanDerWaalsContact CD-CG 3.48Å; Q340-Q349 HydrophobicContact CG-CG 3.99Å
350	L	85.2	Confident	85.5	Confident	59 Å²	59	50 Å²	50	31%	0.309	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	132.4	172.5	-68.1	171.7	0	0	0	108.6	V313 Q340 L341 D343 R348 M352	V313-L350 HydrophobicContact CG1-CD1 4.22Å; Q340-L350 PolarHBondContact NE2-O 3.34Å; L341-L350 HydrophobicContact CB-CB 3.94Å; L341-L350 HydrophobicContact CB-CD1 4.01Å; L341-L350 PolarHBondContact O-N 3.25Å; D343-L350 HydrophobicContact CB-CD2 4.21Å; D343-L350 HydrophobicContact CB-CG 4.41Å; R348-L350 PolarHBondContact O-N 2.83Å; L350-M352 PolarHBondContact O-N 2.94Å
351	E	84.3	Confident	85.6	Confident	177 Å²	177	50 Å²	50	83%	0.827	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-68.7	119.2	178.7	-170.1	173.5	-178.4	0	0	109.6	N390	E351-N390 PolarHBondContact O-ND2 3.39Å
352	M	86.1	Confident	85.6	Confident	30 Å²	30	50.5 Å²	50.5	15%	0.148	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-83.1	127	175.1	-66.7	-60.1	-66	0	0	108.6	L339 L341 L350 I354 I356 W385	L339-M352 HydrophobicContact CD2-CE 3.97Å; L341-M352 HydrophobicContact CB-SD 4.02Å; L341-M352 HydrophobicContact CD1-CE 4.21Å; L341-M352 HydrophobicContact CD1-SD 3.5Å; L341-M352 WeakPolarHBondContact CD1-SD 3.43Å; L341-M352 HydrophobicContact CG-CE 4.39Å; L341-M352 HydrophobicContact CG-SD 3.53Å; L341-M352 VanDerWaalsContact CG-SD 3.53Å; L350-M352 PolarHBondContact O-N 2.94Å; M352-I354 PolarHBondContact O-N 3.27Å; M352-I356 HydrophobicContact CE-CD1 3.73Å; M352-W385 HydrophobicContact CE-CH2 4.13Å; M352-W385 HydrophobicContact CE-CZ2 3.57Å
353	P	85	Confident	85.7	Confident	85 Å²	85	51.8 Å²	51.8	55%	0.552	26%	0.264	S	S	*	.	S	Bend	trans	-68.6	-23.1	-178.5	29.4	-36.4	0	0	0	112.3	W385	P353-W385 HydrophobicContact CG-CH2 3.74Å; P353-W385 HydrophobicContact CG-CZ2 4.01Å
354	I	85.2	Confident	85.7	Confident	105 Å²	105	50 Å²	50	54%	0.538	25%	0.254	S	S	.	.	S	Bend	trans	-141.4	141.8	179.3	-55.4	174.5	0	0	0	107.5	M352 I356	M352-I354 PolarHBondContact O-N 3.27Å; I354-I356 PolarHBondContact O-N 3.3Å
355	E	83.6	Confident	85.6	Confident	99 Å²	99	55.7 Å²	55.7	46%	0.463	28%	0.276	S	S	.	.			trans	-74.2	120.9	172	-171.4	176.5	171.2	0	0	110.6	R338	R338-E355 HydrophobicContact CG-CG 4.15Å; R338-E355 IonicContact CZ-OE1 3.82Å; R338-E355 IonicContact CZ-OE2 2.73Å; R338-E355 IonicContact NE-OE1 2.68Å; R338-E355 PolarHBondContact NE-OE1 3.14Å; R338-E355 IonicContact NH1-OE1 3.31Å; R338-E355 IonicContact NH1-OE2 3.75Å; R338-E355 IonicContact NH2-OE1 3.98Å; R338-E355 PolarHBondContact NH2-OE1 3.14Å; R338-E355 IonicContact NH2-OE2 3.51Å; R338-E355 PolarHBondContact NH2-OE2 3.22Å
356	I	85.9	Confident	85.6	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.015	28%	0.28	C	S	.	.			trans	-111.2	116.2	-176.8	-59.1	163.1	0	0	0	108.8	R338 L339 M352 I354 I372 Q374 L383 W385	R338-I356 CarbonylContact C-O 3.53Å; R338-I356 WeakPolarHBondContact CA-O 3Å; L339-I356 HydrophobicContact CB-CB 4.04Å; L339-I356 HydrophobicContact CB-CG2 4.3Å; L339-I356 HydrophobicContact CD2-CD1 3.95Å; L339-I356 PolarHBondContact N-O 3.31Å; M352-I356 HydrophobicContact CE-CD1 3.73Å; I354-I356 PolarHBondContact O-N 3.3Å; I356-I372 HydrophobicContact CG2-CD1 4.48Å; I356-I372 HydrophobicContact CG2-CG2 4.18Å; I356-Q374 HydrophobicContact CG2-CG 4.12Å; I356-L383 HydrophobicContact CD1-CD2 3.9Å; I356-L383 HydrophobicContact CG1-CD2 4.24Å; I356-L383 HydrophobicContact CG2-CD2 3.84Å; I356-W385 HydrophobicContact CD1-CD2 4.09Å; I356-W385 HydrophobicContact CD1-CE3 3.56Å; I356-W385 HydrophobicContact CD1-CH2 3.88Å; I356-W385 HydrophobicContact CD1-CZ2 4.38Å; I356-W385 HydrophobicContact CD1-CZ3 3.45Å; I356-W385 VanDerWaalsContact CD1-CZ3 3.45Å; I356-W385 HydrophobicContact CG1-CZ3 4.48Å
357	M	86.7	Confident	85.7	Confident	35 Å²	35	53.6 Å²	53.6	17%	0.172	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.6	174.1	-64.6	-53.4	-78.8	0	0	110.1	T323 V336 K337 R338 Q374 V375	T323-M357 HydrophobicContact CG2-CE 4.46Å; V336-M357 HydrophobicContact CB-CE 4.17Å; V336-M357 HydrophobicContact CG1-CB 3.69Å; V336-M357 HydrophobicContact CG1-CE 3.65Å; V336-M357 HydrophobicContact CG1-CG 4.47Å; K337-M357 CarbonylContact O-C 3.56Å; K337-M357 WeakPolarHBondContact O-CA 3.24Å; R338-M357 HydrophobicContact CB-SD 4.31Å; M357-Q374 CarbonylContact O-C 3.49Å; M357-Q374 VanDerWaalsContact O-CA 3.3Å; M357-Q374 WeakPolarHBondContact O-CA 3.45Å; M357-Q374 WeakPolarHBondContact O-CG 3.49Å; M357-V375 PolarHBondContact O-N 2.83Å
358	C	85.7	Confident	85.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	158.9	-170.7	62.3	0	0	0	0	113.3	K337 I372 A373	K337-C358 PolarHBondContact N-O 3.03Å; K337-C358 PolarHBondContact O-N 3.02Å; K337-C358 PolarHBondContact O-SG 3.13Å; K337-C358 VanDerWaalsContact O-SG 3.32Å; C358-I372 HydrophobicContact CB-CG2 3.29Å; C358-A373 WeakPolarHBondContact CA-O 3.41Å
359	T	84.6	Confident	86.2	Confident	19 Å²	19	53.2 Å²	53.2	12%	0.117	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	-33.8	179	49.4	0	0	0	0	112.9	A373 V375	T359-A373 PolarHBondContact N-O 3.29Å; T359-A373 PolarHBondContact OG1-O 3.34Å; T359-V375 HydrophobicContact CG2-CG2 3.74Å
360	A	86.4	Confident	86.5	Confident	5 Å²	5	49.4 Å²	49.4	4%	0.041	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	149.4	177	0	0	0	0	0	110.4	Q317 A373 V409 L412	Q317-A360 VanDerWaalsContact NE2-C 3.28Å; Q317-A360 VanDerWaalsContact NE2-CA 3.28Å; A360-A373 HydrophobicContact CB-CB 4.32Å; A360-A373 PolarHBondContact O-N 3.15Å; A360-V409 HydrophobicContact CB-CB 4.34Å; A360-V409 HydrophobicContact CB-CG1 3.93Å; A360-L412 HydrophobicContact CB-CB 4.06Å
361	T	90.7	Very high	86.9	Confident	6 Å²	6	46.6 Å²	46.6	4%	0.037	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	154	176.9	43.2	0	0	0	0	111.5	D304 H306 Q317 L339 I371 I372	D304-T361 PolarHBondContact OD2-N 3.2Å; D304-T361 PolarHBondContact OD2-OG1 3.27Å; H306-T361 PolarHBondContact CD2-OG1 2.71Å; H306-T361 VanDerWaalsContact CD2-OG1 3.29Å; H306-T361 PolarHBondContact NE2-O 3.43Å; H306-T361 PolarHBondContact NE2-OG1 3.21Å; Q317-T361 HydrophobicContact CG-CG2 4.16Å; Q317-T361 VanDerWaalsContact NE2-N 3.12Å; Q317-T361 PolarHBondContact NE2-OG1 3.4Å; L339-T361 HydrophobicContact CD1-CG2 3.77Å; T361-I371 CarbonylContact C-O 3.54Å; T361-I371 WeakPolarHBondContact CA-O 3.43Å; T361-I372 HydrophobicContact CG2-CB 4.48Å; T361-I372 HydrophobicContact CG2-CG1 4.04Å; T361-I372 HydrophobicContact CG2-CG2 4.26Å
362	C	90.3	Very high	87.3	Confident	13 Å²	13	38.2 Å²	38.2	9%	0.088	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	143	174.7	-171.3	0	0	0	0	108.8	V370 I371 L412	C362-V370 CarbonylContact O-C 3.54Å; C362-V370 WeakPolarHBondContact O-CG1 3.42Å; C362-I371 PolarHBondContact N-O 2.76Å; C362-I371 PolarHBondContact O-N 2.79Å; C362-L412 HydrophobicContact CB-CB 4.07Å; C362-L412 HydrophobicContact CB-CD2 3.96Å; C362-L412 HydrophobicContact CB-CG 3.9Å; C362-L412 WeakPolarHBondContact CB-O 3.35Å
363	I	89.3	Confident	87.5	Confident	26 Å²	26	36.8 Å²	36.8	13%	0.133	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	140	173.7	-56.1	164.9	0	0	0	109.1	H306 L307 A308 V370	H306-I363 HydrophobicContact CB-CD1 3.37Å; H306-I363 HydrophobicContact CB-CG1 3.82Å; L307-I363 VanDerWaalsContact O-CD1 3.26Å; L307-I363 WeakPolarHBondContact O-CD1 3.27Å; A308-I363 HydrophobicContact CB-CD1 3.9Å; A308-I363 HydrophobicContact CB-CG1 4.45Å; A308-I363 HydrophobicContact CB-CG2 4.13Å; I363-V370 HydrophobicContact CG1-CG2 4.37Å
364	T	88	Confident	87.7	Confident	6 Å²	6	34 Å²	34	4%	0.037	17%	0.166	C	C	.	.			trans	-58.4	151.6	167.3	51.3	0	0	0	0	112.1	S366 S367 Y369 I371 I414	T364-S366 VanDerWaalsContact C-N 3.26Å; T364-S366 WeakPolarHBondContact CB-OG 3.21Å; T364-S366 PolarHBondContact O-N 2.67Å; T364-S366 PolarHBondContact OG1-OG 2.69Å; T364-S367 WeakPolarHBondContact O-CA 3.29Å; T364-S367 PolarHBondContact O-N 3.38Å; T364-Y369 WeakPolarHBondContact CB-O 3.45Å; T364-Y369 WeakPolarHBondContact CG2-O 3.34Å; T364-Y369 PolarHBondContact N-O 2.88Å; T364-Y369 PolarHBondContact OG1-N 2.76Å; T364-Y369 PolarHBondContact OG1-O 3.34Å; T364-I371 HydrophobicContact CG2-CD1 4.24Å; T364-I371 HydrophobicContact CG2-CG1 4.28Å; T364-I414 HydrophobicContact CG2-CD1 3.74Å
365	R	83.9	Confident	87.6	Confident	135 Å²	135	30.1 Å²	30.1	51%	0.509	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-34.4	177.7	-62.6	-63.7	-175.8	136.7	-1.1	111.6	S367 D418	R365-S367 PolarHBondContact O-N 3.49Å; R365-S367 PolarHBondContact O-OG 3.26Å; R365-D418 WeakPolarHBondContact CB-OD1 3.49Å; R365-D418 PolarHBondContact N-OD1 3.24Å; R365-D418 PolarHBondContact N-OD2 3.13Å
366	S	82.1	Confident	87.5	Confident	57 Å²	57	27.5 Å²	27.5	40%	0.399	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.1	168.7	49.9	0	0	0	0	113.9	T364 E368 D418	T364-S366 VanDerWaalsContact C-N 3.26Å; T364-S366 WeakPolarHBondContact CB-OG 3.21Å; T364-S366 PolarHBondContact O-N 2.67Å; T364-S366 PolarHBondContact OG1-OG 2.69Å; S366-E368 PolarHBondContact O-N 3.14Å; S366-D418 WeakPolarHBondContact CB-OD2 3.33Å; S366-D418 PolarHBondContact N-OD2 3.25Å; S366-D418 PolarHBondContact OG-OD2 3.09Å
367	S	84.3	Confident	87.1	Confident	11 Å²	11	37 Å²	37	8%	0.077	18%	0.182	C	C	.	.	S	Bend	trans	62.6	16.6	-177.9	-48.3	0	0	0	0	114.4	K267 C309 T364 R365	K267-S367 PolarHBondContact NZ-OG 2.9Å; C309-S367 PolarHBondContact N-O 2.93Å; C309-S367 PolarHBondContact SG-O 3.07Å; T364-S367 WeakPolarHBondContact O-CA 3.29Å; T364-S367 PolarHBondContact O-N 3.38Å; R365-S367 PolarHBondContact O-N 3.49Å; R365-S367 PolarHBondContact O-OG 3.26Å
368	E	87	Confident	86.7	Confident	100 Å²	100	44.1 Å²	44.1	47%	0.467	22%	0.215	S	C	.	.	S	Bend	trans	-96.4	-30.6	-179.7	-66	-176.4	160.8	0	0	112.4	S366 L387	S366-E368 PolarHBondContact O-N 3.14Å; E368-L387 WeakPolarHBondContact O-CB 3.44Å; E368-L387 PolarHBondContact O-N 3.11Å
369	Y	91.2	Very high	86.5	Confident	66 Å²	66	45.2 Å²	45.2	26%	0.259	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.4	-177.3	-55.2	-93.8	0	0	0	112.1	T364 V384 W385 N386 D393	T364-Y369 WeakPolarHBondContact CB-O 3.45Å; T364-Y369 WeakPolarHBondContact CG2-O 3.34Å; T364-Y369 PolarHBondContact N-O 2.88Å; T364-Y369 PolarHBondContact OG1-N 2.76Å; T364-Y369 PolarHBondContact OG1-O 3.34Å; Y369-V384 HydrophobicContact CD1-CG1 3.86Å; Y369-V384 HydrophobicContact CG-CG1 4.19Å; Y369-W385 CarbonylContact C-O 3.55Å; Y369-W385 WeakPolarHBondContact CA-O 3.12Å; Y369-N386 HydrophobicContact CD1-CB 4.01Å; Y369-N386 HydrophobicContact CE1-CB 3.94Å; Y369-D393 HydrophobicContact CD1-CB 4.39Å; Y369-D393 HydrophobicContact CE1-CB 4.18Å
370	V	91.9	Very high	86.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.9	168.4	-174.4	0	0	0	0	108.6	V315 C362 I363 I372 W385 L387	V315-V370 HydrophobicContact CG1-CG1 4.29Å; V315-V370 HydrophobicContact CG1-CG2 4.43Å; V315-V370 HydrophobicContact CG2-CG2 3.94Å; C362-V370 CarbonylContact O-C 3.54Å; C362-V370 WeakPolarHBondContact O-CG1 3.42Å; I363-V370 HydrophobicContact CG1-CG2 4.37Å; V370-I372 HydrophobicContact CB-CG1 4.49Å; V370-I372 HydrophobicContact CG1-CD1 4.39Å; V370-I372 HydrophobicContact CG1-CG1 3.83Å; V370-W385 HydrophobicContact CB-CB 4.45Å; V370-W385 PolarHBondContact N-O 3.42Å; V370-W385 PolarHBondContact O-N 3Å; V370-L387 HydrophobicContact CG2-CD1 3.56Å; V370-L387 HydrophobicContact CG2-CD2 3.57Å; V370-L387 HydrophobicContact CG2-CG 3.64Å
371	I	92.8	Very high	86.9	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131	174	-48.7	-168	0	0	0	107.9	T361 C362 T364 I382 L383 L412 I414 V421 L440	T361-I371 CarbonylContact C-O 3.54Å; T361-I371 WeakPolarHBondContact CA-O 3.43Å; C362-I371 PolarHBondContact N-O 2.76Å; C362-I371 PolarHBondContact O-N 2.79Å; T364-I371 HydrophobicContact CG2-CD1 4.24Å; T364-I371 HydrophobicContact CG2-CG1 4.28Å; I371-I382 HydrophobicContact CG2-CG2 3.63Å; I371-L383 CarbonylContact C-O 3.56Å; I371-L383 WeakPolarHBondContact CA-O 3.38Å; I371-L412 HydrophobicContact CB-CD2 4.23Å; I371-L412 HydrophobicContact CG2-CD2 4.01Å; I371-L412 VanDerWaalsContact O-CD2 3.26Å; I371-L412 WeakPolarHBondContact O-CD2 3.45Å; I371-I414 HydrophobicContact CD1-CB 4.45Å; I371-I414 HydrophobicContact CD1-CD1 3.44Å; I371-I414 VanDerWaalsContact CD1-CD1 3.44Å; I371-I414 HydrophobicContact CD1-CG1 4.14Å; I371-V421 HydrophobicContact CD1-CG2 3.41Å; I371-V421 VanDerWaalsContact CD1-CG2 3.41Å; I371-V421 HydrophobicContact CG2-CG1 3.88Å; I371-V421 HydrophobicContact CG2-CG2 4.14Å; I371-L440 HydrophobicContact CD1-CD1 3.83Å
372	I	92	Very high	87	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	128	-168.6	-57.3	159	0	0	0	107.8	L339 I356 C358 T361 V370 Q374 I382 L383 W385	L339-I372 HydrophobicContact CD1-CD1 4.34Å; L339-I372 HydrophobicContact CD1-CG1 4.46Å; L339-I372 HydrophobicContact CD2-CD1 3.47Å; L339-I372 VanDerWaalsContact CD2-CD1 3.47Å; L339-I372 HydrophobicContact CD2-CG1 4.43Å; L339-I372 HydrophobicContact CG-CD1 4.47Å; I356-I372 HydrophobicContact CG2-CD1 4.48Å; I356-I372 HydrophobicContact CG2-CG2 4.18Å; C358-I372 HydrophobicContact CB-CG2 3.29Å; T361-I372 HydrophobicContact CG2-CB 4.48Å; T361-I372 HydrophobicContact CG2-CG1 4.04Å; T361-I372 HydrophobicContact CG2-CG2 4.26Å; V370-I372 HydrophobicContact CB-CG1 4.49Å; V370-I372 HydrophobicContact CG1-CD1 4.39Å; V370-I372 HydrophobicContact CG1-CG1 3.83Å; I372-Q374 PolarHBondContact O-N 3.19Å; I372-I382 WeakPolarHBondContact O-CA 3.26Å; I372-L383 HydrophobicContact CB-CB 4.28Å; I372-L383 HydrophobicContact CD1-CD2 3.95Å; I372-L383 HydrophobicContact CD1-CG 4.26Å; I372-L383 PolarHBondContact N-O 3.41Å; I372-L383 PolarHBondContact O-N 3.32Å; I372-W385 HydrophobicContact CD1-CB 3.81Å; I372-W385 HydrophobicContact CD1-CG 4.49Å
373	A	90.8	Very high	87.1	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	95.5	164.5	0	0	0	0	0	108.2	C358 T359 A360 I382 V409	C358-A373 WeakPolarHBondContact CA-O 3.41Å; T359-A373 PolarHBondContact N-O 3.29Å; T359-A373 PolarHBondContact OG1-O 3.34Å; A360-A373 HydrophobicContact CB-CB 4.32Å; A360-A373 PolarHBondContact O-N 3.15Å; A373-I382 HydrophobicContact CB-CD1 4.35Å; A373-V409 HydrophobicContact CB-CB 3.66Å; A373-V409 HydrophobicContact CB-CG1 3.99Å; A373-V409 HydrophobicContact CB-CG2 3.82Å
374	Q	89.4	Confident	87.2	Confident	26 Å²	26	42.6 Å²	42.6	12%	0.121	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	138.9	-175.4	-169.9	-177.9	18.6	0	0	111.1	I356 M357 I372 T376 P380 A381 L383	I356-Q374 HydrophobicContact CG2-CG 4.12Å; M357-Q374 CarbonylContact O-C 3.49Å; M357-Q374 VanDerWaalsContact O-CA 3.3Å; M357-Q374 WeakPolarHBondContact O-CA 3.45Å; M357-Q374 WeakPolarHBondContact O-CG 3.49Å; I372-Q374 PolarHBondContact O-N 3.19Å; Q374-T376 HydrophobicContact CG-CG2 3.84Å; Q374-P380 WeakPolarHBondContact O-CA 3.48Å; Q374-A381 WeakPolarHBondContact CA-O 3.1Å; Q374-A381 WeakPolarHBondContact CB-O 3.45Å; Q374-A381 PolarHBondContact N-O 2.86Å; Q374-A381 PolarHBondContact O-N 3.46Å; Q374-L383 HydrophobicContact CB-CB 4.17Å
375	V	84.1	Confident	87.4	Confident	24 Å²	24	42.5 Å²	42.5	15%	0.145	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.4	171.2	-178.5	0	0	0	0	108.1	V336 M357 T359	V336-V375 HydrophobicContact CG1-CB 4.31Å; M357-V375 PolarHBondContact O-N 2.83Å; T359-V375 HydrophobicContact CG2-CG2 3.74Å
376	T	81.4	Confident	87.8	Confident	43 Å²	43	37 Å²	37	26%	0.264	19%	0.191	S	C	.	.			trans	-109.5	169.6	175.7	75.9	0	0	0	0	110.9	Q374 E378 G379	Q374-T376 HydrophobicContact CG-CG2 3.84Å; T376-E378 PolarHBondContact O-N 3.48Å; T376-E378 PolarHBondContact OG1-N 3.04Å; T376-G379 WeakPolarHBondContact CB-O 3.46Å; T376-G379 PolarHBondContact N-O 2.62Å; T376-G379 PolarHBondContact O-N 3.19Å; T376-G379 PolarHBondContact OG1-N 2.51Å; T376-G379 PolarHBondContact OG1-O 3.2Å
377	Q	76.2	Confident	88	Confident	203 Å²	203	35 Å²	35	95%	0.949	18%	0.175	S	C	*	.	S	Bend	trans	-65.1	-30.7	172.2	-63.5	-174.4	4.5	0	0	112.2	G379	Q377-G379 VanDerWaalsContact C-N 3.33Å
378	E	78.1	Confident	88.1	Confident	185 Å²	185	39.5 Å²	39.5	86%	0.864	20%	0.202	S	C	*	.	S	Bend	trans	-77	-21	-179.7	-60	-174.8	171.3	0	0	112.7	T376	T376-E378 PolarHBondContact O-N 3.48Å; T376-E378 PolarHBondContact OG1-N 3.04Å
379	G	82.9	Confident	87.9	Confident	22 Å²	22	36.6 Å²	36.6	23%	0.227	20%	0.2	C	C	.	.			trans	147.2	178.9	-179.4	0	0	0	0	0	112.7	T376 Q377	T376-G379 WeakPolarHBondContact CB-O 3.46Å; T376-G379 PolarHBondContact N-O 2.62Å; T376-G379 PolarHBondContact O-N 3.19Å; T376-G379 PolarHBondContact OG1-N 2.51Å; T376-G379 PolarHBondContact OG1-O 3.2Å; Q377-G379 VanDerWaalsContact C-N 3.33Å
380	P	89.5	Confident	87.8	Confident	5 Å²	5	35.5 Å²	35.5	3%	0.032	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	145.6	171.8	34.4	-36.1	0	0	0	111	Q374 Y398 P400 D407	Q374-P380 WeakPolarHBondContact O-CA 3.48Å; P380-Y398 HydrophobicContact CB-CE1 4.08Å; P380-Y398 HydrophobicContact CB-CE2 3.88Å; P380-Y398 HydrophobicContact CG-CD2 4.01Å; P380-Y398 HydrophobicContact CG-CE1 4.47Å; P380-Y398 HydrophobicContact CG-CE2 3.59Å; P380-Y398 PolarHBondContact O-N 2.86Å; P380-Y398 VanDerWaalsContact O-N 3.08Å; P380-P400 HydrophobicContact CG-CB 4Å; P380-D407 HydrophobicContact CB-CB 4.5Å; P380-D407 HydrophobicContact CG-CB 4.42Å
381	A	90	Very high	87.6	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	148.9	178.8	0	0	0	0	0	111.2	Q374 I395 I396 P397	Q374-A381 WeakPolarHBondContact CA-O 3.1Å; Q374-A381 WeakPolarHBondContact CB-O 3.45Å; Q374-A381 PolarHBondContact N-O 2.86Å; Q374-A381 PolarHBondContact O-N 3.46Å; A381-I395 HydrophobicContact CB-CG2 3.97Å; A381-I396 CarbonylContact C-O 3.54Å; A381-I396 VanDerWaalsContact CA-O 3.31Å; A381-I396 WeakPolarHBondContact CA-O 3.3Å; A381-P397 HydrophobicContact CB-CB 4.42Å
382	I	91.9	Very high	87.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.2	165.6	-58.1	-57.6	0	0	0	107.8	I371 I372 A373 I396 Y398 L412 V421 A423 F438	I371-I382 HydrophobicContact CG2-CG2 3.63Å; I372-I382 WeakPolarHBondContact O-CA 3.26Å; A373-I382 HydrophobicContact CB-CD1 4.35Å; I382-I396 HydrophobicContact CB-CB 4.35Å; I382-I396 PolarHBondContact N-O 3.03Å; I382-I396 PolarHBondContact O-N 2.95Å; I382-Y398 HydrophobicContact CD1-CE1 3.97Å; I382-Y398 HydrophobicContact CG1-CD1 4.25Å; I382-Y398 HydrophobicContact CG1-CE1 3.87Å; I382-L412 HydrophobicContact CD1-CD1 4.49Å; I382-V421 HydrophobicContact CG2-CG1 4.49Å; I382-A423 HydrophobicContact CD1-CB 4.38Å; I382-F438 HydrophobicContact CD1-CD2 4.42Å; I382-F438 HydrophobicContact CD1-CE2 4.06Å; I382-F438 HydrophobicContact CG1-CD1 4.41Å; I382-F438 HydrophobicContact CG1-CD2 3.7Å; I382-F438 HydrophobicContact CG1-CE1 4.28Å; I382-F438 HydrophobicContact CG1-CE2 3.55Å; I382-F438 HydrophobicContact CG1-CG 4.13Å; I382-F438 HydrophobicContact CG1-CZ 3.86Å
383	L	91.7	Very high	87.1	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.9	178.1	166.6	66.6	0	0	0	109.3	I356 I371 I372 Q374 W385 I395	I356-L383 HydrophobicContact CD1-CD2 3.9Å; I356-L383 HydrophobicContact CG1-CD2 4.24Å; I356-L383 HydrophobicContact CG2-CD2 3.84Å; I371-L383 CarbonylContact C-O 3.56Å; I371-L383 WeakPolarHBondContact CA-O 3.38Å; I372-L383 HydrophobicContact CB-CB 4.28Å; I372-L383 HydrophobicContact CD1-CD2 3.95Å; I372-L383 HydrophobicContact CD1-CG 4.26Å; I372-L383 PolarHBondContact N-O 3.41Å; I372-L383 PolarHBondContact O-N 3.32Å; Q374-L383 HydrophobicContact CB-CB 4.17Å; L383-W385 HydrophobicContact CD1-CE3 4.39Å; L383-W385 HydrophobicContact CD2-CE3 4.1Å; L383-I395 HydrophobicContact CD1-CD1 4.15Å; L383-I395 HydrophobicContact CD1-CG1 3.54Å
384	V	92.2	Very high	86.9	Confident	6 Å²	6	51.1 Å²	51.1	4%	0.036	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.3	166.8	-175.8	0	0	0	0	107.9	Y369 D393 H394 L440	Y369-V384 HydrophobicContact CD1-CG1 3.86Å; Y369-V384 HydrophobicContact CG-CG1 4.19Å; V384-D393 HydrophobicContact CG1-CB 4.42Å; V384-D393 WeakPolarHBondContact O-CB 3.19Å; V384-D393 PolarHBondContact O-N 2.87Å; V384-H394 HydrophobicContact CB-CB 4.17Å; V384-H394 HydrophobicContact CG2-CB 4.3Å; V384-H394 PolarHBondContact N-O 2.53Å; V384-H394 PolarHBondContact O-N 3.01Å; V384-L440 HydrophobicContact CG2-CD1 4.36Å; V384-L440 HydrophobicContact CG2-CD2 3.57Å
385	W	92.5	Very high	87	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125.9	-178.8	-170	-95.4	0	0	0	110.6	M352 P353 I356 Y369 V370 I372 L383 N390	M352-W385 HydrophobicContact CE-CH2 4.13Å; M352-W385 HydrophobicContact CE-CZ2 3.57Å; P353-W385 HydrophobicContact CG-CH2 3.74Å; P353-W385 HydrophobicContact CG-CZ2 4.01Å; I356-W385 HydrophobicContact CD1-CD2 4.09Å; I356-W385 HydrophobicContact CD1-CE3 3.56Å; I356-W385 HydrophobicContact CD1-CH2 3.88Å; I356-W385 HydrophobicContact CD1-CZ2 4.38Å; I356-W385 HydrophobicContact CD1-CZ3 3.45Å; I356-W385 VanDerWaalsContact CD1-CZ3 3.45Å; I356-W385 HydrophobicContact CG1-CZ3 4.48Å; Y369-W385 CarbonylContact C-O 3.55Å; Y369-W385 WeakPolarHBondContact CA-O 3.12Å; V370-W385 HydrophobicContact CB-CB 4.45Å; V370-W385 PolarHBondContact N-O 3.42Å; V370-W385 PolarHBondContact O-N 3Å; I372-W385 HydrophobicContact CD1-CB 3.81Å; I372-W385 HydrophobicContact CD1-CG 4.49Å; L383-W385 HydrophobicContact CD1-CE3 4.39Å; L383-W385 HydrophobicContact CD2-CE3 4.1Å; W385-N390 VanDerWaalsContact CZ2-C 3.43Å; W385-N390 WeakPolarHBondContact CZ2-O 3.41Å; W385-N390 WeakPolarHBondContact CZ2-OD1 3.18Å; W385-N390 PolarHBondContact NE1-OD1 3.03Å
386	N	91.3	Very high	87.3	Confident	20 Å²	20	53.2 Å²	53.2	11%	0.107	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.2	172.6	180	-15.1	0	0	0	109.5	Y369 T388 G389 N390 Q391 D393	Y369-N386 HydrophobicContact CD1-CB 4.01Å; Y369-N386 HydrophobicContact CE1-CB 3.94Å; N386-T388 PolarHBondContact OD1-N 2.73Å; N386-T388 PolarHBondContact OD1-OG1 2.93Å; N386-G389 PolarHBondContact OD1-N 2.85Å; N386-G389 VanDerWaalsContact OD1-N 3.16Å; N386-N390 VanDerWaalsContact O-CA 3.25Å; N386-N390 WeakPolarHBondContact O-CA 3.41Å; N386-N390 PolarHBondContact O-N 2.88Å; N386-Q391 HydrophobicContact CB-CG 4.27Å; N386-Q391 PolarHBondContact N-O 2.92Å; N386-Q391 PolarHBondContact O-N 2.56Å; N386-D393 HydrophobicContact CB-CB 4.38Å
387	L	87.1	Confident	87.7	Confident	13 Å²	13	53.1 Å²	53.1	7%	0.068	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-37.8	-179.3	-70.1	168.9	0	0	0	113.1	A308 V313 V315 L341 E368 V370 N390	A308-L387 HydrophobicContact CB-CD1 3.2Å; V313-L387 HydrophobicContact CG1-CD2 4.21Å; V315-L387 HydrophobicContact CG2-CD2 4.11Å; L341-L387 HydrophobicContact CD1-CD2 4.02Å; L341-L387 HydrophobicContact CD2-CD2 3.85Å; E368-L387 WeakPolarHBondContact O-CB 3.44Å; E368-L387 PolarHBondContact O-N 3.11Å; V370-L387 HydrophobicContact CG2-CD1 3.56Å; V370-L387 HydrophobicContact CG2-CD2 3.57Å; V370-L387 HydrophobicContact CG2-CG 3.64Å; L387-N390 PolarHBondContact O-N 2.92Å
388	T	85.1	Confident	88.3	Confident	106 Å²	106	43.7 Å²	43.7	65%	0.65	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-37.3	-177.1	64.7	0	0	0	0	112	N386	N386-T388 PolarHBondContact OD1-N 2.73Å; N386-T388 PolarHBondContact OD1-OG1 2.93Å
389	G	84.5	Confident	88.6	Confident	40 Å²	40	39.7 Å²	39.7	41%	0.412	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-9.2	175.5	0	0	0	0	0	114.3	N386 Q391	N386-G389 PolarHBondContact OD1-N 2.85Å; N386-G389 VanDerWaalsContact OD1-N 3.16Å; G389-Q391 VanDerWaalsContact C-N 3.25Å; G389-Q391 PolarHBondContact O-N 2.8Å
390	N	87.4	Confident	88.6	Confident	43 Å²	43	40.8 Å²	40.8	23%	0.23	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.1	49.3	-169.7	-165.9	30.4	0	0	0	112.8	L341 E351 W385 N386 L387	L341-N390 WeakPolarHBondContact CD1-OD1 3.49Å; E351-N390 PolarHBondContact O-ND2 3.39Å; W385-N390 VanDerWaalsContact CZ2-C 3.43Å; W385-N390 WeakPolarHBondContact CZ2-O 3.41Å; W385-N390 WeakPolarHBondContact CZ2-OD1 3.18Å; W385-N390 PolarHBondContact NE1-OD1 3.03Å; N386-N390 VanDerWaalsContact O-CA 3.25Å; N386-N390 WeakPolarHBondContact O-CA 3.41Å; N386-N390 PolarHBondContact O-N 2.88Å; L387-N390 PolarHBondContact O-N 2.92Å
391	Q	89	Confident	88	Confident	106 Å²	106	42.5 Å²	42.5	50%	0.495	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	152.6	-175	66.4	-179.4	18.2	0	0	111.3	N386 G389 D393	N386-Q391 HydrophobicContact CB-CG 4.27Å; N386-Q391 PolarHBondContact N-O 2.92Å; N386-Q391 PolarHBondContact O-N 2.56Å; G389-Q391 VanDerWaalsContact C-N 3.25Å; G389-Q391 PolarHBondContact O-N 2.8Å; Q391-D393 PolarHBondContact O-N 2.8Å
392	S	87	Confident	87.2	Confident	56 Å²	56	44.3 Å²	44.3	39%	0.392	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	129.9	170.8	56.6	0	0	0	0	110.1
393	D	87.4	Confident	86.1	Confident	65 Å²	65	49 Å²	49	35%	0.348	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-56.8	179.6	-170.4	63	0	0	0	110.7	Y369 V384 N386 Q391	Y369-D393 HydrophobicContact CD1-CB 4.39Å; Y369-D393 HydrophobicContact CE1-CB 4.18Å; V384-D393 HydrophobicContact CG1-CB 4.42Å; V384-D393 WeakPolarHBondContact O-CB 3.19Å; V384-D393 PolarHBondContact O-N 2.87Å; N386-D393 HydrophobicContact CB-CB 4.38Å; Q391-D393 PolarHBondContact O-N 2.8Å
394	H	87.3	Confident	84.7	Confident	102 Å²	102	56.2 Å²	56.2	47%	0.472	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	140.4	178.4	-67.9	81.1	0	0	0	111.2	V384	V384-H394 HydrophobicContact CB-CB 4.17Å; V384-H394 HydrophobicContact CG2-CB 4.3Å; V384-H394 PolarHBondContact N-O 2.53Å; V384-H394 PolarHBondContact O-N 3.01Å
395	I	89.6	Confident	83.3	Confident	91 Å²	91	58.1 Å²	58.1	47%	0.467	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.9	173.7	-58.9	174	0	0	0	108.1	A381 L383 P397	A381-I395 HydrophobicContact CB-CG2 3.97Å; L383-I395 HydrophobicContact CD1-CD1 4.15Å; L383-I395 HydrophobicContact CD1-CG1 3.54Å; I395-P397 WeakPolarHBondContact O-CD 3.44Å
396	I	91.1	Very high	82	Confident	4 Å²	4	63.7 Å²	63.7	2%	0.021	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	89.7	-180	-53.3	167.4	0	0	0	107.7	A381 I382 F438 L440 Y444	A381-I396 CarbonylContact C-O 3.54Å; A381-I396 VanDerWaalsContact CA-O 3.31Å; A381-I396 WeakPolarHBondContact CA-O 3.3Å; I382-I396 HydrophobicContact CB-CB 4.35Å; I382-I396 PolarHBondContact N-O 3.03Å; I382-I396 PolarHBondContact O-N 2.95Å; I396-F438 HydrophobicContact CD1-CB 4.4Å; I396-F438 HydrophobicContact CG2-CD1 3.93Å; I396-F438 HydrophobicContact CG2-CE1 4.32Å; I396-L440 HydrophobicContact CD1-CD2 4.03Å; I396-Y444 HydrophobicContact CB-CD2 4.28Å; I396-Y444 HydrophobicContact CB-CG 4.47Å; I396-Y444 HydrophobicContact CD1-CD2 3.66Å; I396-Y444 HydrophobicContact CD1-CE2 3.41Å; I396-Y444 VanDerWaalsContact CD1-CE2 3.41Å; I396-Y444 HydrophobicContact CG1-CD2 3.54Å; I396-Y444 HydrophobicContact CG1-CE2 3.85Å; I396-Y444 HydrophobicContact CG1-CG 4.16Å; I396-Y444 HydrophobicContact CG2-CD1 3.77Å; I396-Y444 HydrophobicContact CG2-CD2 3.79Å; I396-Y444 HydrophobicContact CG2-CE1 3.97Å; I396-Y444 HydrophobicContact CG2-CE2 3.96Å; I396-Y444 HydrophobicContact CG2-CG 3.68Å
397	P	89.4	Confident	80.9	Confident	41 Å²	41	62.9 Å²	62.9	27%	0.266	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	140	175.1	29.4	-32	0	0	0	109.9	A381 I395 G446 I447 H448	A381-P397 HydrophobicContact CB-CB 4.42Å; I395-P397 WeakPolarHBondContact O-CD 3.44Å; P397-G446 WeakPolarHBondContact CG-O 3.48Å; P397-I447 HydrophobicContact CB-CG1 4.39Å; P397-H448 PolarHBondContact O-N 2.85Å
398	Y	89.2	Confident	80.4	Confident	5 Å²	5	64.3 Å²	64.3	2%	0.02	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-139	154.9	-178.3	66.4	-93.5	0	0	0	113.3	P380 I382 D407 M436 F438 H448 P450	P380-Y398 HydrophobicContact CB-CE1 4.08Å; P380-Y398 HydrophobicContact CB-CE2 3.88Å; P380-Y398 HydrophobicContact CG-CD2 4.01Å; P380-Y398 HydrophobicContact CG-CE1 4.47Å; P380-Y398 HydrophobicContact CG-CE2 3.59Å; P380-Y398 PolarHBondContact O-N 2.86Å; P380-Y398 VanDerWaalsContact O-N 3.08Å; I382-Y398 HydrophobicContact CD1-CE1 3.97Å; I382-Y398 HydrophobicContact CG1-CD1 4.25Å; I382-Y398 HydrophobicContact CG1-CE1 3.87Å; Y398-D407 HydrophobicContact CE2-CB 4.34Å; Y398-D407 WeakPolarHBondContact CE2-OD2 3.47Å; Y398-M436 HydrophobicContact CD2-CE 4.49Å; Y398-M436 HydrophobicContact CD2-SD 4.21Å; Y398-M436 HydrophobicContact CE2-CE 3.67Å; Y398-M436 HydrophobicContact CE2-SD 3.85Å; Y398-F438 AromaticContact CD1-CE1 3.91Å; Y398-F438 HydrophobicContact CD1-CE1 3.91Å; Y398-F438 AromaticContact CD1-CZ 3.67Å; Y398-F438 HydrophobicContact CD1-CZ 3.67Å; Y398-F438 HydrophobicContact CD2-CZ 4.35Å; Y398-F438 AromaticContact CE1-CZ 3.98Å; Y398-F438 HydrophobicContact CE1-CZ 3.98Å; Y398-F438 HydrophobicContact CG-CE1 4.04Å; Y398-F438 AromaticContact CG-CZ 3.88Å; Y398-F438 HydrophobicContact CG-CZ 3.88Å; Y398-H448 CarbonylContact C-O 3.53Å; Y398-H448 WeakPolarHBondContact CA-O 3.2Å; Y398-H448 VanDerWaalsContact CB-O 3.3Å; Y398-H448 WeakPolarHBondContact CB-O 3.48Å; Y398-P450 HydrophobicContact CD2-CG 4.03Å
399	H	84.9	Confident	80.4	Confident	100 Å²	100	59.3 Å²	59.3	46%	0.463	33%	0.328	S	S	.	.			trans	-71.7	127.6	174.7	-85.3	-63.5	0	0	0	110.2	V401 H448 P450	H399-V401 PolarHBondContact O-N 3.29Å; H399-H448 PolarHBondContact N-O 3.35Å; H399-P450 WeakPolarHBondContact O-CD 3.5Å
400	P	82.5	Confident	80.4	Confident	45 Å²	45	59.6 Å²	59.6	29%	0.292	32%	0.323	S	S	.	.			trans	-62.2	132.2	179.4	23.9	-31.9	0	0	0	110.8	P380 D407	P380-P400 HydrophobicContact CG-CB 4Å; P400-D407 WeakPolarHBondContact CA-OD2 3.44Å
401	V	77.8	Confident	80.5	Confident	42 Å²	42	58.8 Å²	58.8	26%	0.255	32%	0.317	S	S	.	.	S	Bend	trans	-67.6	-41.3	174.6	179.8	0	0	0	0	110	H399 D407 Y434 M436 P450 F452	H399-V401 PolarHBondContact O-N 3.29Å; V401-D407 VanDerWaalsContact N-CG 3.33Å; V401-D407 PolarHBondContact N-OD1 3.23Å; V401-D407 PolarHBondContact N-OD2 3.38Å; V401-Y434 HydrophobicContact CG1-CD1 4Å; V401-Y434 HydrophobicContact CG1-CE1 4.43Å; V401-M436 HydrophobicContact CG2-CG 4.28Å; V401-M436 HydrophobicContact CG2-SD 3.66Å; V401-P450 HydrophobicContact CG2-CG 4.08Å; V401-F452 HydrophobicContact CG1-CD1 4.1Å; V401-F452 HydrophobicContact CG1-CE1 4.11Å; V401-F452 HydrophobicContact CG1-CG 4.36Å; V401-F452 HydrophobicContact CG1-CZ 4.38Å; V401-F452 HydrophobicContact CG2-CD1 4.12Å
402	N	73.4	Confident	80.6	Confident	39 Å²	39	54.4 Å²	54.4	21%	0.209	30%	0.297	C	S	.	.	S	Bend	trans	-115.1	104.1	170.2	-169.3	-15.8	0	0	0	110.8	L404 L405 K406 D407	N402-L404 PolarHBondContact O-N 2.82Å; N402-L404 WeakPolarHBondContact OD1-CB 3.1Å; N402-L404 PolarHBondContact OD1-N 3.11Å; N402-L405 PolarHBondContact O-N 2.77Å; N402-K406 PolarHBondContact O-N 2.9Å; N402-D407 PolarHBondContact N-OD1 2.76Å
403	P	67.8	Low	80.9	Confident	100 Å²	100	52.8 Å²	52.8	65%	0.649	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.2	178.2	-24	33.6	0	0	0	113.9
404	L	63	Low	81.2	Confident	153 Å²	153	49.8 Å²	49.8	80%	0.801	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-35.5	-176.9	-66	166.9	0	0	0	112.1	N402	N402-L404 PolarHBondContact O-N 2.82Å; N402-L404 WeakPolarHBondContact OD1-CB 3.1Å; N402-L404 PolarHBondContact OD1-N 3.11Å
405	L	63	Low	81.4	Confident	46 Å²	46	44.9 Å²	44.9	24%	0.241	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	5.1	-175.4	-68.9	174.5	0	0	0	113.6	I334 N402 D407 S408 P428	I334-L405 WeakPolarHBondContact CD1-O 3.33Å; N402-L405 PolarHBondContact O-N 2.77Å; L405-D407 PolarHBondContact O-N 2.8Å; L405-S408 PolarHBondContact O-N 3.19Å; L405-P428 HydrophobicContact CD1-CG 4.15Å
406	K	63.8	Low	81.3	Confident	120 Å²	120	44.2 Å²	44.2	52%	0.522	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	40.4	38.7	-172.9	-67.4	-173.6	177.4	-177.7	0	112.5	I334 N402	I334-K406 HydrophobicContact CD1-CB 4.43Å; N402-K406 PolarHBondContact O-N 2.9Å
407	D	68.1	Low	81.1	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.021	26%	0.258	C	S	.	.			trans	45.9	71.6	-178.6	-79.5	4.1	0	0	0	114.5	P380 Y398 P400 V401 N402 L405 V409 L425	P380-D407 HydrophobicContact CB-CB 4.5Å; P380-D407 HydrophobicContact CG-CB 4.42Å; Y398-D407 HydrophobicContact CE2-CB 4.34Å; Y398-D407 WeakPolarHBondContact CE2-OD2 3.47Å; P400-D407 WeakPolarHBondContact CA-OD2 3.44Å; V401-D407 VanDerWaalsContact N-CG 3.33Å; V401-D407 PolarHBondContact N-OD1 3.23Å; V401-D407 PolarHBondContact N-OD2 3.38Å; N402-D407 PolarHBondContact N-OD1 2.76Å; L405-D407 PolarHBondContact O-N 2.8Å; D407-V409 VanDerWaalsContact C-N 3.3Å; D407-V409 PolarHBondContact O-N 3.23Å; D407-L425 VanDerWaalsContact C-CD2 3.48Å; D407-L425 HydrophobicContact CB-CD2 3.41Å; D407-L425 VanDerWaalsContact CB-CD2 3.41Å
408	S	77.8	Confident	81.1	Confident	43 Å²	43	47.1 Å²	47.1	30%	0.301	26%	0.255	S	S	.	.			trans	-66.1	88.7	168.3	-175.3	0	0	0	0	110.8	L405 S410	L405-S408 PolarHBondContact O-N 3.19Å; S408-S410 PolarHBondContact O-N 2.81Å
409	V	84.5	Confident	81.2	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	121.1	172.2	-178.1	0	0	0	0	108.5	A360 A373 D407 Y411 A423 L425 M436	A360-V409 HydrophobicContact CB-CB 4.34Å; A360-V409 HydrophobicContact CB-CG1 3.93Å; A373-V409 HydrophobicContact CB-CB 3.66Å; A373-V409 HydrophobicContact CB-CG1 3.99Å; A373-V409 HydrophobicContact CB-CG2 3.82Å; D407-V409 VanDerWaalsContact C-N 3.3Å; D407-V409 PolarHBondContact O-N 3.23Å; V409-Y411 WeakPolarHBondContact CG1-O 3.38Å; V409-A423 HydrophobicContact CG1-CB 4.02Å; V409-A423 HydrophobicContact CG2-CB 4.37Å; V409-L425 HydrophobicContact CG2-CD2 4.17Å; V409-L425 HydrophobicContact CG2-CG 4.26Å; V409-M436 HydrophobicContact CG2-CE 4.38Å
410	S	84.7	Confident	81.6	Confident	46 Å²	46	46.1 Å²	46.1	32%	0.322	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-17.9	179.7	52.9	0	0	0	0	113	S408 G424 N426	S408-S410 PolarHBondContact O-N 2.81Å; S410-G424 PolarHBondContact N-O 3.34Å; S410-G424 PolarHBondContact OG-O 3.02Å; S410-G424 VanDerWaalsContact OG-O 3.11Å; S410-N426 PolarHBondContact OG-N 3.05Å; S410-N426 PolarHBondContact OG-ND2 3.37Å; S410-N426 VanDerWaalsContact OG-ND2 3.09Å
411	Y	89	Confident	82.1	Confident	25 Å²	25	44 Å²	44	10%	0.098	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	133	-176.7	170.9	-95.1	0	0	0	108.9	V409 N413 V422 A423 G424 F435 A459 T462	V409-Y411 WeakPolarHBondContact CG1-O 3.38Å; Y411-N413 HydrophobicContact CE1-CB 3.76Å; Y411-N413 HydrophobicContact CE2-CB 4.19Å; Y411-N413 VanDerWaalsContact CZ-CB 3.45Å; Y411-N413 WeakPolarHBondContact OH-CB 3.48Å; Y411-N413 PolarHBondContact OH-ND2 2.82Å; Y411-V422 HydrophobicContact CE1-CG1 4.42Å; Y411-A423 CarbonylContact O-C 3.59Å; Y411-A423 WeakPolarHBondContact O-CA 3.5Å; Y411-G424 PolarHBondContact N-O 3.21Å; Y411-G424 PolarHBondContact O-N 3.09Å; Y411-F435 HydrophobicContact CD1-CE1 4.21Å; Y411-F435 HydrophobicContact CE1-CE1 4.47Å; Y411-A459 HydrophobicContact CG-CB 4.36Å; Y411-T462 HydrophobicContact CE1-CG2 4.5Å; Y411-T462 PolarHBondContact OH-O 3.3Å
412	L	92.1	Very high	82.9	Confident	15 Å²	15	42 Å²	42	8%	0.079	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	126.7	175.5	-165.8	67.7	0	0	0	108.4	A360 C362 I371 I382 V421 V422 A423	A360-L412 HydrophobicContact CB-CB 4.06Å; C362-L412 HydrophobicContact CB-CB 4.07Å; C362-L412 HydrophobicContact CB-CD2 3.96Å; C362-L412 HydrophobicContact CB-CG 3.9Å; C362-L412 WeakPolarHBondContact CB-O 3.35Å; I371-L412 HydrophobicContact CB-CD2 4.23Å; I371-L412 HydrophobicContact CG2-CD2 4.01Å; I371-L412 VanDerWaalsContact O-CD2 3.26Å; I371-L412 WeakPolarHBondContact O-CD2 3.45Å; I382-L412 HydrophobicContact CD1-CD1 4.49Å; L412-V421 HydrophobicContact CD1-CG1 3.63Å; L412-V421 HydrophobicContact CG-CG1 4.37Å; L412-V422 WeakPolarHBondContact CA-O 3.43Å; L412-A423 HydrophobicContact CD1-CB 3.84Å
413	N	93.3	Very high	83.8	Confident	21 Å²	21	40.2 Å²	40.2	11%	0.112	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	160.4	177.6	-158.1	-5.9	0	0	0	110.3	Y411 V422 I464	Y411-N413 HydrophobicContact CE1-CB 3.76Å; Y411-N413 HydrophobicContact CE2-CB 4.19Å; Y411-N413 VanDerWaalsContact CZ-CB 3.45Å; Y411-N413 WeakPolarHBondContact OH-CB 3.48Å; Y411-N413 PolarHBondContact OH-ND2 2.82Å; N413-V422 PolarHBondContact N-O 2.85Å; N413-V422 PolarHBondContact O-N 2.84Å; N413-I464 HydrophobicContact CB-CD1 3.9Å
414	I	93.1	Very high	84.9	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.6	-175.9	-164.9	177.4	0	0	0	110.7	T364 I371 D418 L420 V421 L440 I464	T364-I414 HydrophobicContact CG2-CD1 3.74Å; I371-I414 HydrophobicContact CD1-CB 4.45Å; I371-I414 HydrophobicContact CD1-CD1 3.44Å; I371-I414 VanDerWaalsContact CD1-CD1 3.44Å; I371-I414 HydrophobicContact CD1-CG1 4.14Å; I414-D418 HydrophobicContact CD1-CB 3.94Å; I414-L420 CarbonylContact C-O 3.59Å; I414-L420 WeakPolarHBondContact CA-O 3.45Å; I414-V421 HydrophobicContact CG1-CG2 4.43Å; I414-L440 HydrophobicContact CD1-CD1 4.33Å; I414-I464 VanDerWaalsContact C-CD1 3.4Å; I414-I464 WeakPolarHBondContact O-CD1 3.36Å
415	S	91.6	Very high	86.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.146	C	C	.	.			trans	-61.5	160.4	174.5	62.2	0	0	0	0	113	D417 D418 R419 L420 N467	S415-D417 VanDerWaalsContact CB-OD1 3.24Å; S415-D417 WeakPolarHBondContact CB-OD1 3.46Å; S415-D417 PolarHBondContact O-N 3.49Å; S415-D417 PolarHBondContact OG-OD1 3.1Å; S415-D418 PolarHBondContact O-N 3.04Å; S415-R419 PolarHBondContact OG-N 3.4Å; S415-L420 PolarHBondContact N-O 3.03Å; S415-L420 PolarHBondContact OG-N 3.13Å; S415-L420 PolarHBondContact OG-O 2.74Å; S415-N467 VanDerWaalsContact CB-O 3.28Å; S415-N467 WeakPolarHBondContact CB-O 3.33Å
416	L	86.6	Confident	87.1	Confident	76 Å²	76	29.1 Å²	29.1	40%	0.398	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.3	-176.1	-65.9	179.2	0	0	0	113.9	G466	L416-G466 WeakPolarHBondContact CD1-O 3.47Å; L416-G466 WeakPolarHBondContact CG-O 3.33Å
417	D	88.6	Confident	87.9	Confident	68 Å²	68	24.2 Å²	24.2	36%	0.364	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	11.9	175.7	64.9	-20.9	0	0	0	113.5	S415 R419	S415-D417 VanDerWaalsContact CB-OD1 3.24Å; S415-D417 WeakPolarHBondContact CB-OD1 3.46Å; S415-D417 PolarHBondContact O-N 3.49Å; S415-D417 PolarHBondContact OG-OD1 3.1Å; D417-R419 PolarHBondContact O-N 3.25Å; D417-R419 WeakPolarHBondContact OD1-CB 3.5Å; D417-R419 PolarHBondContact OD1-N 2.88Å; D417-R419 WeakPolarHBondContact OD2-CB 3.46Å
418	D	89.1	Confident	87.9	Confident	38 Å²	38	28.5 Å²	28.5	20%	0.203	16%	0.156	C	C	.	.	S	Bend	trans	55.2	27.6	-177.2	-74.2	-20.1	0	0	0	114.1	R365 S366 I414 S415	R365-D418 WeakPolarHBondContact CB-OD1 3.49Å; R365-D418 PolarHBondContact N-OD1 3.24Å; R365-D418 PolarHBondContact N-OD2 3.13Å; S366-D418 WeakPolarHBondContact CB-OD2 3.33Å; S366-D418 PolarHBondContact N-OD2 3.25Å; S366-D418 PolarHBondContact OG-OD2 3.09Å; I414-D418 HydrophobicContact CD1-CB 3.94Å; S415-D418 PolarHBondContact O-N 3.04Å
419	R	91.5	Very high	87.7	Confident	84 Å²	84	31.3 Å²	31.3	32%	0.317	17%	0.172	S	C	.	.			trans	-103.2	-50.6	-174.1	179.2	176.9	173.4	-164.1	-4.3	114.5	S415 D417 D439 L440 T441	S415-R419 PolarHBondContact OG-N 3.4Å; D417-R419 PolarHBondContact O-N 3.25Å; D417-R419 WeakPolarHBondContact OD1-CB 3.5Å; D417-R419 PolarHBondContact OD1-N 2.88Å; D417-R419 WeakPolarHBondContact OD2-CB 3.46Å; R419-D439 WeakPolarHBondContact CG-OD1 3.24Å; R419-D439 IonicContact CZ-OD2 2.82Å; R419-D439 IonicContact NE-OD1 3.6Å; R419-D439 PolarHBondContact NE-OD1 3.01Å; R419-D439 VanDerWaalsContact NE-OD1 3.15Å; R419-D439 IonicContact NE-OD2 3.6Å; R419-D439 PolarHBondContact NE-OD2 3.11Å; R419-D439 IonicContact NH2-OD2 3.34Å; R419-D439 PolarHBondContact NH2-OD2 2.93Å; R419-L440 WeakPolarHBondContact O-CB 3.13Å; R419-L440 WeakPolarHBondContact O-CG 3.42Å; R419-L440 PolarHBondContact O-N 3.02Å; R419-T441 HydrophobicContact CG-CG2 3.95Å; R419-T441 PolarHBondContact NE-OG1 3.48Å
420	L	92.7	Very high	87.4	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.9	-172.4	-59.7	177.7	0	0	0	109.8	I414 S415 V437 F438 D439 L484 L485	I414-L420 CarbonylContact C-O 3.59Å; I414-L420 WeakPolarHBondContact CA-O 3.45Å; S415-L420 PolarHBondContact N-O 3.03Å; S415-L420 PolarHBondContact OG-N 3.13Å; S415-L420 PolarHBondContact OG-O 2.74Å; L420-V437 HydrophobicContact CB-CG1 4.3Å; L420-F438 CarbonylContact C-O 3.53Å; L420-F438 WeakPolarHBondContact CA-O 3.27Å; L420-D439 HydrophobicContact CD2-CB 3.72Å; L420-L484 HydrophobicContact CB-CD1 4.32Å; L420-L484 HydrophobicContact CD1-CB 3.74Å; L420-L484 HydrophobicContact CD1-CD1 4.15Å; L420-L485 HydrophobicContact CD1-CD2 3.8Å; L420-L485 HydrophobicContact CD1-CG 4.03Å; L420-L485 HydrophobicContact CD2-CD2 3.88Å; L420-L485 HydrophobicContact CG-CD2 4.48Å
421	V	92.9	Very high	87.3	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.1	176.6	-178.4	0	0	0	0	109	I371 I382 L412 I414 V437 F438 L440	I371-V421 HydrophobicContact CD1-CG2 3.41Å; I371-V421 VanDerWaalsContact CD1-CG2 3.41Å; I371-V421 HydrophobicContact CG2-CG1 3.88Å; I371-V421 HydrophobicContact CG2-CG2 4.14Å; I382-V421 HydrophobicContact CG2-CG1 4.49Å; L412-V421 HydrophobicContact CD1-CG1 3.63Å; L412-V421 HydrophobicContact CG-CG1 4.37Å; I414-V421 HydrophobicContact CG1-CG2 4.43Å; V421-V437 CarbonylContact O-C 3.59Å; V421-V437 VanDerWaalsContact O-CA 3.27Å; V421-V437 WeakPolarHBondContact O-CA 3.28Å; V421-F438 HydrophobicContact CB-CB 4.35Å; V421-F438 PolarHBondContact N-O 3.11Å; V421-F438 PolarHBondContact O-N 3.32Å; V421-L440 HydrophobicContact CG2-CD1 3.88Å; V421-L440 HydrophobicContact CG2-CD2 3.8Å; V421-L440 HydrophobicContact CG2-CG 3.79Å
422	V	93.6	Very high	87.3	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	114.5	175.7	-175	0	0	0	0	109	Y411 L412 N413 F435 M436 V437 I464 W482 L484	Y411-V422 HydrophobicContact CE1-CG1 4.42Å; L412-V422 WeakPolarHBondContact CA-O 3.43Å; N413-V422 PolarHBondContact N-O 2.85Å; N413-V422 PolarHBondContact O-N 2.84Å; V422-F435 HydrophobicContact CG1-CB 4.48Å; V422-F435 HydrophobicContact CG1-CD1 3.93Å; V422-M436 WeakPolarHBondContact CA-O 3.38Å; V422-V437 HydrophobicContact CG2-CG2 4.33Å; V422-I464 HydrophobicContact CB-CD1 4.19Å; V422-I464 HydrophobicContact CG2-CD1 3.68Å; V422-I464 HydrophobicContact CG2-CG1 4.15Å; V422-W482 HydrophobicContact CG1-CH2 3.98Å; V422-W482 HydrophobicContact CG1-CZ2 4.2Å; V422-L484 HydrophobicContact CG2-CD1 4.04Å; V422-L484 HydrophobicContact CG2-CD2 3.48Å; V422-L484 VanDerWaalsContact CG2-CD2 3.48Å; V422-L484 HydrophobicContact CG2-CG 4.37Å
423	A	92.9	Very high	87.2	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.6	175	0	0	0	0	0	109.8	I382 V409 Y411 L412 F435 M436 F438	I382-A423 HydrophobicContact CD1-CB 4.38Å; V409-A423 HydrophobicContact CG1-CB 4.02Å; V409-A423 HydrophobicContact CG2-CB 4.37Å; Y411-A423 CarbonylContact O-C 3.59Å; Y411-A423 WeakPolarHBondContact O-CA 3.5Å; L412-A423 HydrophobicContact CD1-CB 3.84Å; A423-F435 CarbonylContact O-C 3.58Å; A423-F435 WeakPolarHBondContact O-CA 3.33Å; A423-M436 HydrophobicContact CB-CB 4.45Å; A423-M436 HydrophobicContact CB-CE 3.93Å; A423-M436 PolarHBondContact N-O 3.36Å; A423-M436 PolarHBondContact O-N 3.33Å; A423-F438 HydrophobicContact CB-CE2 4.16Å
424	G	91.7	Very high	87.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.1	-179.7	0	0	0	0	0	112.3	S410 Y411 Y434	S410-G424 PolarHBondContact N-O 3.34Å; S410-G424 PolarHBondContact OG-O 3.02Å; S410-G424 VanDerWaalsContact OG-O 3.11Å; Y411-G424 PolarHBondContact N-O 3.21Å; Y411-G424 PolarHBondContact O-N 3.09Å; G424-Y434 CarbonylContact C-O 3.53Å; G424-Y434 WeakPolarHBondContact CA-O 3.17Å
425	L	87.9	Confident	87.1	Confident	13 Å²	13	40.4 Å²	40.4	7%	0.068	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.8	176.6	-48.1	99.2	0	0	0	110	D407 V409 A433 Y434 M436	D407-L425 VanDerWaalsContact C-CD2 3.48Å; D407-L425 HydrophobicContact CB-CD2 3.41Å; D407-L425 VanDerWaalsContact CB-CD2 3.41Å; V409-L425 HydrophobicContact CG2-CD2 4.17Å; V409-L425 HydrophobicContact CG2-CG 4.26Å; L425-A433 CarbonylContact O-C 3.58Å; L425-A433 VanDerWaalsContact O-CA 3.28Å; L425-A433 WeakPolarHBondContact O-CA 3.36Å; L425-Y434 WeakPolarHBondContact CD1-O 3.16Å; L425-Y434 PolarHBondContact N-O 2.82Å; L425-Y434 PolarHBondContact O-N 3.49Å; L425-M436 HydrophobicContact CD1-CE 3.65Å; L425-M436 HydrophobicContact CD1-CG 4.2Å; L425-M436 HydrophobicContact CD1-SD 4.14Å
426	N	84.6	Confident	87.1	Confident	54 Å²	54	40.4 Å²	40.4	29%	0.289	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.4	169.9	-68.4	-40.8	0	0	0	108.8	S410 P428 A459	S410-N426 PolarHBondContact OG-N 3.05Å; S410-N426 PolarHBondContact OG-ND2 3.37Å; S410-N426 VanDerWaalsContact OG-ND2 3.09Å; N426-P428 WeakPolarHBondContact O-CD 3.25Å; N426-A459 VanDerWaalsContact OD1-CB 3.28Å; N426-A459 WeakPolarHBondContact OD1-CB 3.28Å; N426-A459 PolarHBondContact OD1-N 2.81Å
427	N	79.3	Confident	87.4	Confident	16 Å²	16	38 Å²	38	9%	0.086	20%	0.2	C	C	.	.			trans	-82.7	118.2	173.7	-170.9	8.8	0	0	0	109.3	T429 D430 E431 L432 Y434	N427-T429 PolarHBondContact ND2-OG1 3.34Å; N427-T429 PolarHBondContact O-N 3.46Å; N427-T429 PolarHBondContact OD1-N 2.95Å; N427-T429 PolarHBondContact OD1-OG1 3.46Å; N427-D430 PolarHBondContact ND2-OD2 2.89Å; N427-D430 PolarHBondContact O-N 2.88Å; N427-E431 PolarHBondContact O-N 3.26Å; N427-L432 PolarHBondContact N-O 2.84Å; N427-L432 VanDerWaalsContact N-O 3.13Å; N427-Y434 HydrophobicContact CB-CD2 4.38Å; N427-Y434 HydrophobicContact CB-CE2 3.98Å
428	P	68.9	Low	87.5	Confident	95 Å²	95	34.9 Å²	34.9	62%	0.617	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-21.6	178.8	24.7	-34.6	0	0	0	113.2	L405 N426	L405-P428 HydrophobicContact CD1-CG 4.15Å; N426-P428 WeakPolarHBondContact O-CD 3.25Å
429	T	73.2	Confident	87.6	Confident	102 Å²	102	34.3 Å²	34.3	63%	0.626	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-34.8	-177.3	68.2	0	0	0	0	113.8	N427	N427-T429 PolarHBondContact ND2-OG1 3.34Å; N427-T429 PolarHBondContact O-N 3.46Å; N427-T429 PolarHBondContact OD1-N 2.95Å; N427-T429 PolarHBondContact OD1-OG1 3.46Å
430	D	78.2	Confident	87.4	Confident	85 Å²	85	32 Å²	32	46%	0.455	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	0.3	-163.2	-63	-7	0	0	0	113.6	N427 L432	N427-D430 PolarHBondContact ND2-OD2 2.89Å; N427-D430 PolarHBondContact O-N 2.88Å; D430-L432 HydrophobicContact CB-CB 4.41Å; D430-L432 HydrophobicContact CB-CD1 4.36Å; D430-L432 HydrophobicContact CB-CG 4.15Å; D430-L432 WeakPolarHBondContact O-CG 3.39Å; D430-L432 PolarHBondContact O-N 2.94Å
431	E	83.1	Confident	87.1	Confident	121 Å²	121	36.6 Å²	36.6	57%	0.565	20%	0.202	S	C	*	.	S	Bend	trans	55.4	6	-172.5	-59.1	-172.1	166.3	0	0	115.3	N427 R475	N427-E431 PolarHBondContact O-N 3.26Å; E431-R475 PolarHBondContact O-NE 2.91Å
432	L	89.6	Confident	86.7	Confident	48 Å²	48	38.5 Å²	38.5	25%	0.251	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-89.1	144.6	179.5	-60.4	-178.1	0	0	0	111.6	N427 D430 Y434 F455 N456	N427-L432 PolarHBondContact N-O 2.84Å; N427-L432 VanDerWaalsContact N-O 3.13Å; D430-L432 HydrophobicContact CB-CB 4.41Å; D430-L432 HydrophobicContact CB-CD1 4.36Å; D430-L432 HydrophobicContact CB-CG 4.15Å; D430-L432 WeakPolarHBondContact O-CG 3.39Å; D430-L432 PolarHBondContact O-N 2.94Å; L432-Y434 HydrophobicContact CB-CE2 3.96Å; L432-F455 WeakPolarHBondContact CA-O 3.29Å; L432-N456 HydrophobicContact CD2-CB 3.89Å
433	A	89.7	Confident	86.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.3	166.8	0	0	0	0	0	110.1	L425 F435 T454 F455 A457 A459	L425-A433 CarbonylContact O-C 3.58Å; L425-A433 VanDerWaalsContact O-CA 3.28Å; L425-A433 WeakPolarHBondContact O-CA 3.36Å; A433-F435 HydrophobicContact CB-CD2 4.48Å; A433-F435 HydrophobicContact CB-CE2 3.67Å; A433-F435 HydrophobicContact CB-CZ 3.99Å; A433-T454 VanDerWaalsContact O-CA 3.32Å; A433-T454 WeakPolarHBondContact O-CA 3.41Å; A433-F455 PolarHBondContact N-O 3.24Å; A433-F455 PolarHBondContact O-N 3.42Å; A433-A457 WeakPolarHBondContact CB-O 3.28Å; A433-A459 HydrophobicContact CB-CB 4.3Å
434	Y	90.6	Very high	85.7	Confident	46 Å²	46	46.8 Å²	46.8	18%	0.18	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.7	175.1	-66.8	-108.2	0	0	0	108.3	V401 G424 L425 N427 L432 F452 T454	V401-Y434 HydrophobicContact CG1-CD1 4Å; V401-Y434 HydrophobicContact CG1-CE1 4.43Å; G424-Y434 CarbonylContact C-O 3.53Å; G424-Y434 WeakPolarHBondContact CA-O 3.17Å; L425-Y434 WeakPolarHBondContact CD1-O 3.16Å; L425-Y434 PolarHBondContact N-O 2.82Å; L425-Y434 PolarHBondContact O-N 3.49Å; N427-Y434 HydrophobicContact CB-CD2 4.38Å; N427-Y434 HydrophobicContact CB-CE2 3.98Å; L432-Y434 HydrophobicContact CB-CE2 3.96Å; Y434-F452 AromaticContact CD1-CD2 3.87Å; Y434-F452 HydrophobicContact CD1-CD2 3.87Å; Y434-F452 HydrophobicContact CD1-CE2 4.14Å; Y434-F452 HydrophobicContact CE1-CD2 4.39Å; Y434-F452 HydrophobicContact CE1-CE2 4.22Å; Y434-T454 HydrophobicContact CD1-CG2 3.28Å; Y434-T454 HydrophobicContact CD2-CG2 4.37Å; Y434-T454 HydrophobicContact CE1-CG2 3.31Å; Y434-T454 HydrophobicContact CE2-CG2 4.38Å; Y434-T454 HydrophobicContact CG-CG2 3.83Å
435	F	92.7	Very high	85	Confident	1 Å²	1	53.4 Å²	53.4	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.6	177.5	-63.8	-87.6	0	0	0	110.6	Y411 V422 A423 A433 F452 I453 F455 A459 T462 T472 W482	Y411-F435 HydrophobicContact CD1-CE1 4.21Å; Y411-F435 HydrophobicContact CE1-CE1 4.47Å; V422-F435 HydrophobicContact CG1-CB 4.48Å; V422-F435 HydrophobicContact CG1-CD1 3.93Å; A423-F435 CarbonylContact O-C 3.58Å; A423-F435 WeakPolarHBondContact O-CA 3.33Å; A433-F435 HydrophobicContact CB-CD2 4.48Å; A433-F435 HydrophobicContact CB-CE2 3.67Å; A433-F435 HydrophobicContact CB-CZ 3.99Å; F435-F452 WeakPolarHBondContact O-CA 3.36Å; F435-F452 WeakPolarHBondContact O-CB 3.45Å; F435-I453 HydrophobicContact CB-CG2 3.9Å; F435-I453 PolarHBondContact N-O 2.94Å; F435-I453 PolarHBondContact O-N 3.22Å; F435-F455 AromaticContact CD2-CD2 3.74Å; F435-F455 HydrophobicContact CD2-CD2 3.74Å; F435-F455 HydrophobicContact CD2-CE2 4.29Å; F435-F455 AromaticContact CE2-CD2 3.74Å; F435-F455 HydrophobicContact CE2-CD2 3.74Å; F435-A459 HydrophobicContact CE1-CB 4.21Å; F435-A459 HydrophobicContact CZ-CB 4.24Å; F435-T462 HydrophobicContact CE1-CG2 4.03Å; F435-T462 WeakPolarHBondContact CE1-OG1 3.32Å; F435-T462 HydrophobicContact CZ-CG2 4.33Å; F435-T462 WeakPolarHBondContact CZ-OG1 3.36Å; F435-T472 HydrophobicContact CE2-CG2 4.2Å; F435-T472 HydrophobicContact CZ-CG2 4.32Å; F435-W482 HydrophobicContact CB-CH2 3.79Å; F435-W482 HydrophobicContact CB-CZ2 4.01Å; F435-W482 HydrophobicContact CD1-CZ2 4.33Å; F435-W482 HydrophobicContact CG-CH2 4.33Å; F435-W482 HydrophobicContact CG-CZ2 4.05Å
436	M	91.8	Very high	84.8	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	143.9	172.2	-56.5	178.9	-59.9	0	0	108.9	Y398 V401 V409 V422 A423 L425 F438 P450 F452	Y398-M436 HydrophobicContact CD2-CE 4.49Å; Y398-M436 HydrophobicContact CD2-SD 4.21Å; Y398-M436 HydrophobicContact CE2-CE 3.67Å; Y398-M436 HydrophobicContact CE2-SD 3.85Å; V401-M436 HydrophobicContact CG2-CG 4.28Å; V401-M436 HydrophobicContact CG2-SD 3.66Å; V409-M436 HydrophobicContact CG2-CE 4.38Å; V422-M436 WeakPolarHBondContact CA-O 3.38Å; A423-M436 HydrophobicContact CB-CB 4.45Å; A423-M436 HydrophobicContact CB-CE 3.93Å; A423-M436 PolarHBondContact N-O 3.36Å; A423-M436 PolarHBondContact O-N 3.33Å; L425-M436 HydrophobicContact CD1-CE 3.65Å; L425-M436 HydrophobicContact CD1-CG 4.2Å; L425-M436 HydrophobicContact CD1-SD 4.14Å; M436-F438 HydrophobicContact CB-CE2 3.72Å; M436-F438 HydrophobicContact CB-CZ 4.09Å; M436-F438 HydrophobicContact CE-CE2 4.13Å; M436-F438 HydrophobicContact CE-CZ 4.2Å; M436-F438 HydrophobicContact SD-CZ 4.31Å; M436-P450 HydrophobicContact CB-CB 4.13Å; M436-P450 HydrophobicContact CG-CB 4.02Å; M436-P450 HydrophobicContact CG-CG 4.28Å; M436-P450 HydrophobicContact SD-CB 3.86Å; M436-P450 HydrophobicContact SD-CG 3.6Å; M436-P450 VanDerWaalsContact SD-CG 3.6Å; M436-F452 HydrophobicContact CG-CB 4.35Å
437	V	92.7	Very high	84.7	Confident	26 Å²	26	57 Å²	57	16%	0.158	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132.9	176.4	-174.1	0	0	0	0	109.9	L420 V421 V422 W482 L484	L420-V437 HydrophobicContact CB-CG1 4.3Å; V421-V437 CarbonylContact O-C 3.59Å; V421-V437 VanDerWaalsContact O-CA 3.27Å; V421-V437 WeakPolarHBondContact O-CA 3.28Å; V422-V437 HydrophobicContact CG2-CG2 4.33Å; V437-W482 HydrophobicContact CG2-CH2 3.89Å; V437-W482 HydrophobicContact CG2-CZ3 3.78Å; V437-L484 HydrophobicContact CG1-CB 4.17Å; V437-L484 WeakPolarHBondContact CG1-O 3.23Å; V437-L484 HydrophobicContact CG2-CB 4.49Å; V437-L484 HydrophobicContact CG2-CD2 4.18Å
438	F	91.6	Very high	84.9	Confident	1 Å²	1	59.6 Å²	59.6	0%	0.004	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	137.9	177.1	-56.1	-90.1	0	0	0	109.6	I382 I396 Y398 L420 V421 A423 M436 P450	I382-F438 HydrophobicContact CD1-CD2 4.42Å; I382-F438 HydrophobicContact CD1-CE2 4.06Å; I382-F438 HydrophobicContact CG1-CD1 4.41Å; I382-F438 HydrophobicContact CG1-CD2 3.7Å; I382-F438 HydrophobicContact CG1-CE1 4.28Å; I382-F438 HydrophobicContact CG1-CE2 3.55Å; I382-F438 HydrophobicContact CG1-CG 4.13Å; I382-F438 HydrophobicContact CG1-CZ 3.86Å; I396-F438 HydrophobicContact CD1-CB 4.4Å; I396-F438 HydrophobicContact CG2-CD1 3.93Å; I396-F438 HydrophobicContact CG2-CE1 4.32Å; Y398-F438 AromaticContact CD1-CE1 3.91Å; Y398-F438 HydrophobicContact CD1-CE1 3.91Å; Y398-F438 AromaticContact CD1-CZ 3.67Å; Y398-F438 HydrophobicContact CD1-CZ 3.67Å; Y398-F438 HydrophobicContact CD2-CZ 4.35Å; Y398-F438 AromaticContact CE1-CZ 3.98Å; Y398-F438 HydrophobicContact CE1-CZ 3.98Å; Y398-F438 HydrophobicContact CG-CE1 4.04Å; Y398-F438 AromaticContact CG-CZ 3.88Å; Y398-F438 HydrophobicContact CG-CZ 3.88Å; L420-F438 CarbonylContact C-O 3.53Å; L420-F438 WeakPolarHBondContact CA-O 3.27Å; V421-F438 HydrophobicContact CB-CB 4.35Å; V421-F438 PolarHBondContact N-O 3.11Å; V421-F438 PolarHBondContact O-N 3.32Å; A423-F438 HydrophobicContact CB-CE2 4.16Å; M436-F438 HydrophobicContact CB-CE2 3.72Å; M436-F438 HydrophobicContact CB-CZ 4.09Å; M436-F438 HydrophobicContact CE-CE2 4.13Å; M436-F438 HydrophobicContact CE-CZ 4.2Å; M436-F438 HydrophobicContact SD-CZ 4.31Å; F438-P450 HydrophobicContact CE1-CB 4.23Å; F438-P450 HydrophobicContact CZ-CB 4.11Å
439	D	90.7	Very high	85.6	Confident	27 Å²	27	62.3 Å²	62.3	14%	0.144	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	110.9	177.9	-177.4	-8.4	0	0	0	109	R419 L420 T441 A442 Y444	R419-D439 WeakPolarHBondContact CG-OD1 3.24Å; R419-D439 IonicContact CZ-OD2 2.82Å; R419-D439 IonicContact NE-OD1 3.6Å; R419-D439 PolarHBondContact NE-OD1 3.01Å; R419-D439 VanDerWaalsContact NE-OD1 3.15Å; R419-D439 IonicContact NE-OD2 3.6Å; R419-D439 PolarHBondContact NE-OD2 3.11Å; R419-D439 IonicContact NH2-OD2 3.34Å; R419-D439 PolarHBondContact NH2-OD2 2.93Å; L420-D439 HydrophobicContact CD2-CB 3.72Å; D439-T441 VanDerWaalsContact CG-OG1 3.3Å; D439-T441 PolarHBondContact O-N 3.38Å; D439-T441 WeakPolarHBondContact OD1-CB 3.48Å; D439-T441 PolarHBondContact OD1-N 2.92Å; D439-T441 PolarHBondContact OD1-OG1 3.42Å; D439-T441 PolarHBondContact OD2-OG1 3.45Å; D439-A442 HydrophobicContact CB-CB 4.11Å; D439-A442 WeakPolarHBondContact O-CB 3.18Å; D439-A442 PolarHBondContact O-N 3.45Å; D439-Y444 PolarHBondContact N-OH 3.02Å; D439-Y444 WeakPolarHBondContact O-CE2 3.47Å; D439-Y444 PolarHBondContact O-OH 3.49Å
440	L	87.5	Confident	86.1	Confident	36 Å²	36	57.9 Å²	57.9	19%	0.188	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.5	-177.5	-61.8	-178.3	0	0	0	113.3	I371 V384 I396 I414 R419 V421 A442	I371-L440 HydrophobicContact CD1-CD1 3.83Å; V384-L440 HydrophobicContact CG2-CD1 4.36Å; V384-L440 HydrophobicContact CG2-CD2 3.57Å; I396-L440 HydrophobicContact CD1-CD2 4.03Å; I414-L440 HydrophobicContact CD1-CD1 4.33Å; R419-L440 WeakPolarHBondContact O-CB 3.13Å; R419-L440 WeakPolarHBondContact O-CG 3.42Å; R419-L440 PolarHBondContact O-N 3.02Å; V421-L440 HydrophobicContact CG2-CD1 3.88Å; V421-L440 HydrophobicContact CG2-CD2 3.8Å; V421-L440 HydrophobicContact CG2-CG 3.79Å; L440-A442 VanDerWaalsContact C-N 3.33Å
441	T	85.3	Confident	86.3	Confident	97 Å²	97	61.6 Å²	61.6	60%	0.595	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-13.2	176.3	65.7	0	0	0	0	112.8	R419 D439	R419-T441 HydrophobicContact CG-CG2 3.95Å; R419-T441 PolarHBondContact NE-OG1 3.48Å; D439-T441 VanDerWaalsContact CG-OG1 3.3Å; D439-T441 PolarHBondContact O-N 3.38Å; D439-T441 WeakPolarHBondContact OD1-CB 3.48Å; D439-T441 PolarHBondContact OD1-N 2.92Å; D439-T441 PolarHBondContact OD1-OG1 3.42Å; D439-T441 PolarHBondContact OD2-OG1 3.45Å
442	A	85.2	Confident	86.5	Confident	40 Å²	40	61 Å²	61	33%	0.331	33%	0.333	S	S	.	.	S	Bend	trans	-77.5	137.2	178.1	0	0	0	0	0	110.9	D439 L440 Y444	D439-A442 HydrophobicContact CB-CB 4.11Å; D439-A442 WeakPolarHBondContact O-CB 3.18Å; D439-A442 PolarHBondContact O-N 3.45Å; L440-A442 VanDerWaalsContact C-N 3.33Å; A442-Y444 HydrophobicContact CB-CD2 4.49Å; A442-Y444 HydrophobicContact CB-CE2 3.96Å; A442-Y444 VanDerWaalsContact O-CD2 3.26Å; A442-Y444 WeakPolarHBondContact O-CD2 3.41Å; A442-Y444 PolarHBondContact O-N 2.87Å
443	S	83.5	Confident	86.5	Confident	118 Å²	118	59.8 Å²	59.8	83%	0.825	33%	0.327	S	S	*	.			trans	-80.3	105.8	172.8	-170	0	0	0	0	109.8
444	Y	81.2	Confident	86.6	Confident	56 Å²	56	62.8 Å²	62.8	22%	0.22	35%	0.345	C	S	.	.			trans	-87.6	123.4	175.7	-65.4	-82.2	0	0	0	110.5	I396 D439 A442 H448	I396-Y444 HydrophobicContact CB-CD2 4.28Å; I396-Y444 HydrophobicContact CB-CG 4.47Å; I396-Y444 HydrophobicContact CD1-CD2 3.66Å; I396-Y444 HydrophobicContact CD1-CE2 3.41Å; I396-Y444 VanDerWaalsContact CD1-CE2 3.41Å; I396-Y444 HydrophobicContact CG1-CD2 3.54Å; I396-Y444 HydrophobicContact CG1-CE2 3.85Å; I396-Y444 HydrophobicContact CG1-CG 4.16Å; I396-Y444 HydrophobicContact CG2-CD1 3.77Å; I396-Y444 HydrophobicContact CG2-CD2 3.79Å; I396-Y444 HydrophobicContact CG2-CE1 3.97Å; I396-Y444 HydrophobicContact CG2-CE2 3.96Å; I396-Y444 HydrophobicContact CG2-CG 3.68Å; D439-Y444 PolarHBondContact N-OH 3.02Å; D439-Y444 WeakPolarHBondContact O-CE2 3.47Å; D439-Y444 PolarHBondContact O-OH 3.49Å; A442-Y444 HydrophobicContact CB-CD2 4.49Å; A442-Y444 HydrophobicContact CB-CE2 3.96Å; A442-Y444 VanDerWaalsContact O-CD2 3.26Å; A442-Y444 WeakPolarHBondContact O-CD2 3.41Å; A442-Y444 PolarHBondContact O-N 2.87Å; Y444-H448 HydrophobicContact CD1-CB 4.07Å; Y444-H448 AromaticContact CD1-CD2 3.88Å; Y444-H448 AromaticContact CD1-CG 3.98Å; Y444-H448 HydrophobicContact CE1-CB 4.38Å; Y444-H448 AromaticContact CE1-CD2 3.76Å; Y444-H448 AromaticContact CE1-CG 3.88Å
445	V	78.8	Confident	86.7	Confident	139 Å²	139	61.2 Å²	61.2	84%	0.842	34%	0.339	S	S	*	.			trans	-117.6	110	174.2	-176.5	0	0	0	0	108.5
446	G	83.6	Confident	86.7	Confident	47 Å²	47	63.8 Å²	63.8	49%	0.485	35%	0.353	S	S	.	.	S	Bend	trans	79.1	-163.5	-178.3	0	0	0	0	0	114	P397	P397-G446 WeakPolarHBondContact CG-O 3.48Å
447	I	82.1	Confident	86.7	Confident	96 Å²	96	63.8 Å²	63.8	49%	0.492	35%	0.353	S	S	.	.			trans	-78.4	120.6	-176.3	-55.3	174.3	0	0	0	110	P397	P397-I447 HydrophobicContact CB-CG1 4.39Å
448	H	83.9	Confident	86.6	Confident	70 Å²	70	66 Å²	66	32%	0.324	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-92	142.7	-177.9	-176.7	-94.3	0	0	0	112.2	P397 Y398 H399 Y444 P450	P397-H448 PolarHBondContact O-N 2.85Å; Y398-H448 CarbonylContact C-O 3.53Å; Y398-H448 WeakPolarHBondContact CA-O 3.2Å; Y398-H448 VanDerWaalsContact CB-O 3.3Å; Y398-H448 WeakPolarHBondContact CB-O 3.48Å; H399-H448 PolarHBondContact N-O 3.35Å; Y444-H448 HydrophobicContact CD1-CB 4.07Å; Y444-H448 AromaticContact CD1-CD2 3.88Å; Y444-H448 AromaticContact CD1-CG 3.98Å; Y444-H448 HydrophobicContact CE1-CB 4.38Å; Y444-H448 AromaticContact CE1-CD2 3.76Å; Y444-H448 AromaticContact CE1-CG 3.88Å; H448-P450 WeakPolarHBondContact O-CD 3.34Å
449	Q	83.3	Confident	86.6	Confident	153 Å²	153	65.9 Å²	65.9	72%	0.715	36%	0.36	S	S	*	.			trans	-91.5	110.3	169.3	-171.4	173.1	21.1	0	0	109.5
450	P	82.4	Confident	86.5	Confident	8 Å²	8	70.4 Å²	70.4	5%	0.052	38%	0.38	C	S	.	.			trans	-70.7	139.6	-176.4	29.1	-31.5	0	0	0	110.5	Y398 H399 V401 M436 F438 H448	Y398-P450 HydrophobicContact CD2-CG 4.03Å; H399-P450 WeakPolarHBondContact O-CD 3.5Å; V401-P450 HydrophobicContact CG2-CG 4.08Å; M436-P450 HydrophobicContact CB-CB 4.13Å; M436-P450 HydrophobicContact CG-CB 4.02Å; M436-P450 HydrophobicContact CG-CG 4.28Å; M436-P450 HydrophobicContact SD-CB 3.86Å; M436-P450 HydrophobicContact SD-CG 3.6Å; M436-P450 VanDerWaalsContact SD-CG 3.6Å; F438-P450 HydrophobicContact CE1-CB 4.23Å; F438-P450 HydrophobicContact CZ-CB 4.11Å; H448-P450 WeakPolarHBondContact O-CD 3.34Å
451	K	84.3	Confident	86.8	Confident	164 Å²	164	68.7 Å²	68.7	71%	0.713	37%	0.371	S	S	*	.			trans	-76.9	134.3	164	-68.9	179.1	-177	170.2	0	107.6
452	F	86.2	Confident	87.2	Confident	109 Å²	109	64 Å²	64	48%	0.478	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	150.1	178.9	63.7	-91.9	0	0	0	112.6	V401 Y434 F435 M436 T454	V401-F452 HydrophobicContact CG1-CD1 4.1Å; V401-F452 HydrophobicContact CG1-CE1 4.11Å; V401-F452 HydrophobicContact CG1-CG 4.36Å; V401-F452 HydrophobicContact CG1-CZ 4.38Å; V401-F452 HydrophobicContact CG2-CD1 4.12Å; Y434-F452 AromaticContact CD1-CD2 3.87Å; Y434-F452 HydrophobicContact CD1-CD2 3.87Å; Y434-F452 HydrophobicContact CD1-CE2 4.14Å; Y434-F452 HydrophobicContact CE1-CD2 4.39Å; Y434-F452 HydrophobicContact CE1-CE2 4.22Å; F435-F452 WeakPolarHBondContact O-CA 3.36Å; F435-F452 WeakPolarHBondContact O-CB 3.45Å; M436-F452 HydrophobicContact CG-CB 4.35Å; F452-T454 HydrophobicContact CD2-CG2 4.11Å; F452-T454 HydrophobicContact CE2-CG2 4.34Å
453	I	90.6	Very high	87.6	Confident	22 Å²	22	62.9 Å²	62.9	11%	0.113	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	144.4	169.5	-174.7	166.6	0	0	0	108.7	F435 F455 W482 V489	F435-I453 HydrophobicContact CB-CG2 3.9Å; F435-I453 PolarHBondContact N-O 2.94Å; F435-I453 PolarHBondContact O-N 3.22Å; I453-F455 HydrophobicContact CB-CE2 4.47Å; I453-F455 HydrophobicContact CD1-CE1 4.2Å; I453-F455 HydrophobicContact CD1-CE2 3.74Å; I453-F455 HydrophobicContact CD1-CZ 3.39Å; I453-F455 HydrophobicContact CG1-CD2 4.44Å; I453-F455 HydrophobicContact CG1-CE2 3.8Å; I453-F455 HydrophobicContact CG1-CZ 3.88Å; I453-F455 HydrophobicContact CG2-CE2 3.86Å; I453-W482 HydrophobicContact CD1-CB 4.34Å; I453-W482 HydrophobicContact CG2-CD2 4.25Å; I453-W482 HydrophobicContact CG2-CE3 3.84Å; I453-W482 HydrophobicContact CG2-CH2 4.05Å; I453-W482 HydrophobicContact CG2-CZ2 4.44Å; I453-W482 HydrophobicContact CG2-CZ3 3.72Å; I453-V489 HydrophobicContact CD1-CG2 3.95Å
454	T	90.9	Very high	88.1	Confident	63 Å²	63	57.5 Å²	57.5	39%	0.387	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.2	179.6	55.2	0	0	0	0	111.4	A433 Y434 F452	A433-T454 VanDerWaalsContact O-CA 3.32Å; A433-T454 WeakPolarHBondContact O-CA 3.41Å; Y434-T454 HydrophobicContact CD1-CG2 3.28Å; Y434-T454 HydrophobicContact CD2-CG2 4.37Å; Y434-T454 HydrophobicContact CE1-CG2 3.31Å; Y434-T454 HydrophobicContact CE2-CG2 4.38Å; Y434-T454 HydrophobicContact CG-CG2 3.83Å; F452-T454 HydrophobicContact CD2-CG2 4.11Å; F452-T454 HydrophobicContact CE2-CG2 4.34Å
455	F	92.5	Very high	88.6	Confident	12 Å²	12	55.1 Å²	55.1	5%	0.053	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	144.7	172.7	-65.8	-75.1	0	0	0	110	L432 A433 F435 I453 A457 T472 F480 W482 V489	L432-F455 WeakPolarHBondContact CA-O 3.29Å; A433-F455 PolarHBondContact N-O 3.24Å; A433-F455 PolarHBondContact O-N 3.42Å; F435-F455 AromaticContact CD2-CD2 3.74Å; F435-F455 HydrophobicContact CD2-CD2 3.74Å; F435-F455 HydrophobicContact CD2-CE2 4.29Å; F435-F455 AromaticContact CE2-CD2 3.74Å; F435-F455 HydrophobicContact CE2-CD2 3.74Å; I453-F455 HydrophobicContact CB-CE2 4.47Å; I453-F455 HydrophobicContact CD1-CE1 4.2Å; I453-F455 HydrophobicContact CD1-CE2 3.74Å; I453-F455 HydrophobicContact CD1-CZ 3.39Å; I453-F455 HydrophobicContact CG1-CD2 4.44Å; I453-F455 HydrophobicContact CG1-CE2 3.8Å; I453-F455 HydrophobicContact CG1-CZ 3.88Å; I453-F455 HydrophobicContact CG2-CE2 3.86Å; F455-A457 HydrophobicContact CB-CB 3.95Å; F455-A457 PolarHBondContact O-N 2.91Å; F455-T472 HydrophobicContact CB-CG2 4Å; F455-T472 HydrophobicContact CD2-CG2 3.98Å; F455-T472 HydrophobicContact CG-CG2 3.99Å; F455-F480 HydrophobicContact CD1-CB 4.42Å; F455-F480 HydrophobicContact CD1-CD2 4.04Å; F455-F480 HydrophobicContact CE1-CB 3.76Å; F455-F480 HydrophobicContact CE1-CD2 4.05Å; F455-F480 HydrophobicContact CE1-CG 4.08Å; F455-F480 HydrophobicContact CZ-CB 4.36Å; F455-W482 AromaticContact CE2-CD1 3.69Å; F455-W482 HydrophobicContact CE2-CD2 4.12Å; F455-W482 AromaticContact CE2-CE2 3.97Å; F455-W482 AromaticContact CE2-CG 3.95Å; F455-W482 HydrophobicContact CE2-CG 3.95Å; F455-W482 AromaticContact CE2-NE1 3.67Å; F455-W482 HydrophobicContact CZ-CB 4.06Å; F455-W482 AromaticContact CZ-CD1 3.62Å; F455-W482 HydrophobicContact CZ-CD2 4.37Å; F455-W482 AromaticContact CZ-CG 3.77Å; F455-W482 HydrophobicContact CZ-CG 3.77Å; F455-V489 HydrophobicContact CE1-CG2 3.66Å; F455-V489 HydrophobicContact CZ-CG2 3.86Å
456	N	92.5	Very high	89	Confident	56 Å²	56	50.1 Å²	50.1	30%	0.299	26%	0.26	S	S	.	.	S	Bend	trans	-77.1	77.3	167.2	-173.4	-9.5	0	0	0	108.9	L432 T474 R475	L432-N456 HydrophobicContact CD2-CB 3.89Å; N456-T474 CarbonylContact O-C 3.56Å; N456-T474 WeakPolarHBondContact O-CA 3.46Å; N456-T474 VanDerWaalsContact O-CB 3.29Å; N456-T474 WeakPolarHBondContact O-CB 3.38Å; N456-R475 PolarHBondContact O-N 3.36Å; N456-R475 WeakPolarHBondContact OD1-CD 3.46Å
457	A	92.4	Very high	89.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-151.1	167.8	-169.9	0	0	0	0	0	110	A433 F455 T472 G473	A433-A457 WeakPolarHBondContact CB-O 3.28Å; F455-A457 HydrophobicContact CB-CB 3.95Å; F455-A457 PolarHBondContact O-N 2.91Å; A457-T472 HydrophobicContact CB-CG2 3.68Å; A457-G473 WeakPolarHBondContact CB-O 3.38Å
458	K	90.8	Very high	89.7	Confident	71 Å²	71	49.8 Å²	49.8	31%	0.309	25%	0.248	S	C	.	.			trans	-87.2	140.8	159.4	-68.2	179.5	178.4	174.2	0	108.1	E460 A461	K458-E460 PolarHBondContact O-N 3.34Å; K458-A461 WeakPolarHBondContact O-CB 3.21Å; K458-A461 PolarHBondContact O-N 2.95Å
459	A	90.4	Very high	90.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-57.6	-36.2	-179.1	0	0	0	0	0	112.8	Y411 N426 A433 F435 A461 T462	Y411-A459 HydrophobicContact CG-CB 4.36Å; N426-A459 VanDerWaalsContact OD1-CB 3.28Å; N426-A459 WeakPolarHBondContact OD1-CB 3.28Å; N426-A459 PolarHBondContact OD1-N 2.81Å; A433-A459 HydrophobicContact CB-CB 4.3Å; F435-A459 HydrophobicContact CE1-CB 4.21Å; F435-A459 HydrophobicContact CZ-CB 4.24Å; A459-A461 PolarHBondContact O-N 3.25Å; A459-T462 VanDerWaalsContact O-CB 3.31Å; A459-T462 WeakPolarHBondContact O-CB 3.32Å; A459-T462 PolarHBondContact O-N 3.36Å; A459-T462 PolarHBondContact O-OG1 3.29Å
460	E	90.1	Very high	90.8	Very high	121 Å²	121	41.3 Å²	41.3	57%	0.565	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-65.4	-19.9	177.6	-61.5	170.7	-167.3	0	0	114.1	K458 T462	K458-E460 PolarHBondContact O-N 3.34Å; E460-T462 PolarHBondContact O-N 3.13Å; E460-T462 VanDerWaalsContact O-N 3.11Å
461	A	92.9	Very high	91.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-82	27.5	175.1	0	0	0	0	0	112	K458 A459 G473 I514 V517	K458-A461 WeakPolarHBondContact O-CB 3.21Å; K458-A461 PolarHBondContact O-N 2.95Å; A459-A461 PolarHBondContact O-N 3.25Å; A461-G473 PolarHBondContact O-N 3.28Å; A461-I514 WeakPolarHBondContact CB-O 3.27Å; A461-V517 WeakPolarHBondContact O-CG2 3.08Å
462	T	94.6	Very high	92	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.6	178.6	-58.9	0	0	0	0	110.1	Y411 F435 A459 E460 A470 V471 T472	Y411-T462 HydrophobicContact CE1-CG2 4.5Å; Y411-T462 PolarHBondContact OH-O 3.3Å; F435-T462 HydrophobicContact CE1-CG2 4.03Å; F435-T462 WeakPolarHBondContact CE1-OG1 3.32Å; F435-T462 HydrophobicContact CZ-CG2 4.33Å; F435-T462 WeakPolarHBondContact CZ-OG1 3.36Å; A459-T462 VanDerWaalsContact O-CB 3.31Å; A459-T462 WeakPolarHBondContact O-CB 3.32Å; A459-T462 PolarHBondContact O-N 3.36Å; A459-T462 PolarHBondContact O-OG1 3.29Å; E460-T462 PolarHBondContact O-N 3.13Å; E460-T462 VanDerWaalsContact O-N 3.11Å; T462-A470 HydrophobicContact CG2-CB 4.37Å; T462-V471 CarbonylContact C-O 3.52Å; T462-V471 VanDerWaalsContact CA-O 3.27Å; T462-V471 WeakPolarHBondContact CA-O 3.39Å; T462-T472 VanDerWaalsContact CG2-OG1 3.29Å; T462-T472 WeakPolarHBondContact CG2-OG1 3.46Å; T462-T472 WeakPolarHBondContact OG1-CG2 3.44Å; T462-T472 PolarHBondContact OG1-OG1 2.83Å
463	E	93.7	Very high	92.4	Very high	15 Å²	15	28 Å²	28	7%	0.07	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	139.6	174.1	-168.3	73.9	-160.5	0	0	108.8	A470 V471 V517 K518 L519	E463-A470 WeakPolarHBondContact O-CA 3.09Å; E463-V471 PolarHBondContact N-O 2.5Å; E463-V471 PolarHBondContact O-N 3.24Å; E463-V517 HydrophobicContact CB-CB 4.33Å; E463-V517 HydrophobicContact CB-CG1 4Å; E463-K518 IonicContact OE2-NZ 2.82Å; E463-K518 PolarHBondContact OE2-NZ 3.14Å; E463-L519 HydrophobicContact CG-CB 3.97Å
464	I	93.4	Very high	92.6	Very high	6 Å²	6	27.1 Å²	27.1	3%	0.031	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.3	178.2	-62.3	168.2	0	0	0	108.7	N413 I414 V422 E469 A470 L484	N413-I464 HydrophobicContact CB-CD1 3.9Å; I414-I464 VanDerWaalsContact C-CD1 3.4Å; I414-I464 WeakPolarHBondContact O-CD1 3.36Å; V422-I464 HydrophobicContact CB-CD1 4.19Å; V422-I464 HydrophobicContact CG2-CD1 3.68Å; V422-I464 HydrophobicContact CG2-CG1 4.15Å; I464-E469 WeakPolarHBondContact CG2-O 3.49Å; I464-A470 HydrophobicContact CG1-CB 4.31Å; I464-L484 HydrophobicContact CG2-CD1 4Å
465	I	91.3	Very high	92.7	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.031	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	119.1	178.5	57.3	157.2	0	0	0	110	E469 V471 V481 L519 L526 M540	I465-E469 CarbonylContact C-O 3.57Å; I465-E469 HydrophobicContact CD1-CB 4.13Å; I465-E469 HydrophobicContact CG1-CB 3.74Å; I465-E469 PolarHBondContact N-O 2.88Å; I465-E469 CarbonylContact O-C 3.57Å; I465-E469 WeakPolarHBondContact O-CB 3.26Å; I465-E469 PolarHBondContact O-N 3.23Å; I465-V471 HydrophobicContact CB-CG2 4.3Å; I465-V471 HydrophobicContact CD1-CG2 3.37Å; I465-V471 HydrophobicContact CG1-CG2 3.63Å; I465-V471 HydrophobicContact CG2-CG2 3.66Å; I465-V481 HydrophobicContact CD1-CG1 3.8Å; I465-V481 HydrophobicContact CD1-CG2 4.47Å; I465-L519 HydrophobicContact CG2-CD1 4.09Å; I465-L519 HydrophobicContact CG2-CD2 4.19Å; I465-L526 HydrophobicContact CG2-CD1 4.23Å; I465-M540 HydrophobicContact CB-CE 4.42Å; I465-M540 HydrophobicContact CD1-CE 3.52Å; I465-M540 HydrophobicContact CG2-CE 4.47Å
466	G	87.7	Confident	92.7	Very high	33 Å²	33	35 Å²	35	34%	0.34	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	-150.9	-174.1	0	0	0	0	0	112.6	L416	L416-G466 WeakPolarHBondContact CD1-O 3.47Å; L416-G466 WeakPolarHBondContact CG-O 3.33Å
467	N	88.3	Confident	92.7	Very high	79 Å²	79	32.3 Å²	32.3	42%	0.422	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-37.4	-174.5	-61.8	-2.4	0	0	0	112.6	S415	S415-N467 VanDerWaalsContact CB-O 3.28Å; S415-N467 WeakPolarHBondContact CB-O 3.33Å
468	D	92	Very high	92.9	Very high	57 Å²	57	34.9 Å²	34.9	31%	0.305	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.1	6	-169.2	-60	-34.6	0	0	0	113.9	N483 L484 L485	D468-N483 CarbonylContact O-C 3.59Å; D468-N483 WeakPolarHBondContact O-CA 3.42Å; D468-N483 PolarHBondContact O-ND2 3.31Å; D468-L484 PolarHBondContact O-N 2.87Å; D468-L485 HydrophobicContact CB-CD1 4.29Å
469	E	94.3	Very high	93.1	Very high	46 Å²	46	31.5 Å²	31.5	22%	0.215	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	151	-177.1	-63.8	-171.5	153.2	0	0	111.1	I464 I465 V481 W482 R491	I464-E469 WeakPolarHBondContact CG2-O 3.49Å; I465-E469 CarbonylContact C-O 3.57Å; I465-E469 HydrophobicContact CD1-CB 4.13Å; I465-E469 HydrophobicContact CG1-CB 3.74Å; I465-E469 PolarHBondContact N-O 2.88Å; I465-E469 CarbonylContact O-C 3.57Å; I465-E469 WeakPolarHBondContact O-CB 3.26Å; I465-E469 PolarHBondContact O-N 3.23Å; E469-V481 HydrophobicContact CB-CG1 4.23Å; E469-W482 CarbonylContact C-O 3.55Å; E469-W482 WeakPolarHBondContact CA-O 3.18Å; E469-R491 IonicContact OE1-CZ 3.87Å; E469-R491 IonicContact OE1-NH1 3.34Å; E469-R491 PolarHBondContact OE1-NH1 2.89Å; E469-R491 IonicContact OE1-NH2 2.75Å; E469-R491 IonicContact OE2-CZ 3.34Å; E469-R491 IonicContact OE2-NH1 3.49Å; E469-R491 PolarHBondContact OE2-NH1 2.84Å; E469-R491 IonicContact OE2-NH2 3.21Å; E469-R491 PolarHBondContact OE2-NH2 2.86Å
470	A	95.3	Very high	93.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.9	171.3	0	0	0	0	0	110.4	T462 E463 I464 V481 W482 L484	T462-A470 HydrophobicContact CG2-CB 4.37Å; E463-A470 WeakPolarHBondContact O-CA 3.09Å; I464-A470 HydrophobicContact CG1-CB 4.31Å; A470-V481 CarbonylContact O-C 3.45Å; A470-V481 VanDerWaalsContact O-CA 3.32Å; A470-V481 WeakPolarHBondContact O-CA 3.43Å; A470-W482 HydrophobicContact CB-CD2 4.37Å; A470-W482 HydrophobicContact CB-CZ2 3.94Å; A470-W482 PolarHBondContact N-O 3.39Å; A470-W482 PolarHBondContact O-N 2.8Å; A470-L484 HydrophobicContact CB-CD2 3.7Å; A470-L484 HydrophobicContact CB-CG 4.42Å
471	V	95.8	Very high	93.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.2	174.9	-172.5	0	0	0	0	109.2	T462 E463 I465 L479 F480 V481 I493 L526	T462-V471 CarbonylContact C-O 3.52Å; T462-V471 VanDerWaalsContact CA-O 3.27Å; T462-V471 WeakPolarHBondContact CA-O 3.39Å; E463-V471 PolarHBondContact N-O 2.5Å; E463-V471 PolarHBondContact O-N 3.24Å; I465-V471 HydrophobicContact CB-CG2 4.3Å; I465-V471 HydrophobicContact CD1-CG2 3.37Å; I465-V471 HydrophobicContact CG1-CG2 3.63Å; I465-V471 HydrophobicContact CG2-CG2 3.66Å; V471-L479 HydrophobicContact CG1-CB 4.2Å; V471-L479 HydrophobicContact CG1-CD2 3.88Å; V471-F480 WeakPolarHBondContact CA-O 3.26Å; V471-V481 HydrophobicContact CG2-CG2 4Å; V471-I493 HydrophobicContact CG1-CD1 4.27Å; V471-L526 HydrophobicContact CG1-CD2 4.21Å; V471-L526 HydrophobicContact CG2-CD2 4.44Å
472	T	96.5	Very high	93.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.4	174.7	-62.1	0	0	0	0	109.8	F435 F455 A457 T462 F480 W482	F435-T472 HydrophobicContact CE2-CG2 4.2Å; F435-T472 HydrophobicContact CZ-CG2 4.32Å; F455-T472 HydrophobicContact CB-CG2 4Å; F455-T472 HydrophobicContact CD2-CG2 3.98Å; F455-T472 HydrophobicContact CG-CG2 3.99Å; A457-T472 HydrophobicContact CB-CG2 3.68Å; T462-T472 VanDerWaalsContact CG2-OG1 3.29Å; T462-T472 WeakPolarHBondContact CG2-OG1 3.46Å; T462-T472 WeakPolarHBondContact OG1-CG2 3.44Å; T462-T472 PolarHBondContact OG1-OG1 2.83Å; T472-F480 PolarHBondContact N-O 2.94Å; T472-F480 PolarHBondContact O-N 2.81Å; T472-W482 PolarHBondContact OG1-NE1 2.8Å
473	G	95.4	Very high	93.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.1	171.9	0	0	0	0	0	111.9	A457 A461 E478	A457-G473 WeakPolarHBondContact CB-O 3.38Å; A461-G473 PolarHBondContact O-N 3.28Å; G473-E478 CarbonylContact C-O 3.57Å; G473-E478 WeakPolarHBondContact CA-O 3.33Å
474	T	94.9	Very high	93.7	Very high	5 Å²	5	28.2 Å²	28.2	3%	0.031	14%	0.136	C	C	.	.			trans	-90.6	165.6	-177.7	73.8	0	0	0	0	113	N456 R476 G477 E478 F480 I514	N456-T474 CarbonylContact O-C 3.56Å; N456-T474 WeakPolarHBondContact O-CA 3.46Å; N456-T474 VanDerWaalsContact O-CB 3.29Å; N456-T474 WeakPolarHBondContact O-CB 3.38Å; T474-R476 PolarHBondContact O-N 3.06Å; T474-R476 PolarHBondContact OG1-N 3.21Å; T474-G477 PolarHBondContact O-N 3.22Å; T474-G477 VanDerWaalsContact O-N 3.14Å; T474-E478 HydrophobicContact CG2-CB 4.23Å; T474-E478 PolarHBondContact N-O 2.95Å; T474-E478 WeakPolarHBondContact OG1-CB 3.5Å; T474-E478 PolarHBondContact OG1-N 2.75Å; T474-E478 PolarHBondContact OG1-O 2.82Å; T474-F480 HydrophobicContact CG2-CD2 3.54Å; T474-F480 HydrophobicContact CG2-CE2 3.68Å; T474-I514 PolarHBondContact O-N 3.1Å
475	R	93	Very high	93.6	Very high	68 Å²	68	31.8 Å²	31.8	26%	0.257	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.6	169.3	-63	-170.6	-169.6	-95.4	2	113.7	E431 N456 T513	E431-R475 PolarHBondContact O-NE 2.91Å; N456-R475 PolarHBondContact O-N 3.36Å; N456-R475 WeakPolarHBondContact OD1-CD 3.46Å; R475-T513 HydrophobicContact CB-CG2 4.43Å; R475-T513 HydrophobicContact CG-CG2 4.2Å; R475-T513 WeakPolarHBondContact O-CA 3.5Å; R475-T513 PolarHBondContact O-N 3.21Å; R475-T513 PolarHBondContact O-OG1 3.01Å
476	R	92.2	Very high	93.5	Very high	172 Å²	172	35.1 Å²	35.1	65%	0.649	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	1	177	-63.9	-175.3	176.3	-172.3	-0.5	113.3	T474 E478	T474-R476 PolarHBondContact O-N 3.06Å; T474-R476 PolarHBondContact OG1-N 3.21Å; R476-E478 HydrophobicContact CB-CG 4.31Å
477	G	92.8	Very high	93.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	79.8	19.1	-176.9	0	0	0	0	0	114.1	T474 P509 H510 E512	T474-G477 PolarHBondContact O-N 3.22Å; T474-G477 VanDerWaalsContact O-N 3.14Å; G477-P509 WeakPolarHBondContact O-CB 3.42Å; G477-P509 WeakPolarHBondContact O-CD 3.41Å; G477-H510 WeakPolarHBondContact CA-O 3.35Å; G477-H510 PolarHBondContact O-N 2.77Å; G477-E512 WeakPolarHBondContact CA-O 3.49Å; G477-E512 PolarHBondContact N-O 2.91Å
478	E	95.1	Very high	93.8	Very high	53 Å²	53	39.8 Å²	39.8	25%	0.248	19%	0.185	C	C	.	.			trans	-95.1	145	176.4	-56.3	171.8	138.2	0	0	110.3	G473 T474 R476 F480 I514	G473-E478 CarbonylContact C-O 3.57Å; G473-E478 WeakPolarHBondContact CA-O 3.33Å; T474-E478 HydrophobicContact CG2-CB 4.23Å; T474-E478 PolarHBondContact N-O 2.95Å; T474-E478 WeakPolarHBondContact OG1-CB 3.5Å; T474-E478 PolarHBondContact OG1-N 2.75Å; T474-E478 PolarHBondContact OG1-O 2.82Å; R476-E478 HydrophobicContact CB-CG 4.31Å; E478-F480 HydrophobicContact CB-CE2 4Å; E478-F480 HydrophobicContact CB-CZ 4.28Å; E478-I514 WeakPolarHBondContact O-CD1 3.46Å
479	L	95.6	Very high	93.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.8	174.1	-72.4	166.8	0	0	0	108.9	V471 Q492 I493 P509 I514 V517 T528 W538	V471-L479 HydrophobicContact CG1-CB 4.2Å; V471-L479 HydrophobicContact CG1-CD2 3.88Å; L479-Q492 CarbonylContact O-C 3.58Å; L479-Q492 VanDerWaalsContact O-CA 3.31Å; L479-Q492 WeakPolarHBondContact O-CA 2.9Å; L479-Q492 WeakPolarHBondContact O-CG 3.34Å; L479-I493 HydrophobicContact CB-CB 3.93Å; L479-I493 HydrophobicContact CB-CD1 4.4Å; L479-I493 HydrophobicContact CB-CG1 4.43Å; L479-I493 HydrophobicContact CD1-CB 4.28Å; L479-I493 HydrophobicContact CD1-CD1 4.47Å; L479-I493 HydrophobicContact CD1-CG2 4.32Å; L479-I493 PolarHBondContact O-N 2.84Å; L479-P509 HydrophobicContact CB-CG 4.05Å; L479-P509 HydrophobicContact CD1-CB 3.65Å; L479-P509 HydrophobicContact CD1-CG 3.94Å; L479-P509 HydrophobicContact CG-CB 3.96Å; L479-P509 HydrophobicContact CG-CG 4.05Å; L479-I514 HydrophobicContact CD2-CD1 3.76Å; L479-I514 HydrophobicContact CG-CD1 3.86Å; L479-V517 HydrophobicContact CD2-CG2 4.06Å; L479-T528 HydrophobicContact CD1-CG2 3.87Å; L479-T528 HydrophobicContact CD2-CG2 3.86Å; L479-T528 HydrophobicContact CG-CG2 4.49Å; L479-W538 HydrophobicContact CD1-CZ2 3.97Å
480	F	95.5	Very high	93.8	Very high	40 Å²	40	43 Å²	43	18%	0.175	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124	176.2	-72.2	-63.1	0	0	0	110.5	F455 V471 T472 T474 E478 V489 Q492	F455-F480 HydrophobicContact CD1-CB 4.42Å; F455-F480 HydrophobicContact CD1-CD2 4.04Å; F455-F480 HydrophobicContact CE1-CB 3.76Å; F455-F480 HydrophobicContact CE1-CD2 4.05Å; F455-F480 HydrophobicContact CE1-CG 4.08Å; F455-F480 HydrophobicContact CZ-CB 4.36Å; V471-F480 WeakPolarHBondContact CA-O 3.26Å; T472-F480 PolarHBondContact N-O 2.94Å; T472-F480 PolarHBondContact O-N 2.81Å; T474-F480 HydrophobicContact CG2-CD2 3.54Å; T474-F480 HydrophobicContact CG2-CE2 3.68Å; E478-F480 HydrophobicContact CB-CE2 4Å; E478-F480 HydrophobicContact CB-CZ 4.28Å; F480-V489 HydrophobicContact CB-CG1 4.19Å; F480-V489 HydrophobicContact CD1-CG1 3.6Å; F480-V489 HydrophobicContact CE1-CG1 4.4Å; F480-V489 HydrophobicContact CG-CG1 4.21Å; F480-Q492 HydrophobicContact CD1-CB 4.01Å; F480-Q492 HydrophobicContact CD1-CG 4.06Å; F480-Q492 HydrophobicContact CE1-CB 3.97Å; F480-Q492 HydrophobicContact CE1-CG 3.87Å
481	V	95.7	Very high	93.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.4	166.4	-173.6	0	0	0	0	108	I465 E469 A470 V471 M490 R491 I493	I465-V481 HydrophobicContact CD1-CG1 3.8Å; I465-V481 HydrophobicContact CD1-CG2 4.47Å; E469-V481 HydrophobicContact CB-CG1 4.23Å; A470-V481 CarbonylContact O-C 3.45Å; A470-V481 VanDerWaalsContact O-CA 3.32Å; A470-V481 WeakPolarHBondContact O-CA 3.43Å; V471-V481 HydrophobicContact CG2-CG2 4Å; V481-M490 PolarHBondContact O-N 2.78Å; V481-R491 HydrophobicContact CB-CG 3.75Å; V481-R491 HydrophobicContact CG1-CG 4.41Å; V481-R491 HydrophobicContact CG2-CG 3.99Å; V481-R491 PolarHBondContact N-O 2.8Å; V481-R491 PolarHBondContact O-N 2.78Å; V481-I493 HydrophobicContact CG2-CD1 3.98Å; V481-I493 HydrophobicContact CG2-CG1 3.81Å
482	W	96.1	Very high	93.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150.3	-179.9	61.3	-78.7	0	0	0	110.7	V422 F435 V437 I453 F455 E469 A470 T472 L484 R488 V489	V422-W482 HydrophobicContact CG1-CH2 3.98Å; V422-W482 HydrophobicContact CG1-CZ2 4.2Å; F435-W482 HydrophobicContact CB-CH2 3.79Å; F435-W482 HydrophobicContact CB-CZ2 4.01Å; F435-W482 HydrophobicContact CD1-CZ2 4.33Å; F435-W482 HydrophobicContact CG-CH2 4.33Å; F435-W482 HydrophobicContact CG-CZ2 4.05Å; V437-W482 HydrophobicContact CG2-CH2 3.89Å; V437-W482 HydrophobicContact CG2-CZ3 3.78Å; I453-W482 HydrophobicContact CD1-CB 4.34Å; I453-W482 HydrophobicContact CG2-CD2 4.25Å; I453-W482 HydrophobicContact CG2-CE3 3.84Å; I453-W482 HydrophobicContact CG2-CH2 4.05Å; I453-W482 HydrophobicContact CG2-CZ2 4.44Å; I453-W482 HydrophobicContact CG2-CZ3 3.72Å; F455-W482 AromaticContact CE2-CD1 3.69Å; F455-W482 HydrophobicContact CE2-CD2 4.12Å; F455-W482 AromaticContact CE2-CE2 3.97Å; F455-W482 AromaticContact CE2-CG 3.95Å; F455-W482 HydrophobicContact CE2-CG 3.95Å; F455-W482 AromaticContact CE2-NE1 3.67Å; F455-W482 HydrophobicContact CZ-CB 4.06Å; F455-W482 AromaticContact CZ-CD1 3.62Å; F455-W482 HydrophobicContact CZ-CD2 4.37Å; F455-W482 AromaticContact CZ-CG 3.77Å; F455-W482 HydrophobicContact CZ-CG 3.77Å; E469-W482 CarbonylContact C-O 3.55Å; E469-W482 WeakPolarHBondContact CA-O 3.18Å; A470-W482 HydrophobicContact CB-CD2 4.37Å; A470-W482 HydrophobicContact CB-CZ2 3.94Å; A470-W482 PolarHBondContact N-O 3.39Å; A470-W482 PolarHBondContact O-N 2.8Å; T472-W482 PolarHBondContact OG1-NE1 2.8Å; W482-L484 HydrophobicContact CE3-CD2 4.16Å; W482-L484 HydrophobicContact CH2-CD2 3.56Å; W482-L484 HydrophobicContact CZ2-CD2 4.03Å; W482-L484 HydrophobicContact CZ3-CD2 3.63Å; W482-R488 CarbonylContact C-O 3.56Å; W482-R488 VanDerWaalsContact CA-O 3.24Å; W482-R488 WeakPolarHBondContact CA-O 3.41Å; W482-R488 WeakPolarHBondContact CB-O 3.08Å; W482-V489 HydrophobicContact CB-CG2 4.48Å
483	N	94.8	Very high	93.4	Very high	23 Å²	23	49.6 Å²	49.6	12%	0.123	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.9	-177.7	175	-76.2	0	0	0	110	D468 L485 T486 G487 R488 M490	D468-N483 CarbonylContact O-C 3.59Å; D468-N483 WeakPolarHBondContact O-CA 3.42Å; D468-N483 PolarHBondContact O-ND2 3.31Å; N483-L485 WeakPolarHBondContact OD1-CB 3.36Å; N483-L485 PolarHBondContact OD1-N 3.28Å; N483-T486 WeakPolarHBondContact CB-OG1 3.36Å; N483-T486 PolarHBondContact OD1-N 2.89Å; N483-T486 PolarHBondContact OD1-OG1 3.27Å; N483-T486 VanDerWaalsContact OD1-OG1 3.08Å; N483-G487 WeakPolarHBondContact O-CA 3.47Å; N483-G487 PolarHBondContact O-N 3.11Å; N483-R488 PolarHBondContact N-O 2.85Å; N483-M490 HydrophobicContact CB-CG 3.62Å; N483-M490 HydrophobicContact CB-SD 3.81Å
484	L	91.8	Very high	93.2	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.021	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-37.3	-174.6	-64	-177.3	0	0	0	112.6	L420 V422 V437 I464 D468 A470 W482	L420-L484 HydrophobicContact CB-CD1 4.32Å; L420-L484 HydrophobicContact CD1-CB 3.74Å; L420-L484 HydrophobicContact CD1-CD1 4.15Å; V422-L484 HydrophobicContact CG2-CD1 4.04Å; V422-L484 HydrophobicContact CG2-CD2 3.48Å; V422-L484 VanDerWaalsContact CG2-CD2 3.48Å; V422-L484 HydrophobicContact CG2-CG 4.37Å; V437-L484 HydrophobicContact CG1-CB 4.17Å; V437-L484 WeakPolarHBondContact CG1-O 3.23Å; V437-L484 HydrophobicContact CG2-CB 4.49Å; V437-L484 HydrophobicContact CG2-CD2 4.18Å; I464-L484 HydrophobicContact CG2-CD1 4Å; D468-L484 PolarHBondContact O-N 2.87Å; A470-L484 HydrophobicContact CB-CD2 3.7Å; A470-L484 HydrophobicContact CB-CG 4.42Å; W482-L484 HydrophobicContact CE3-CD2 4.16Å; W482-L484 HydrophobicContact CH2-CD2 3.56Å; W482-L484 HydrophobicContact CZ2-CD2 4.03Å; W482-L484 HydrophobicContact CZ3-CD2 3.63Å
485	L	91	Very high	92.9	Very high	81 Å²	81	53.8 Å²	53.8	42%	0.424	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-42	-178.9	-64.7	169.4	0	0	0	112.3	L420 D468 N483	L420-L485 HydrophobicContact CD1-CD2 3.8Å; L420-L485 HydrophobicContact CD1-CG 4.03Å; L420-L485 HydrophobicContact CD2-CD2 3.88Å; L420-L485 HydrophobicContact CG-CD2 4.48Å; D468-L485 HydrophobicContact CB-CD1 4.29Å; N483-L485 WeakPolarHBondContact OD1-CB 3.36Å; N483-L485 PolarHBondContact OD1-N 3.28Å
486	T	89.9	Confident	92.5	Very high	76 Å²	76	54.8 Å²	54.8	47%	0.466	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-21.7	-176.1	61.9	0	0	0	0	113.2	N483 R488	N483-T486 WeakPolarHBondContact CB-OG1 3.36Å; N483-T486 PolarHBondContact OD1-N 2.89Å; N483-T486 PolarHBondContact OD1-OG1 3.27Å; N483-T486 VanDerWaalsContact OD1-OG1 3.08Å; T486-R488 VanDerWaalsContact C-N 3.3Å
487	G	89	Confident	92.1	Very high	26 Å²	26	48 Å²	48	27%	0.268	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	33	-174.3	0	0	0	0	0	112.6	N483	N483-G487 WeakPolarHBondContact O-CA 3.47Å; N483-G487 PolarHBondContact O-N 3.11Å
488	R	93	Very high	91.6	Very high	184 Å²	184	53.4 Å²	53.4	69%	0.694	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.4	-177.9	-67.6	-176.6	179.6	-120.1	-0.4	111.4	W482 N483 T486 M490	W482-R488 CarbonylContact C-O 3.56Å; W482-R488 VanDerWaalsContact CA-O 3.24Å; W482-R488 WeakPolarHBondContact CA-O 3.41Å; W482-R488 WeakPolarHBondContact CB-O 3.08Å; N483-R488 PolarHBondContact N-O 2.85Å; T486-R488 VanDerWaalsContact C-N 3.3Å; R488-M490 PolarHBondContact O-N 2.86Å
489	V	94.3	Very high	90.9	Very high	67 Å²	67	55.5 Å²	55.5	41%	0.406	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	123	168.9	-176.5	0	0	0	0	108.8	I453 F455 F480 W482	I453-V489 HydrophobicContact CD1-CG2 3.95Å; F455-V489 HydrophobicContact CE1-CG2 3.66Å; F455-V489 HydrophobicContact CZ-CG2 3.86Å; F480-V489 HydrophobicContact CB-CG1 4.19Å; F480-V489 HydrophobicContact CD1-CG1 3.6Å; F480-V489 HydrophobicContact CE1-CG1 4.4Å; F480-V489 HydrophobicContact CG-CG1 4.21Å; W482-V489 HydrophobicContact CB-CG2 4.48Å
490	M	92.9	Very high	90.1	Very high	103 Å²	103	65.7 Å²	65.7	51%	0.507	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-46.9	178.5	-67.2	-63.1	-68.6	0	0	110.8	V481 N483 R488	V481-M490 PolarHBondContact O-N 2.78Å; N483-M490 HydrophobicContact CB-CG 3.62Å; N483-M490 HydrophobicContact CB-SD 3.81Å; R488-M490 PolarHBondContact O-N 2.86Å
491	R	93.9	Very high	89.5	Confident	83 Å²	83	67 Å²	67	31%	0.313	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	166.8	-174.6	58.4	-170.7	-177.7	-80.7	-3.5	111	E469 V481 E543	E469-R491 IonicContact OE1-CZ 3.87Å; E469-R491 IonicContact OE1-NH1 3.34Å; E469-R491 PolarHBondContact OE1-NH1 2.89Å; E469-R491 IonicContact OE1-NH2 2.75Å; E469-R491 IonicContact OE2-CZ 3.34Å; E469-R491 IonicContact OE2-NH1 3.49Å; E469-R491 PolarHBondContact OE2-NH1 2.84Å; E469-R491 IonicContact OE2-NH2 3.21Å; E469-R491 PolarHBondContact OE2-NH2 2.86Å; V481-R491 HydrophobicContact CB-CG 3.75Å; V481-R491 HydrophobicContact CG1-CG 4.41Å; V481-R491 HydrophobicContact CG2-CG 3.99Å; V481-R491 PolarHBondContact N-O 2.8Å; V481-R491 PolarHBondContact O-N 2.78Å; R491-E543 WeakPolarHBondContact CD-OE2 3.26Å; R491-E543 IonicContact CZ-OE1 3.17Å; R491-E543 VanDerWaalsContact NE-CD 3.27Å; R491-E543 IonicContact NE-OE1 3.65Å; R491-E543 PolarHBondContact NE-OE1 3.45Å; R491-E543 IonicContact NE-OE2 3.1Å; R491-E543 PolarHBondContact NE-OE2 3.06Å; R491-E543 VanDerWaalsContact NE-OE2 3.09Å; R491-E543 IonicContact NH2-OE1 3.49Å; R491-E543 PolarHBondContact NH2-OE1 3.03Å
492	Q	92.8	Very high	88.8	Confident	54 Å²	54	69.9 Å²	69.9	25%	0.252	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.6	174.1	-173.5	-177.1	-11.1	0	0	108.1	L479 F480 Q494	L479-Q492 CarbonylContact O-C 3.58Å; L479-Q492 VanDerWaalsContact O-CA 3.31Å; L479-Q492 WeakPolarHBondContact O-CA 2.9Å; L479-Q492 WeakPolarHBondContact O-CG 3.34Å; F480-Q492 HydrophobicContact CD1-CB 4.01Å; F480-Q492 HydrophobicContact CD1-CG 4.06Å; F480-Q492 HydrophobicContact CE1-CB 3.97Å; F480-Q492 HydrophobicContact CE1-CG 3.87Å; Q492-Q494 HydrophobicContact CB-CG 4.28Å; Q492-Q494 HydrophobicContact CG-CG 3.89Å; Q492-Q494 PolarHBondContact O-N 2.83Å
493	I	92.5	Very high	88.2	Confident	2 Å²	2	75.3 Å²	75.3	1%	0.01	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	129.6	170.6	-58.6	174.4	0	0	0	106.3	V471 L479 V481 P509 L526 W538 E543	V471-I493 HydrophobicContact CG1-CD1 4.27Å; L479-I493 HydrophobicContact CB-CB 3.93Å; L479-I493 HydrophobicContact CB-CD1 4.4Å; L479-I493 HydrophobicContact CB-CG1 4.43Å; L479-I493 HydrophobicContact CD1-CB 4.28Å; L479-I493 HydrophobicContact CD1-CD1 4.47Å; L479-I493 HydrophobicContact CD1-CG2 4.32Å; L479-I493 PolarHBondContact O-N 2.84Å; V481-I493 HydrophobicContact CG2-CD1 3.98Å; V481-I493 HydrophobicContact CG2-CG1 3.81Å; I493-P509 WeakPolarHBondContact O-CD 3.34Å; I493-P509 WeakPolarHBondContact O-CG 3.47Å; I493-L526 HydrophobicContact CD1-CD2 4.06Å; I493-W538 HydrophobicContact CG2-CD2 4.09Å; I493-W538 HydrophobicContact CG2-CE3 3.49Å; I493-W538 VanDerWaalsContact CG2-CE3 3.49Å; I493-W538 HydrophobicContact CG2-CH2 4.18Å; I493-W538 HydrophobicContact CG2-CZ3 3.53Å; I493-E543 HydrophobicContact CD1-CG 4.07Å; I493-E543 HydrophobicContact CG1-CB 4.22Å; I493-E543 HydrophobicContact CG1-CG 3.97Å; I493-E543 HydrophobicContact CG2-CB 4.37Å
494	Q	90.6	Very high	87.7	Confident	65 Å²	65	80.2 Å²	80.2	30%	0.304	45%	0.451	S	S	.	.			trans	-143.3	158.4	-176.6	-67.2	-178.2	-27.1	0	0	109.9	Q492 M506	Q492-Q494 HydrophobicContact CB-CG 4.28Å; Q492-Q494 HydrophobicContact CG-CG 3.89Å; Q492-Q494 PolarHBondContact O-N 2.83Å; Q494-M506 HydrophobicContact CB-CE 3.43Å; Q494-M506 VanDerWaalsContact CB-CE 3.43Å; Q494-M506 HydrophobicContact CG-CE 4.41Å
495	I	88.9	Confident	87.4	Confident	28 Å²	28	82.2 Å²	82.2	14%	0.144	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120.3	176.8	-61.5	160.8	0	0	0	108.3	L507 W538 L545	I495-L507 HydrophobicContact CB-CB 4.3Å; I495-L507 PolarHBondContact N-O 3.42Å; I495-L507 PolarHBondContact O-N 2.85Å; I495-W538 HydrophobicContact CD1-CH2 3.82Å; I495-W538 HydrophobicContact CG1-CH2 3.57Å; I495-W538 HydrophobicContact CG1-CZ3 3.81Å; I495-L545 HydrophobicContact CD1-CD2 3.76Å; I495-L545 HydrophobicContact CG1-CB 4.24Å; I495-L545 HydrophobicContact CG1-CD2 4.04Å; I495-L545 HydrophobicContact CG2-CD2 4.4Å
496	S	85.2	Confident	87.1	Confident	90 Å²	90	83.1 Å²	83.1	63%	0.629	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	115.1	173.4	38.2	0	0	0	0	110.2
497	A	82.9	Confident	87	Confident	30 Å²	30	83.7 Å²	83.7	25%	0.248	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140.3	175.1	0	0	0	0	0	110.6	L504 T505 L507	A497-L504 WeakPolarHBondContact O-CA 3.36Å; A497-T505 PolarHBondContact N-O 2.95Å; A497-T505 PolarHBondContact O-N 2.78Å; A497-T505 PolarHBondContact O-OG1 2.7Å; A497-L507 HydrophobicContact CB-CD1 3.96Å
498	T	82.1	Confident	86.9	Confident	113 Å²	113	85.1 Å²	85.1	69%	0.693	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	118.1	173.2	51.5	0	0	0	0	109.7	L504	T498-L504 HydrophobicContact CG2-CD2 3.54Å
499	L	79.9	Confident	86.8	Confident	96 Å²	96	76.4 Å²	76.4	50%	0.503	44%	0.438	S	S	.	.			trans	-75.9	163.4	173	-68.9	166.5	0	0	0	111.6	G501 G502 N503 T505	L499-G501 PolarHBondContact O-N 3.43Å; L499-G502 PolarHBondContact O-N 3.39Å; L499-N503 HydrophobicContact CD1-CB 4.49Å; L499-N503 PolarHBondContact N-O 3.22Å; L499-T505 HydrophobicContact CD1-CG2 3.36Å; L499-T505 HydrophobicContact CG-CG2 4.04Å
500	E	79.9	Confident	86.8	Confident	214 Å²	214	73.2 Å²	73.2	100%	1	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-21.5	-179.9	-65	-175.8	161	0	0	114.4
501	G	81.7	Confident	86.7	Confident	67 Å²	67	73.1 Å²	73.1	69%	0.691	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	6.8	176.2	0	0	0	0	0	115.8	L499 N503	L499-G501 PolarHBondContact O-N 3.43Å; G501-N503 PolarHBondContact O-N 3.01Å
502	G	81.8	Confident	86.8	Confident	61 Å²	61	72.1 Å²	72.1	63%	0.629	42%	0.423	S	S	*	.	S	Bend	trans	76.7	2.4	-174.8	0	0	0	0	0	114.6	L499	L499-G502 PolarHBondContact O-N 3.39Å
503	N	83.8	Confident	86.8	Confident	114 Å²	114	70.3 Å²	70.3	61%	0.61	42%	0.416	S	S	*	.			trans	-77.2	127.6	175.5	-71.7	-15.8	0	0	0	110.3	L499 G501	L499-N503 HydrophobicContact CD1-CB 4.49Å; L499-N503 PolarHBondContact N-O 3.22Å; G501-N503 PolarHBondContact O-N 3.01Å
504	L	83.4	Confident	87	Confident	127 Å²	127	70.2 Å²	70.2	67%	0.665	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	125.9	171	-67.9	167.7	0	0	0	109.4	A497 T498	A497-L504 WeakPolarHBondContact O-CA 3.36Å; T498-L504 HydrophobicContact CG2-CD2 3.54Å
505	T	85.7	Confident	87.2	Confident	46 Å²	46	68.1 Å²	68.1	28%	0.282	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	138.9	168	47.6	0	0	0	0	110.4	A497 L499	A497-T505 PolarHBondContact N-O 2.95Å; A497-T505 PolarHBondContact O-N 2.78Å; A497-T505 PolarHBondContact O-OG1 2.7Å; L499-T505 HydrophobicContact CD1-CG2 3.36Å; L499-T505 HydrophobicContact CG-CG2 4.04Å
506	M	84.9	Confident	87.5	Confident	100 Å²	100	67.3 Å²	67.3	49%	0.493	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119	173.5	-57.3	-53	-64.4	0	0	108.3	Q494	Q494-M506 HydrophobicContact CB-CE 3.43Å; Q494-M506 VanDerWaalsContact CB-CE 3.43Å; Q494-M506 HydrophobicContact CG-CE 4.41Å
507	L	87.3	Confident	88	Confident	88 Å²	88	63 Å²	63	46%	0.461	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	143.4	176.6	-66.6	171.1	0	0	0	109.9	I495 A497	I495-L507 HydrophobicContact CB-CB 4.3Å; I495-L507 PolarHBondContact N-O 3.42Å; I495-L507 PolarHBondContact O-N 2.85Å; A497-L507 HydrophobicContact CB-CD1 3.96Å
508	P	88.3	Confident	88.7	Confident	56 Å²	56	65.3 Å²	65.3	36%	0.364	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-61.7	145.5	173.7	27.4	-33.9	0	0	0	110.4	H510	P508-H510 PolarHBondContact O-N 3.06Å
509	P	89.8	Confident	89.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.351	C	S	.	.	S	Bend	trans	-53.7	-31.5	177.7	-33.2	38.2	0	0	0	115.9	G477 L479 I493 R536 W538	G477-P509 WeakPolarHBondContact O-CB 3.42Å; G477-P509 WeakPolarHBondContact O-CD 3.41Å; L479-P509 HydrophobicContact CB-CG 4.05Å; L479-P509 HydrophobicContact CD1-CB 3.65Å; L479-P509 HydrophobicContact CD1-CG 3.94Å; L479-P509 HydrophobicContact CG-CB 3.96Å; L479-P509 HydrophobicContact CG-CG 4.05Å; I493-P509 WeakPolarHBondContact O-CD 3.34Å; I493-P509 WeakPolarHBondContact O-CG 3.47Å; P509-R536 WeakPolarHBondContact O-CD 3.23Å; P509-R536 PolarHBondContact O-NE 3.48Å; P509-R536 VanDerWaalsContact O-NE 3.11Å; P509-R536 PolarHBondContact O-NH1 3.29Å; P509-W538 HydrophobicContact CB-CH2 3.69Å; P509-W538 HydrophobicContact CB-CZ2 3.62Å; P509-W538 HydrophobicContact CG-CH2 4.16Å; P509-W538 HydrophobicContact CG-CZ2 4.45Å
510	H	93.8	Very high	89.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.328	C	S	.	.			trans	-145.2	159.6	175	-78.6	-80.2	0	0	0	108.4	G477 P508 I514 T528 S530 D532 T534	G477-H510 WeakPolarHBondContact CA-O 3.35Å; G477-H510 PolarHBondContact O-N 2.77Å; P508-H510 PolarHBondContact O-N 3.06Å; H510-I514 HydrophobicContact CB-CD1 4.5Å; H510-I514 HydrophobicContact CB-CG1 4.12Å; H510-T528 PolarHBondContact NE2-OG1 2.86Å; H510-S530 VanDerWaalsContact CG-CB 3.48Å; H510-S530 WeakPolarHBondContact ND1-CB 3.49Å; H510-D532 WeakPolarHBondContact CA-OD2 3.26Å; H510-D532 WeakPolarHBondContact CB-OD2 3.41Å; H510-D532 IonicContact CE1-OD1 3.66Å; H510-D532 IonicContact CE1-OD2 4Å; H510-D532 IonicContact CG-OD2 3.12Å; H510-D532 VanDerWaalsContact ND1-CG 3.31Å; H510-D532 IonicContact ND1-OD1 3.74Å; H510-D532 PolarHBondContact ND1-OD1 3.03Å; H510-D532 IonicContact ND1-OD2 3.04Å; H510-D532 PolarHBondContact ND1-OD2 2.57Å; H510-T534 PolarHBondContact CE1-OG1 2.94Å; H510-T534 PolarHBondContact ND1-OG1 2.85Å
511	T	92.3	Very high	90.4	Very high	102 Å²	102	50.9 Å²	50.9	63%	0.626	31%	0.306	S	S	*	.	S	Bend	trans	-91.6	-14.9	178.9	54	0	0	0	0	113.7	D532	T511-D532 PolarHBondContact N-OD2 2.78Å; T511-D532 VanDerWaalsContact OG1-CB 3.29Å; T511-D532 WeakPolarHBondContact OG1-CB 3.32Å
512	E	94.4	Very high	90.8	Very high	62 Å²	62	51 Å²	51	29%	0.29	29%	0.291	S	S	.	.	S	Bend	trans	-138.1	-175.6	-178.1	-57.8	-165.9	-177.7	0	0	110.5	R146 G477 I514 S530 Q531 D532	R146-E512 IonicContact NH2-OE1 3.42Å; G477-E512 WeakPolarHBondContact CA-O 3.49Å; G477-E512 PolarHBondContact N-O 2.91Å; E512-I514 PolarHBondContact O-N 3.49Å; E512-S530 PolarHBondContact O-OG 2.81Å; E512-Q531 HydrophobicContact CB-CB 3.77Å; E512-Q531 HydrophobicContact CB-CG 4.23Å; E512-Q531 VanDerWaalsContact OE2-CG 3.32Å; E512-Q531 WeakPolarHBondContact OE2-CG 3.34Å; E512-D532 HydrophobicContact CB-CB 4.24Å; E512-D532 HydrophobicContact CG-CB 4.35Å
513	T	94.7	Very high	91.2	Very high	15 Å²	15	49.5 Å²	49.5	9%	0.092	28%	0.275	C	S	.	.			trans	-50.8	133	-174.1	-57.1	0	0	0	0	112.8	R475 S530 Q531	R475-T513 HydrophobicContact CB-CG2 4.43Å; R475-T513 HydrophobicContact CG-CG2 4.2Å; R475-T513 WeakPolarHBondContact O-CA 3.5Å; R475-T513 PolarHBondContact O-N 3.21Å; R475-T513 PolarHBondContact O-OG1 3.01Å; T513-S530 CarbonylContact O-C 3.54Å; T513-S530 VanDerWaalsContact O-CA 3.24Å; T513-S530 WeakPolarHBondContact O-CA 3.31Å; T513-S530 WeakPolarHBondContact O-CB 3.38Å; T513-S530 PolarHBondContact O-OG 3.05Å; T513-Q531 VanDerWaalsContact CB-OE1 3.28Å; T513-Q531 WeakPolarHBondContact O-CB 3.43Å; T513-Q531 PolarHBondContact O-N 3.49Å; T513-Q531 PolarHBondContact OG1-OE1 2.8Å
514	I	96.4	Very high	91.7	Very high	1 Å²	1	49 Å²	49	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	121.2	167.1	-65.4	154.5	0	0	0	108	A461 T474 E478 L479 H510 E512 V517	A461-I514 WeakPolarHBondContact CB-O 3.27Å; T474-I514 PolarHBondContact O-N 3.1Å; E478-I514 WeakPolarHBondContact O-CD1 3.46Å; L479-I514 HydrophobicContact CD2-CD1 3.76Å; L479-I514 HydrophobicContact CG-CD1 3.86Å; H510-I514 HydrophobicContact CB-CD1 4.5Å; H510-I514 HydrophobicContact CB-CG1 4.12Å; E512-I514 PolarHBondContact O-N 3.49Å; I514-V517 HydrophobicContact CG2-CG2 3.71Å
515	H	95.1	Very high	92.2	Very high	20 Å²	20	45.6 Å²	45.6	9%	0.093	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-35.1	-178.2	-75.2	124.6	0	0	0	112.7	G529 D555 V556 L557	H515-G529 PolarHBondContact N-O 3.34Å; H515-D555 IonicContact CE1-OD2 2.53Å; H515-D555 PolarHBondContact CE1-OD2 3.02Å; H515-V556 WeakPolarHBondContact CB-O 3.48Å; H515-L557 HydrophobicContact CB-CD2 4.29Å
516	C	94.6	Very high	92.7	Very high	12 Å²	12	43.4 Å²	43.4	8%	0.081	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	148.3	-178.4	58.7	0	0	0	0	111.3	T528 G529 L557 V559	C516-T528 WeakPolarHBondContact O-CA 3.47Å; C516-G529 PolarHBondContact N-O 3.43Å; C516-G529 PolarHBondContact O-N 2.89Å; C516-L557 PolarHBondContact SG-O 2.81Å; C516-V559 WeakPolarHBondContact SG-CG2 3.32Å
517	V	95.9	Very high	93.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	132	174.9	-179.4	0	0	0	0	106.5	A461 E463 L479 I514 L526 V527 T528	A461-V517 WeakPolarHBondContact O-CG2 3.08Å; E463-V517 HydrophobicContact CB-CB 4.33Å; E463-V517 HydrophobicContact CB-CG1 4Å; L479-V517 HydrophobicContact CD2-CG2 4.06Å; I514-V517 HydrophobicContact CG2-CG2 3.71Å; V517-L526 HydrophobicContact CG1-CD1 3.6Å; V517-L526 HydrophobicContact CG1-CD2 4.15Å; V517-L526 HydrophobicContact CG1-CG 3.99Å; V517-V527 CarbonylContact C-O 3.52Å; V517-V527 WeakPolarHBondContact CA-O 3.37Å; V517-T528 HydrophobicContact CG1-CG2 4.21Å; V517-T528 HydrophobicContact CG2-CG2 4.11Å
518	K	96	Very high	93.7	Very high	78 Å²	78	34.4 Å²	34.4	34%	0.339	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134	178.8	-74.2	-69.5	155.1	-151	0	111.4	E463 L526 V527 V559 I561	E463-K518 IonicContact OE2-NZ 2.82Å; E463-K518 PolarHBondContact OE2-NZ 3.14Å; K518-L526 CarbonylContact O-C 3.46Å; K518-L526 WeakPolarHBondContact O-CA 3.03Å; K518-V527 PolarHBondContact N-O 3.34Å; K518-V527 PolarHBondContact O-N 2.9Å; K518-V559 HydrophobicContact CB-CG1 4.43Å; K518-V559 HydrophobicContact CG-CB 4.5Å; K518-V559 WeakPolarHBondContact CG-O 3.34Å; K518-I561 HydrophobicContact CB-CD1 4.08Å
519	L	94.9	Very high	94.1	Very high	28 Å²	28	31.8 Å²	31.8	15%	0.147	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	140.5	172.4	-171.6	71.3	0	0	0	109.2	E463 I465 L526 M540	E463-L519 HydrophobicContact CG-CB 3.97Å; I465-L519 HydrophobicContact CG2-CD1 4.09Å; I465-L519 HydrophobicContact CG2-CD2 4.19Å; L519-L526 HydrophobicContact CB-CD1 4.27Å; L519-L526 HydrophobicContact CD1-CB 4.48Å; L519-L526 HydrophobicContact CD1-CD1 4.1Å; L519-M540 HydrophobicContact CD1-CG 4.21Å
520	S	93.9	Very high	94.5	Very high	4 Å²	4	31.8 Å²	31.8	3%	0.028	17%	0.171	C	C	.	.			trans	-68.4	156.9	171.2	64.8	0	0	0	0	111.3	D522 G523 H524 Y525 S565	S520-D522 VanDerWaalsContact C-N 3.28Å; S520-D522 WeakPolarHBondContact CB-OD1 3.37Å; S520-D522 PolarHBondContact O-N 2.9Å; S520-D522 PolarHBondContact OG-OD1 2.89Å; S520-G523 WeakPolarHBondContact O-CA 3.31Å; S520-G523 PolarHBondContact O-N 3.16Å; S520-H524 PolarHBondContact OG-N 3.49Å; S520-Y525 WeakPolarHBondContact CB-O 3.43Å; S520-Y525 PolarHBondContact N-O 3.48Å; S520-Y525 PolarHBondContact OG-N 3.2Å; S520-Y525 PolarHBondContact OG-O 3.3Å; S520-S565 WeakPolarHBondContact CB-OG 3.41Å
521	T	90.1	Very high	94.6	Very high	88 Å²	88	34.8 Å²	34.8	54%	0.54	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-28.1	-176	45.8	0	0	0	0	113.3	G523 L563	T521-G523 VanDerWaalsContact C-N 3.3Å; T521-L563 HydrophobicContact CG2-CD1 3.78Å; T521-L563 PolarHBondContact OG1-O 3.39Å
522	D	89.1	Confident	94.7	Very high	70 Å²	70	30.9 Å²	30.9	37%	0.374	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-6.7	171	62.8	-7.7	0	0	0	113.4	S520 H524 S565	S520-D522 VanDerWaalsContact C-N 3.28Å; S520-D522 WeakPolarHBondContact CB-OD1 3.37Å; S520-D522 PolarHBondContact O-N 2.9Å; S520-D522 PolarHBondContact OG-OD1 2.89Å; D522-H524 PolarHBondContact O-N 3.17Å; D522-H524 PolarHBondContact OD1-N 3.42Å; D522-H524 IonicContact OD2-CD2 2.8Å; D522-H524 PolarHBondContact OD2-CD2 3.23Å; D522-H524 IonicContact OD2-CG 3.83Å; D522-S565 PolarHBondContact OD1-OG 2.86Å; D522-S565 WeakPolarHBondContact OD2-CB 3.29Å; D522-S565 PolarHBondContact OD2-OG 3.45Å
523	G	90.6	Very high	94.8	Very high	28 Å²	28	32 Å²	32	29%	0.289	17%	0.166	S	C	.	.	S	Bend	trans	70.3	10	-179	0	0	0	0	0	114.7	S520 T521 M540	S520-G523 WeakPolarHBondContact O-CA 3.31Å; S520-G523 PolarHBondContact O-N 3.16Å; T521-G523 VanDerWaalsContact C-N 3.3Å; G523-M540 VanDerWaalsContact O-CB 3.25Å; G523-M540 WeakPolarHBondContact O-CB 3.46Å
524	H	93.6	Very high	94.8	Very high	104 Å²	104	32 Å²	32	48%	0.481	17%	0.166	S	C	.	.	S	Bend	trans	-91.3	-18.6	-176.5	-68.2	-36.5	0	0	0	114.5	S520 D522 T539 M540	S520-H524 PolarHBondContact OG-N 3.49Å; D522-H524 PolarHBondContact O-N 3.17Å; D522-H524 PolarHBondContact OD1-N 3.42Å; D522-H524 IonicContact OD2-CD2 2.8Å; D522-H524 PolarHBondContact OD2-CD2 3.23Å; D522-H524 IonicContact OD2-CG 3.83Å; H524-T539 CarbonylContact O-C 3.56Å; H524-T539 WeakPolarHBondContact O-CA 3.45Å; H524-M540 PolarHBondContact O-N 3.35Å
525	Y	95.2	Very high	94.8	Very high	55 Å²	55	32 Å²	32	22%	0.216	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	128.9	-176.7	-56.8	-73.5	0	0	0	111.1	S520 I537 W538 T539 L546 I582	S520-Y525 WeakPolarHBondContact CB-O 3.43Å; S520-Y525 PolarHBondContact N-O 3.48Å; S520-Y525 PolarHBondContact OG-N 3.2Å; S520-Y525 PolarHBondContact OG-O 3.3Å; Y525-I537 HydrophobicContact CD1-CG2 4.09Å; Y525-W538 CarbonylContact C-O 3.58Å; Y525-W538 VanDerWaalsContact CA-O 3.26Å; Y525-W538 WeakPolarHBondContact CA-O 3.13Å; Y525-T539 HydrophobicContact CE1-CG2 4.46Å; Y525-L546 HydrophobicContact CD1-CD2 4.23Å; Y525-L546 HydrophobicContact CE1-CD2 3.84Å; Y525-I582 HydrophobicContact CD1-CG2 3.79Å; Y525-I582 HydrophobicContact CD2-CG2 3.95Å; Y525-I582 HydrophobicContact CE1-CG2 3.75Å; Y525-I582 HydrophobicContact CE2-CG2 3.9Å; Y525-I582 HydrophobicContact CG-CG2 3.88Å
526	L	96	Very high	94.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.5	167.5	-172.3	80.3	0	0	0	107.7	I465 V471 I493 V517 K518 L519 T528 I537 W538 M540	I465-L526 HydrophobicContact CG2-CD1 4.23Å; V471-L526 HydrophobicContact CG1-CD2 4.21Å; V471-L526 HydrophobicContact CG2-CD2 4.44Å; I493-L526 HydrophobicContact CD1-CD2 4.06Å; V517-L526 HydrophobicContact CG1-CD1 3.6Å; V517-L526 HydrophobicContact CG1-CD2 4.15Å; V517-L526 HydrophobicContact CG1-CG 3.99Å; K518-L526 CarbonylContact O-C 3.46Å; K518-L526 WeakPolarHBondContact O-CA 3.03Å; L519-L526 HydrophobicContact CB-CD1 4.27Å; L519-L526 HydrophobicContact CD1-CB 4.48Å; L519-L526 HydrophobicContact CD1-CD1 4.1Å; L526-T528 HydrophobicContact CD2-CG2 4.38Å; L526-I537 CarbonylContact O-C 3.56Å; L526-I537 WeakPolarHBondContact O-CA 3.41Å; L526-W538 HydrophobicContact CB-CB 4.14Å; L526-W538 PolarHBondContact N-O 2.99Å; L526-W538 PolarHBondContact O-N 3.27Å; L526-M540 HydrophobicContact CB-CG 3.98Å; L526-M540 HydrophobicContact CB-SD 4.49Å
527	V	97	Very high	95	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.9	177.9	-171.5	0	0	0	0	109.5	V517 K518 R536 I537 V559 I561 V568	V517-V527 CarbonylContact C-O 3.52Å; V517-V527 WeakPolarHBondContact CA-O 3.37Å; K518-V527 PolarHBondContact N-O 3.34Å; K518-V527 PolarHBondContact O-N 2.9Å; V527-R536 CarbonylContact C-O 3.56Å; V527-R536 VanDerWaalsContact CA-O 3.29Å; V527-R536 WeakPolarHBondContact CA-O 3.22Å; V527-I537 HydrophobicContact CG1-CG1 4.4Å; V527-I537 HydrophobicContact CG2-CG1 4.19Å; V527-I537 HydrophobicContact CG2-CG2 4.4Å; V527-V559 HydrophobicContact CB-CG1 3.74Å; V527-V559 HydrophobicContact CG1-CB 4.47Å; V527-V559 HydrophobicContact CG1-CG1 3.43Å; V527-V559 VanDerWaalsContact CG1-CG1 3.43Å; V527-V559 HydrophobicContact CG1-CG2 4.25Å; V527-I561 HydrophobicContact CB-CD1 4.18Å; V527-I561 HydrophobicContact CG2-CD1 3.66Å; V527-I561 HydrophobicContact CG2-CG1 4.09Å; V527-V568 HydrophobicContact CG1-CG1 3.99Å; V527-V568 HydrophobicContact CG2-CG2 3.83Å
528	T	97	Very high	94.9	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.1	-177.5	56.1	0	0	0	0	109.8	L479 H510 C516 V517 L526 A535 R536 W538	L479-T528 HydrophobicContact CD1-CG2 3.87Å; L479-T528 HydrophobicContact CD2-CG2 3.86Å; L479-T528 HydrophobicContact CG-CG2 4.49Å; H510-T528 PolarHBondContact NE2-OG1 2.86Å; C516-T528 WeakPolarHBondContact O-CA 3.47Å; V517-T528 HydrophobicContact CG1-CG2 4.21Å; V517-T528 HydrophobicContact CG2-CG2 4.11Å; L526-T528 HydrophobicContact CD2-CG2 4.38Å; T528-A535 CarbonylContact O-C 3.4Å; T528-A535 WeakPolarHBondContact O-CA 3.38Å; T528-A535 WeakPolarHBondContact O-CB 3.1Å; T528-R536 PolarHBondContact N-O 3.23Å; T528-R536 PolarHBondContact O-N 3.36Å; T528-R536 PolarHBondContact OG1-O 2.88Å; T528-W538 PolarHBondContact OG1-NE1 3.38Å
529	G	96.4	Very high	94.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.1	173.9	0	0	0	0	0	110.4	H515 C516 V556	H515-G529 PolarHBondContact N-O 3.34Å; C516-G529 PolarHBondContact N-O 3.43Å; C516-G529 PolarHBondContact O-N 2.89Å; G529-V556 CarbonylContact C-O 3.48Å
530	S	97.1	Very high	94.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	159.4	-173.4	178.2	0	0	0	0	113.5	H510 E512 T513 D532 Q533 T534 V556	H510-S530 VanDerWaalsContact CG-CB 3.48Å; H510-S530 WeakPolarHBondContact ND1-CB 3.49Å; E512-S530 PolarHBondContact O-OG 2.81Å; T513-S530 CarbonylContact O-C 3.54Å; T513-S530 VanDerWaalsContact O-CA 3.24Å; T513-S530 WeakPolarHBondContact O-CA 3.31Å; T513-S530 WeakPolarHBondContact O-CB 3.38Å; T513-S530 PolarHBondContact O-OG 3.05Å; S530-D532 VanDerWaalsContact CB-OD1 3.3Å; S530-D532 WeakPolarHBondContact CB-OD1 3.47Å; S530-D532 PolarHBondContact O-N 3.44Å; S530-D532 PolarHBondContact OG-N 2.86Å; S530-D532 VanDerWaalsContact OG-N 3.11Å; S530-D532 PolarHBondContact OG-OD1 3.06Å; S530-Q533 PolarHBondContact O-N 3.08Å; S530-T534 PolarHBondContact N-O 2.92Å; S530-T534 VanDerWaalsContact N-O 3.12Å; S530-V556 PolarHBondContact O-N 3.41Å
531	Q	96.7	Very high	94.5	Very high	63 Å²	63	33.9 Å²	33.9	29%	0.294	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.7	165.7	-165.8	177	0.4	0	0	112.7	E512 T513 Q533 D555	E512-Q531 HydrophobicContact CB-CB 3.77Å; E512-Q531 HydrophobicContact CB-CG 4.23Å; E512-Q531 VanDerWaalsContact OE2-CG 3.32Å; E512-Q531 WeakPolarHBondContact OE2-CG 3.34Å; T513-Q531 VanDerWaalsContact CB-OE1 3.28Å; T513-Q531 WeakPolarHBondContact O-CB 3.43Å; T513-Q531 PolarHBondContact O-N 3.49Å; T513-Q531 PolarHBondContact OG1-OE1 2.8Å; Q531-Q533 PolarHBondContact O-N 2.89Å; Q531-D555 WeakPolarHBondContact CG-OD1 3.37Å
532	D	94.7	Very high	94.5	Very high	21 Å²	21	35 Å²	35	11%	0.112	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	11.4	174.4	76.3	3.1	0	0	0	114.3	H510 T511 E512 S530 T534 R536	H510-D532 WeakPolarHBondContact CA-OD2 3.26Å; H510-D532 WeakPolarHBondContact CB-OD2 3.41Å; H510-D532 IonicContact CE1-OD1 3.66Å; H510-D532 IonicContact CE1-OD2 4Å; H510-D532 IonicContact CG-OD2 3.12Å; H510-D532 VanDerWaalsContact ND1-CG 3.31Å; H510-D532 IonicContact ND1-OD1 3.74Å; H510-D532 PolarHBondContact ND1-OD1 3.03Å; H510-D532 IonicContact ND1-OD2 3.04Å; H510-D532 PolarHBondContact ND1-OD2 2.57Å; T511-D532 PolarHBondContact N-OD2 2.78Å; T511-D532 VanDerWaalsContact OG1-CB 3.29Å; T511-D532 WeakPolarHBondContact OG1-CB 3.32Å; E512-D532 HydrophobicContact CB-CB 4.24Å; E512-D532 HydrophobicContact CG-CB 4.35Å; S530-D532 VanDerWaalsContact CB-OD1 3.3Å; S530-D532 WeakPolarHBondContact CB-OD1 3.47Å; S530-D532 PolarHBondContact O-N 3.44Å; S530-D532 PolarHBondContact OG-N 2.86Å; S530-D532 VanDerWaalsContact OG-N 3.11Å; S530-D532 PolarHBondContact OG-OD1 3.06Å; D532-T534 VanDerWaalsContact CG-OG1 3.27Å; D532-T534 PolarHBondContact O-N 2.88Å; D532-T534 WeakPolarHBondContact OD1-CA 3.48Å; D532-T534 WeakPolarHBondContact OD1-CB 3.14Å; D532-T534 PolarHBondContact OD1-N 2.9Å; D532-T534 PolarHBondContact OD1-OG1 2.96Å; D532-T534 PolarHBondContact OD2-OG1 3.04Å; D532-R536 IonicContact OD2-NH2 2.71Å; D532-R536 PolarHBondContact OD2-NH2 2.75Å
533	Q	95.5	Very high	94.6	Very high	85 Å²	85	33.1 Å²	33.1	40%	0.397	18%	0.175	S	C	.	.	S	Bend	trans	67.5	9.9	179.2	-44.9	177.3	-9.2	0	0	113.7	S530 Q531 A553	S530-Q533 PolarHBondContact O-N 3.08Å; Q531-Q533 PolarHBondContact O-N 2.89Å; Q533-A553 PolarHBondContact NE2-O 2.86Å
534	T	95.4	Very high	94.6	Very high	16 Å²	16	40.2 Å²	40.2	10%	0.098	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.2	177.5	75.4	0	0	0	0	111.2	H510 S530 D532 T548 E550	H510-T534 PolarHBondContact CE1-OG1 2.94Å; H510-T534 PolarHBondContact ND1-OG1 2.85Å; S530-T534 PolarHBondContact N-O 2.92Å; S530-T534 VanDerWaalsContact N-O 3.12Å; D532-T534 VanDerWaalsContact CG-OG1 3.27Å; D532-T534 PolarHBondContact O-N 2.88Å; D532-T534 WeakPolarHBondContact OD1-CA 3.48Å; D532-T534 WeakPolarHBondContact OD1-CB 3.14Å; D532-T534 PolarHBondContact OD1-N 2.9Å; D532-T534 PolarHBondContact OD1-OG1 2.96Å; D532-T534 PolarHBondContact OD2-OG1 3.04Å; T534-T548 HydrophobicContact CG2-CG2 4.08Å; T534-E550 HydrophobicContact CG2-CG 4.23Å
535	A	96.4	Very high	94.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	145.3	158	0	0	0	0	0	109	T528 L549 V556 T570	T528-A535 CarbonylContact O-C 3.4Å; T528-A535 WeakPolarHBondContact O-CA 3.38Å; T528-A535 WeakPolarHBondContact O-CB 3.1Å; A535-L549 HydrophobicContact CB-CB 4.11Å; A535-L549 HydrophobicContact CB-CD1 3.96Å; A535-L549 HydrophobicContact CB-CG 4.41Å; A535-L549 PolarHBondContact N-O 3.39Å; A535-L549 WeakPolarHBondContact O-CA 3.38Å; A535-L549 VanDerWaalsContact O-CB 3.26Å; A535-L549 WeakPolarHBondContact O-CB 3.42Å; A535-L549 PolarHBondContact O-N 3.13Å; A535-V556 HydrophobicContact CB-CG1 4.4Å; A535-T570 HydrophobicContact CB-CG2 3.84Å
536	R	96.2	Very high	94.5	Very high	32 Å²	32	38.2 Å²	38.2	12%	0.121	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.2	179.2	-70.3	179.5	-163.4	-165.9	5.5	110.3	P509 V527 T528 D532 W538 L545 H547 T548	P509-R536 WeakPolarHBondContact O-CD 3.23Å; P509-R536 PolarHBondContact O-NE 3.48Å; P509-R536 VanDerWaalsContact O-NE 3.11Å; P509-R536 PolarHBondContact O-NH1 3.29Å; V527-R536 CarbonylContact C-O 3.56Å; V527-R536 VanDerWaalsContact CA-O 3.29Å; V527-R536 WeakPolarHBondContact CA-O 3.22Å; T528-R536 PolarHBondContact N-O 3.23Å; T528-R536 PolarHBondContact O-N 3.36Å; T528-R536 PolarHBondContact OG1-O 2.88Å; D532-R536 IonicContact OD2-NH2 2.71Å; D532-R536 PolarHBondContact OD2-NH2 2.75Å; R536-W538 HydrophobicContact CB-CZ2 4.04Å; R536-L545 HydrophobicContact CB-CD1 3.74Å; R536-L545 HydrophobicContact CG-CD1 3.96Å; R536-H547 WeakPolarHBondContact CA-O 3.41Å; R536-T548 HydrophobicContact CG-CG2 4.06Å
537	I	96.4	Very high	94.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.9	174.5	-54	179.9	0	0	0	107.7	Y525 L526 V527 L546 H547 L549 V568 I582	Y525-I537 HydrophobicContact CD1-CG2 4.09Å; L526-I537 CarbonylContact O-C 3.56Å; L526-I537 WeakPolarHBondContact O-CA 3.41Å; V527-I537 HydrophobicContact CG1-CG1 4.4Å; V527-I537 HydrophobicContact CG2-CG1 4.19Å; V527-I537 HydrophobicContact CG2-CG2 4.4Å; I537-L546 HydrophobicContact CB-CB 4.44Å; I537-L546 HydrophobicContact CG2-CB 4.27Å; I537-L546 HydrophobicContact CG2-CD2 4.06Å; I537-L546 WeakPolarHBondContact O-CB 3.25Å; I537-L546 PolarHBondContact O-N 2.91Å; I537-H547 PolarHBondContact N-O 3.49Å; I537-H547 PolarHBondContact O-N 2.94Å; I537-L549 HydrophobicContact CD1-CD1 4.04Å; I537-L549 HydrophobicContact CD1-CD2 3.95Å; I537-L549 HydrophobicContact CD1-CG 4.3Å; I537-L549 HydrophobicContact CG1-CD1 3.98Å; I537-L549 HydrophobicContact CG1-CD2 4.33Å; I537-L549 HydrophobicContact CG1-CG 4.2Å; I537-V568 HydrophobicContact CD1-CG2 4.3Å; I537-I582 HydrophobicContact CD1-CG1 4.28Å; I537-I582 HydrophobicContact CG2-CG2 4.41Å
538	W	95.6	Very high	94.3	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	144	177.9	-47.1	81.6	0	0	0	109.3	L479 I493 I495 P509 Y525 L526 T528 R536 R544 L545	L479-W538 HydrophobicContact CD1-CZ2 3.97Å; I493-W538 HydrophobicContact CG2-CD2 4.09Å; I493-W538 HydrophobicContact CG2-CE3 3.49Å; I493-W538 VanDerWaalsContact CG2-CE3 3.49Å; I493-W538 HydrophobicContact CG2-CH2 4.18Å; I493-W538 HydrophobicContact CG2-CZ3 3.53Å; I495-W538 HydrophobicContact CD1-CH2 3.82Å; I495-W538 HydrophobicContact CG1-CH2 3.57Å; I495-W538 HydrophobicContact CG1-CZ3 3.81Å; P509-W538 HydrophobicContact CB-CH2 3.69Å; P509-W538 HydrophobicContact CB-CZ2 3.62Å; P509-W538 HydrophobicContact CG-CH2 4.16Å; P509-W538 HydrophobicContact CG-CZ2 4.45Å; Y525-W538 CarbonylContact C-O 3.58Å; Y525-W538 VanDerWaalsContact CA-O 3.26Å; Y525-W538 WeakPolarHBondContact CA-O 3.13Å; L526-W538 HydrophobicContact CB-CB 4.14Å; L526-W538 PolarHBondContact N-O 2.99Å; L526-W538 PolarHBondContact O-N 3.27Å; T528-W538 PolarHBondContact OG1-NE1 3.38Å; R536-W538 HydrophobicContact CB-CZ2 4.04Å; W538-R544 CarbonylContact C-O 3.54Å; W538-R544 WeakPolarHBondContact CA-O 3.14Å; W538-L545 HydrophobicContact CD2-CD1 4.33Å; W538-L545 HydrophobicContact CE3-CB 3.98Å; W538-L545 HydrophobicContact CE3-CD1 4.36Å; W538-L545 HydrophobicContact CH2-CB 4.35Å; W538-L545 HydrophobicContact CH2-CD1 4.17Å; W538-L545 HydrophobicContact CZ2-CD1 4.12Å; W538-L545 HydrophobicContact CZ3-CB 3.79Å; W538-L545 HydrophobicContact CZ3-CD1 4.29Å
539	T	93.8	Very high	94.2	Very high	29 Å²	29	43 Å²	43	18%	0.178	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	139.5	169.5	52.8	0	0	0	0	109.9	H524 Y525 E543 R544 L546	H524-T539 CarbonylContact O-C 3.56Å; H524-T539 WeakPolarHBondContact O-CA 3.45Å; Y525-T539 HydrophobicContact CE1-CG2 4.46Å; T539-E543 WeakPolarHBondContact O-CA 3.46Å; T539-E543 PolarHBondContact O-N 2.86Å; T539-R544 PolarHBondContact N-O 3Å; T539-R544 WeakPolarHBondContact OG1-CB 3.37Å; T539-R544 PolarHBondContact OG1-N 3.31Å; T539-R544 PolarHBondContact OG1-O 2.94Å; T539-R544 VanDerWaalsContact OG1-O 3.07Å; T539-L546 HydrophobicContact CG2-CB 4.11Å; T539-L546 HydrophobicContact CG2-CD1 3.95Å; T539-L546 HydrophobicContact CG2-CD2 4.44Å; T539-L546 HydrophobicContact CG2-CG 4.38Å
540	M	92.3	Very high	94	Very high	18 Å²	18	49.9 Å²	49.9	9%	0.089	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	141.5	175.2	-68.9	-61	-69.4	0	0	109.4	I465 L519 G523 H524 L526 E543	I465-M540 HydrophobicContact CB-CE 4.42Å; I465-M540 HydrophobicContact CD1-CE 3.52Å; I465-M540 HydrophobicContact CG2-CE 4.47Å; L519-M540 HydrophobicContact CD1-CG 4.21Å; G523-M540 VanDerWaalsContact O-CB 3.25Å; G523-M540 WeakPolarHBondContact O-CB 3.46Å; H524-M540 PolarHBondContact O-N 3.35Å; L526-M540 HydrophobicContact CB-CG 3.98Å; L526-M540 HydrophobicContact CB-SD 4.49Å; M540-E543 HydrophobicContact CE-CG 4.23Å; M540-E543 HydrophobicContact SD-CG 3.68Å
541	P	89	Confident	93.6	Very high	103 Å²	103	51.7 Å²	51.7	67%	0.669	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85.2	2.2	3.7	35.9	-36.8	0	0	0	114.5	E543	P541-E543 PolarHBondContact O-N 2.89Å
542	D	90.3	Very high	93.3	Very high	111 Å²	111	49.1 Å²	49.1	59%	0.594	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-13.9	-174	-71.5	-22.4	0	0	0	114.5	R544	D542-R544 HydrophobicContact CB-CG 4.24Å; D542-R544 WeakPolarHBondContact O-CG 3.47Å; D542-R544 PolarHBondContact O-N 2.79Å; D542-R544 VanDerWaalsContact O-N 3.13Å
543	E	90.9	Very high	93.2	Very high	31 Å²	31	51.4 Å²	51.4	15%	0.145	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	27.2	178.1	-69.7	173.6	-176.1	0	0	114.4	R491 I493 T539 M540 P541	R491-E543 WeakPolarHBondContact CD-OE2 3.26Å; R491-E543 IonicContact CZ-OE1 3.17Å; R491-E543 VanDerWaalsContact NE-CD 3.27Å; R491-E543 IonicContact NE-OE1 3.65Å; R491-E543 PolarHBondContact NE-OE1 3.45Å; R491-E543 IonicContact NE-OE2 3.1Å; R491-E543 PolarHBondContact NE-OE2 3.06Å; R491-E543 VanDerWaalsContact NE-OE2 3.09Å; R491-E543 IonicContact NH2-OE1 3.49Å; R491-E543 PolarHBondContact NH2-OE1 3.03Å; I493-E543 HydrophobicContact CD1-CG 4.07Å; I493-E543 HydrophobicContact CG1-CB 4.22Å; I493-E543 HydrophobicContact CG1-CG 3.97Å; I493-E543 HydrophobicContact CG2-CB 4.37Å; T539-E543 WeakPolarHBondContact O-CA 3.46Å; T539-E543 PolarHBondContact O-N 2.86Å; M540-E543 HydrophobicContact CE-CG 4.23Å; M540-E543 HydrophobicContact SD-CG 3.68Å; P541-E543 PolarHBondContact O-N 2.89Å
544	R	91.7	Very high	93.1	Very high	176 Å²	176	50 Å²	50	66%	0.664	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	135.8	179.2	-59.8	179.9	178.6	175.7	0.2	110.9	W538 T539 D542 L546	W538-R544 CarbonylContact C-O 3.54Å; W538-R544 WeakPolarHBondContact CA-O 3.14Å; T539-R544 PolarHBondContact N-O 3Å; T539-R544 WeakPolarHBondContact OG1-CB 3.37Å; T539-R544 PolarHBondContact OG1-N 3.31Å; T539-R544 PolarHBondContact OG1-O 2.94Å; T539-R544 VanDerWaalsContact OG1-O 3.07Å; D542-R544 HydrophobicContact CB-CG 4.24Å; D542-R544 WeakPolarHBondContact O-CG 3.47Å; D542-R544 PolarHBondContact O-N 2.79Å; D542-R544 VanDerWaalsContact O-N 3.13Å; R544-L546 PolarHBondContact O-N 2.95Å
545	L	93.2	Very high	93.1	Very high	55 Å²	55	50.7 Å²	50.7	29%	0.288	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	118.7	168	-179.6	68.4	0	0	0	109.2	I495 R536 W538	I495-L545 HydrophobicContact CD1-CD2 3.76Å; I495-L545 HydrophobicContact CG1-CB 4.24Å; I495-L545 HydrophobicContact CG1-CD2 4.04Å; I495-L545 HydrophobicContact CG2-CD2 4.4Å; R536-L545 HydrophobicContact CB-CD1 3.74Å; R536-L545 HydrophobicContact CG-CD1 3.96Å; W538-L545 HydrophobicContact CD2-CD1 4.33Å; W538-L545 HydrophobicContact CE3-CB 3.98Å; W538-L545 HydrophobicContact CE3-CD1 4.36Å; W538-L545 HydrophobicContact CH2-CB 4.35Å; W538-L545 HydrophobicContact CH2-CD1 4.17Å; W538-L545 HydrophobicContact CZ2-CD1 4.12Å; W538-L545 HydrophobicContact CZ3-CB 3.79Å; W538-L545 HydrophobicContact CZ3-CD1 4.29Å
546	L	93.3	Very high	93.1	Very high	62 Å²	62	50.7 Å²	50.7	33%	0.325	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-56.6	175.8	-170.9	69.5	0	0	0	110.3	Y525 I537 T539 R544	Y525-L546 HydrophobicContact CD1-CD2 4.23Å; Y525-L546 HydrophobicContact CE1-CD2 3.84Å; I537-L546 HydrophobicContact CB-CB 4.44Å; I537-L546 HydrophobicContact CG2-CB 4.27Å; I537-L546 HydrophobicContact CG2-CD2 4.06Å; I537-L546 WeakPolarHBondContact O-CB 3.25Å; I537-L546 PolarHBondContact O-N 2.91Å; T539-L546 HydrophobicContact CG2-CB 4.11Å; T539-L546 HydrophobicContact CG2-CD1 3.95Å; T539-L546 HydrophobicContact CG2-CD2 4.44Å; T539-L546 HydrophobicContact CG2-CG 4.38Å; R544-L546 PolarHBondContact O-N 2.95Å
547	H	94.5	Very high	93	Very high	50 Å²	50	50.7 Å²	50.7	23%	0.231	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	142.3	-175.3	-63.7	-59.1	0	0	0	111.5	R536 I537 L549 I582 R583 G585	R536-H547 WeakPolarHBondContact CA-O 3.41Å; I537-H547 PolarHBondContact N-O 3.49Å; I537-H547 PolarHBondContact O-N 2.94Å; H547-L549 HydrophobicContact CB-CD2 4.37Å; H547-I582 PolarHBondContact CD2-O 2.9Å; H547-I582 VanDerWaalsContact CD2-O 3.23Å; H547-R583 PolarHBondContact NE2-O 2.84Å; H547-G585 VanDerWaalsContact CD2-CA 3.47Å; H547-G585 WeakPolarHBondContact CD2-CA 3.38Å; H547-G585 PolarHBondContact CD2-N 2.72Å; H547-G585 VanDerWaalsContact CG-CA 3.47Å; H547-G585 PolarHBondContact NE2-N 3.11Å
548	T	94.8	Very high	92.9	Very high	51 Å²	51	51.3 Å²	51.3	31%	0.313	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.3	165.4	-55.7	0	0	0	0	108.4	T534 R536 E550	T534-T548 HydrophobicContact CG2-CG2 4.08Å; R536-T548 HydrophobicContact CG-CG2 4.06Å; T548-E550 HydrophobicContact CG2-CG 3.89Å; T548-E550 PolarHBondContact O-N 3.27Å
549	L	94.2	Very high	92.9	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	95	-179.9	-50	179.9	0	0	0	108.8	A535 I537 H547 V568 W580 G585	A535-L549 HydrophobicContact CB-CB 4.11Å; A535-L549 HydrophobicContact CB-CD1 3.96Å; A535-L549 HydrophobicContact CB-CG 4.41Å; A535-L549 PolarHBondContact N-O 3.39Å; A535-L549 WeakPolarHBondContact O-CA 3.38Å; A535-L549 VanDerWaalsContact O-CB 3.26Å; A535-L549 WeakPolarHBondContact O-CB 3.42Å; A535-L549 PolarHBondContact O-N 3.13Å; I537-L549 HydrophobicContact CD1-CD1 4.04Å; I537-L549 HydrophobicContact CD1-CD2 3.95Å; I537-L549 HydrophobicContact CD1-CG 4.3Å; I537-L549 HydrophobicContact CG1-CD1 3.98Å; I537-L549 HydrophobicContact CG1-CD2 4.33Å; I537-L549 HydrophobicContact CG1-CG 4.2Å; H547-L549 HydrophobicContact CB-CD2 4.37Å; L549-V568 HydrophobicContact CD1-CG1 4.22Å; L549-W580 HydrophobicContact CB-CD2 3.96Å; L549-W580 HydrophobicContact CB-CE3 3.95Å; L549-W580 HydrophobicContact CB-CH2 4.09Å; L549-W580 HydrophobicContact CB-CZ2 4.06Å; L549-W580 HydrophobicContact CB-CZ3 4.02Å; L549-W580 HydrophobicContact CD1-CB 4.13Å; L549-W580 HydrophobicContact CD1-CD2 3.97Å; L549-W580 HydrophobicContact CD1-CG 3.73Å; L549-W580 HydrophobicContact CD2-CB 4.21Å; L549-W580 HydrophobicContact CD2-CD2 4.03Å; L549-W580 HydrophobicContact CD2-CE3 3.83Å; L549-W580 HydrophobicContact CD2-CG 4.2Å; L549-W580 HydrophobicContact CG-CD2 4.2Å; L549-W580 HydrophobicContact CG-CE3 4.32Å; L549-W580 HydrophobicContact CG-CG 4.4Å; L549-G585 WeakPolarHBondContact CD2-O 3.35Å
550	E	92.6	Very high	92.9	Very high	144 Å²	144	50.7 Å²	50.7	67%	0.673	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	135.9	179.7	-63.1	-176.2	177.8	0	0	111.4	T534 T548 W580	T534-E550 HydrophobicContact CG2-CG 4.23Å; T548-E550 HydrophobicContact CG2-CG 3.89Å; T548-E550 PolarHBondContact O-N 3.27Å; E550-W580 WeakPolarHBondContact O-CH2 3.24Å
551	G	87.8	Confident	93	Very high	37 Å²	37	51.2 Å²	51.2	38%	0.381	28%	0.28	S	S	.	.			trans	159	-25	168.9	0	0	0	0	0	114.6	R578	G551-R578 VanDerWaalsContact C-NH2 3.33Å; G551-R578 VanDerWaalsContact CA-NH1 3.31Å; G551-R578 PolarHBondContact O-NH1 3.06Å; G551-R578 VanDerWaalsContact O-NH1 3.13Å; G551-R578 PolarHBondContact O-NH2 2.94Å
552	H	91	Very high	93.1	Very high	9 Å²	9	46.3 Å²	46.3	4%	0.042	25%	0.249	C	C	.	.			trans	-60.5	149.2	172.8	-75.7	-67.9	0	0	0	111.2	V556 T570 S572 D574 S576 R578	H552-V556 HydrophobicContact CB-CG2 4.18Å; H552-T570 WeakPolarHBondContact NE2-CB 3.36Å; H552-T570 PolarHBondContact NE2-OG1 3.39Å; H552-S572 WeakPolarHBondContact CE1-CB 3.16Å; H552-S572 WeakPolarHBondContact ND1-CB 3.06Å; H552-D574 VanDerWaalsContact CA-OD2 3.29Å; H552-D574 WeakPolarHBondContact CA-OD2 3.36Å; H552-D574 IonicContact CG-OD2 2.81Å; H552-D574 IonicContact ND1-OD1 3.15Å; H552-D574 PolarHBondContact ND1-OD1 3.25Å; H552-D574 IonicContact ND1-OD2 3.32Å; H552-D574 PolarHBondContact ND1-OD2 3.12Å; H552-D574 VanDerWaalsContact ND1-OD2 3.1Å; H552-S576 PolarHBondContact CE1-OG 3.3Å; H552-S576 VanDerWaalsContact CE1-OG 3.29Å; H552-S576 PolarHBondContact ND1-OG 3.09Å; H552-R578 VanDerWaalsContact CE1-CD 3.48Å; H552-R578 WeakPolarHBondContact CE1-CD 3.29Å; H552-R578 VanDerWaalsContact CE1-CG 3.47Å; H552-R578 WeakPolarHBondContact CE1-CG 3.47Å
553	A	91.6	Very high	93.1	Very high	69 Å²	69	45.3 Å²	45.3	57%	0.57	24%	0.243	S	C	*	.	S	Bend	trans	-102.2	-2.9	-179.3	0	0	0	0	0	113.3	Q533 D574	Q533-A553 PolarHBondContact NE2-O 2.86Å; A553-D574 HydrophobicContact CB-CB 4.07Å; A553-D574 PolarHBondContact N-OD2 3.18Å
554	D	93.8	Very high	92.9	Very high	57 Å²	57	47.2 Å²	47.2	31%	0.305	25%	0.254	S	S	.	.	S	Bend	trans	-156	-179	-176.9	-145.1	-27.1	0	0	0	109.4	V556 S572 W573 D574	D554-V556 PolarHBondContact O-N 3.14Å; D554-S572 PolarHBondContact O-OG 3.1Å; D554-W573 HydrophobicContact CB-CB 4.14Å; D554-D574 HydrophobicContact CB-CB 3.76Å
555	D	94.8	Very high	92.8	Very high	30 Å²	30	39.2 Å²	39.2	16%	0.16	23%	0.225	C	C	.	.			trans	-47.4	132.1	-174.7	-61.5	3.2	0	0	0	113.5	H515 Q531 L557 S572 W573	H515-D555 IonicContact CE1-OD2 2.53Å; H515-D555 PolarHBondContact CE1-OD2 3.02Å; Q531-D555 WeakPolarHBondContact CG-OD1 3.37Å; D555-L557 HydrophobicContact CB-CD2 4.03Å; D555-L557 PolarHBondContact O-N 3.21Å; D555-S572 CarbonylContact O-C 3.57Å; D555-S572 WeakPolarHBondContact O-CA 3.38Å; D555-S572 VanDerWaalsContact O-CB 3.23Å; D555-S572 WeakPolarHBondContact O-CB 3.44Å; D555-S572 PolarHBondContact O-OG 3.46Å; D555-W573 HydrophobicContact CB-CB 4.13Å; D555-W573 PolarHBondContact O-N 3.05Å
556	V	96.5	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	105.7	167.9	-175.6	0	0	0	0	108.4	H515 G529 S530 A535 H552 D554 V559 T570	H515-V556 WeakPolarHBondContact CB-O 3.48Å; G529-V556 CarbonylContact C-O 3.48Å; S530-V556 PolarHBondContact O-N 3.41Å; A535-V556 HydrophobicContact CB-CG1 4.4Å; H552-V556 HydrophobicContact CB-CG2 4.18Å; D554-V556 PolarHBondContact O-N 3.14Å; V556-V559 HydrophobicContact CG1-CG2 4.29Å; V556-T570 HydrophobicContact CG1-CG2 4.43Å
557	L	94.5	Very high	92.4	Very high	31 Å²	31	38 Å²	38	16%	0.162	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-31.8	-175	-67.9	-168.6	0	0	0	113.6	H515 C516 D555 G571 W573 L598	H515-L557 HydrophobicContact CB-CD2 4.29Å; C516-L557 PolarHBondContact SG-O 2.81Å; D555-L557 HydrophobicContact CB-CD2 4.03Å; D555-L557 PolarHBondContact O-N 3.21Å; L557-G571 PolarHBondContact N-O 3.35Å; L557-W573 HydrophobicContact CD1-CD2 4.48Å; L557-W573 HydrophobicContact CD1-CE3 3.42Å; L557-W573 VanDerWaalsContact CD1-CE3 3.42Å; L557-W573 HydrophobicContact CD1-CZ3 3.92Å; L557-W573 HydrophobicContact CG-CE3 4.45Å; L557-L598 HydrophobicContact CD1-CD2 3.82Å
558	S	94.5	Very high	92.3	Very high	14 Å²	14	35.6 Å²	35.6	10%	0.098	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144	-173.5	-171.3	0	0	0	0	112	T570 G571 L598 Q599 V600	S558-T570 CarbonylContact O-C 3.55Å; S558-T570 WeakPolarHBondContact O-CA 3.41Å; S558-G571 PolarHBondContact N-O 2.92Å; S558-G571 PolarHBondContact O-N 2.89Å; S558-L598 WeakPolarHBondContact CB-O 3.27Å; S558-Q599 WeakPolarHBondContact OG-CA 3.44Å; S558-V600 PolarHBondContact OG-N 2.97Å
559	V	95.5	Very high	92.2	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.03	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.4	177.9	173.6	0	0	0	0	107.6	C516 K518 V527 V556 V568 V569 T570	C516-V559 WeakPolarHBondContact SG-CG2 3.32Å; K518-V559 HydrophobicContact CB-CG1 4.43Å; K518-V559 HydrophobicContact CG-CB 4.5Å; K518-V559 WeakPolarHBondContact CG-O 3.34Å; V527-V559 HydrophobicContact CB-CG1 3.74Å; V527-V559 HydrophobicContact CG1-CB 4.47Å; V527-V559 HydrophobicContact CG1-CG1 3.43Å; V527-V559 VanDerWaalsContact CG1-CG1 3.43Å; V527-V559 HydrophobicContact CG1-CG2 4.25Å; V556-V559 HydrophobicContact CG1-CG2 4.29Å; V559-V568 HydrophobicContact CG1-CG1 3.99Å; V559-V569 CarbonylContact C-O 3.59Å; V559-V569 WeakPolarHBondContact CA-O 3.43Å; V559-T570 HydrophobicContact CG2-CG2 4.17Å
560	A	94.5	Very high	92.2	Very high	11 Å²	11	33.1 Å²	33.1	9%	0.091	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	144.9	169.2	0	0	0	0	0	109.8	V568 V569 V600 I602	A560-V568 CarbonylContact O-C 3.56Å; A560-V568 WeakPolarHBondContact O-CA 3.29Å; A560-V569 PolarHBondContact N-O 2.83Å; A560-V569 PolarHBondContact O-N 2.77Å; A560-V600 HydrophobicContact CB-CG2 4.05Å; A560-I602 HydrophobicContact CB-CG2 4.31Å
561	I	93.4	Very high	92.3	Very high	28 Å²	28	26.3 Å²	26.3	14%	0.144	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.7	178.6	-55	173.1	0	0	0	107.5	K518 V527 V568 I582 I602	K518-I561 HydrophobicContact CB-CD1 4.08Å; V527-I561 HydrophobicContact CB-CD1 4.18Å; V527-I561 HydrophobicContact CG2-CD1 3.66Å; V527-I561 HydrophobicContact CG2-CG1 4.09Å; I561-V568 HydrophobicContact CG1-CG2 4.35Å; I561-I582 HydrophobicContact CG2-CD1 4Å; I561-I602 WeakPolarHBondContact O-CG2 3.16Å
562	S	90.7	Very high	92.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.141	C	C	.	.			trans	-67.5	152	173.6	62.4	0	0	0	0	111.8	D564 S565 E566 V567	S562-D564 VanDerWaalsContact CB-OD1 3.25Å; S562-D564 WeakPolarHBondContact CB-OD1 3.33Å; S562-D564 PolarHBondContact O-N 2.93Å; S562-D564 VanDerWaalsContact O-N 3.11Å; S562-D564 PolarHBondContact OG-OD1 3.35Å; S562-S565 PolarHBondContact O-N 3.13Å; S562-E566 PolarHBondContact OG-N 3.26Å; S562-V567 PolarHBondContact N-O 2.65Å; S562-V567 PolarHBondContact OG-N 3.44Å; S562-V567 PolarHBondContact OG-O 2.93Å
563	L	90.4	Very high	92.6	Very high	90 Å²	90	29.6 Å²	29.6	47%	0.471	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-27	-178.5	179	60.8	0	0	0	113.7	T521 N604	T521-L563 HydrophobicContact CG2-CD1 3.78Å; T521-L563 PolarHBondContact OG1-O 3.39Å; L563-N604 HydrophobicContact CB-CB 4.44Å; L563-N604 HydrophobicContact CD2-CB 3.91Å
564	D	86.7	Confident	92.5	Very high	71 Å²	71	28.1 Å²	28.1	38%	0.38	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	7.9	177.8	66.7	-13.9	0	0	0	114.1	S562 E566 K606	S562-D564 VanDerWaalsContact CB-OD1 3.25Å; S562-D564 WeakPolarHBondContact CB-OD1 3.33Å; S562-D564 PolarHBondContact O-N 2.93Å; S562-D564 VanDerWaalsContact O-N 3.11Å; S562-D564 PolarHBondContact OG-OD1 3.35Å; D564-E566 HydrophobicContact CB-CG 4.43Å; D564-E566 PolarHBondContact O-N 2.95Å; D564-E566 VanDerWaalsContact O-N 3.13Å; D564-E566 PolarHBondContact OD1-N 2.82Å; D564-K606 IonicContact OD1-NZ 2.71Å; D564-K606 WeakPolarHBondContact OD2-CE 3.34Å; D564-K606 IonicContact OD2-NZ 3.54Å; D564-K606 PolarHBondContact OD2-NZ 3.17Å
565	S	90.2	Very high	92.1	Very high	8 Å²	8	25.5 Å²	25.5	6%	0.056	13%	0.129	C	C	.	.	S	Bend	trans	56.3	29.2	177.6	-57.2	0	0	0	0	114.5	S520 D522 S562 I582	S520-S565 WeakPolarHBondContact CB-OG 3.41Å; D522-S565 PolarHBondContact OD1-OG 2.86Å; D522-S565 WeakPolarHBondContact OD2-CB 3.29Å; D522-S565 PolarHBondContact OD2-OG 3.45Å; S562-S565 PolarHBondContact O-N 3.13Å; S565-I582 VanDerWaalsContact C-CD1 3.43Å; S565-I582 WeakPolarHBondContact O-CD1 3.24Å
566	E	87.8	Confident	91.7	Very high	73 Å²	73	24.2 Å²	24.2	34%	0.341	12%	0.122	S	C	.	.	S	Bend	trans	-98.9	-30	177.7	-64.9	-166.1	145.6	0	0	113.8	S562 D564 I582 R583 K606	S562-E566 PolarHBondContact OG-N 3.26Å; D564-E566 HydrophobicContact CB-CG 4.43Å; D564-E566 PolarHBondContact O-N 2.95Å; D564-E566 VanDerWaalsContact O-N 3.13Å; D564-E566 PolarHBondContact OD1-N 2.82Å; E566-I582 PolarHBondContact O-N 3.26Å; E566-R583 IonicContact OE1-NH2 3.57Å; E566-K606 IonicContact OE2-NZ 3.83Å; E566-K606 PolarHBondContact OE2-NZ 3.13Å
567	V	90.2	Very high	91.4	Very high	18 Å²	18	24.5 Å²	24.5	11%	0.109	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.5	-169.1	179	0	0	0	0	110.7	S562 V569 V579 W580 I602 K606	S562-V567 PolarHBondContact N-O 2.65Å; S562-V567 PolarHBondContact OG-N 3.44Å; S562-V567 PolarHBondContact OG-O 2.93Å; V567-V569 HydrophobicContact CG1-CG2 4.26Å; V567-V579 HydrophobicContact CG1-CG1 3.37Å; V567-W580 WeakPolarHBondContact CA-O 3.34Å; V567-I602 HydrophobicContact CG1-CD1 4.44Å; V567-K606 HydrophobicContact CG2-CD 4.18Å
568	V	92.6	Very high	91.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	138.2	169.5	172	0	0	0	0	108.7	V527 I537 L549 V559 A560 I561 T570 V579 W580 I582	V527-V568 HydrophobicContact CG1-CG1 3.99Å; V527-V568 HydrophobicContact CG2-CG2 3.83Å; I537-V568 HydrophobicContact CD1-CG2 4.3Å; L549-V568 HydrophobicContact CD1-CG1 4.22Å; V559-V568 HydrophobicContact CG1-CG1 3.99Å; A560-V568 CarbonylContact O-C 3.56Å; A560-V568 WeakPolarHBondContact O-CA 3.29Å; I561-V568 HydrophobicContact CG1-CG2 4.35Å; V568-T570 HydrophobicContact CG1-CG2 3.88Å; V568-V579 CarbonylContact O-C 3.46Å; V568-V579 WeakPolarHBondContact O-CA 3.46Å; V568-W580 HydrophobicContact CB-CB 4.31Å; V568-W580 PolarHBondContact N-O 3.22Å; V568-W580 PolarHBondContact O-N 2.79Å; V568-I582 HydrophobicContact CB-CG1 4.47Å; V568-I582 HydrophobicContact CG2-CD1 3.68Å; V568-I582 HydrophobicContact CG2-CG1 3.44Å; V568-I582 VanDerWaalsContact CG2-CG1 3.44Å
569	V	93.2	Very high	90.9	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.9	170.8	-176.8	0	0	0	0	109.2	V559 A560 V567 I577 R578 V579 V600 I602 L609	V559-V569 CarbonylContact C-O 3.59Å; V559-V569 WeakPolarHBondContact CA-O 3.43Å; A560-V569 PolarHBondContact N-O 2.83Å; A560-V569 PolarHBondContact O-N 2.77Å; V567-V569 HydrophobicContact CG1-CG2 4.26Å; V569-I577 HydrophobicContact CG1-CG2 3.49Å; V569-I577 VanDerWaalsContact CG1-CG2 3.49Å; V569-R578 CarbonylContact C-O 3.5Å; V569-R578 VanDerWaalsContact CA-O 3.26Å; V569-R578 WeakPolarHBondContact CA-O 3.42Å; V569-V579 HydrophobicContact CG1-CG2 4.46Å; V569-V579 HydrophobicContact CG2-CB 4.5Å; V569-V579 HydrophobicContact CG2-CG1 4.23Å; V569-V579 HydrophobicContact CG2-CG2 4.03Å; V569-V600 HydrophobicContact CG1-CB 4.31Å; V569-V600 HydrophobicContact CG1-CG2 4.32Å; V569-I602 HydrophobicContact CG2-CD1 4.19Å; V569-L609 HydrophobicContact CB-CD2 4.34Å; V569-L609 HydrophobicContact CG1-CD2 4.21Å; V569-L609 HydrophobicContact CG2-CD2 3.65Å
570	T	94.8	Very high	90.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.3	179.2	59.3	0	0	0	0	109.7	A535 H552 V556 S558 V559 V568 I577 R578 W580	A535-T570 HydrophobicContact CB-CG2 3.84Å; H552-T570 WeakPolarHBondContact NE2-CB 3.36Å; H552-T570 PolarHBondContact NE2-OG1 3.39Å; V556-T570 HydrophobicContact CG1-CG2 4.43Å; S558-T570 CarbonylContact O-C 3.55Å; S558-T570 WeakPolarHBondContact O-CA 3.41Å; V559-T570 HydrophobicContact CG2-CG2 4.17Å; V568-T570 HydrophobicContact CG1-CG2 3.88Å; T570-I577 CarbonylContact O-C 3.57Å; T570-I577 VanDerWaalsContact O-CA 3.31Å; T570-I577 WeakPolarHBondContact O-CA 3.26Å; T570-R578 PolarHBondContact N-O 3.36Å; T570-R578 PolarHBondContact O-N 3.17Å; T570-W580 PolarHBondContact OG1-NE1 3.17Å
571	G	93.2	Very high	90.4	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.6	171.9	0	0	0	0	0	110	L557 S558	L557-G571 PolarHBondContact N-O 3.35Å; S558-G571 PolarHBondContact N-O 2.92Å; S558-G571 PolarHBondContact O-N 2.89Å
572	S	93.6	Very high	90.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	157.2	-176.4	169.2	0	0	0	0	112.7	H552 D554 D555 D574 G575 S576 I597	H552-S572 WeakPolarHBondContact CE1-CB 3.16Å; H552-S572 WeakPolarHBondContact ND1-CB 3.06Å; D554-S572 PolarHBondContact O-OG 3.1Å; D555-S572 CarbonylContact O-C 3.57Å; D555-S572 WeakPolarHBondContact O-CA 3.38Å; D555-S572 VanDerWaalsContact O-CB 3.23Å; D555-S572 WeakPolarHBondContact O-CB 3.44Å; D555-S572 PolarHBondContact O-OG 3.46Å; S572-D574 WeakPolarHBondContact CB-OD1 3.3Å; S572-D574 PolarHBondContact O-N 2.08Å; S572-D574 PolarHBondContact OG-N 3.07Å; S572-D574 PolarHBondContact OG-OD1 3.36Å; S572-G575 PolarHBondContact O-N 3.03Å; S572-G575 VanDerWaalsContact O-N 3.1Å; S572-S576 PolarHBondContact N-O 2.81Å; S572-S576 VanDerWaalsContact N-O 3.13Å; S572-I597 WeakPolarHBondContact O-CB 3.19Å; S572-I597 PolarHBondContact O-N 2.89Å
573	W	92.4	Very high	90.1	Very high	115 Å²	115	34.2 Å²	34.2	44%	0.436	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-19	168.5	-161	-97.5	0	0	0	112.9	D554 D555 L557 G575 E596 L598	D554-W573 HydrophobicContact CB-CB 4.14Å; D555-W573 HydrophobicContact CB-CB 4.13Å; D555-W573 PolarHBondContact O-N 3.05Å; L557-W573 HydrophobicContact CD1-CD2 4.48Å; L557-W573 HydrophobicContact CD1-CE3 3.42Å; L557-W573 VanDerWaalsContact CD1-CE3 3.42Å; L557-W573 HydrophobicContact CD1-CZ3 3.92Å; L557-W573 HydrophobicContact CG-CE3 4.45Å; W573-G575 PolarHBondContact O-N 2.79Å; W573-E596 HydrophobicContact CD2-CB 3.89Å; W573-E596 HydrophobicContact CD2-CG 3.89Å; W573-E596 HydrophobicContact CE3-CB 3.8Å; W573-E596 HydrophobicContact CE3-CG 4.3Å; W573-E596 HydrophobicContact CG-CB 4.39Å; W573-E596 HydrophobicContact CG-CG 4.21Å; W573-E596 HydrophobicContact CZ2-CG 4.22Å; W573-E596 HydrophobicContact CZ3-CB 4.19Å; W573-L598 HydrophobicContact CE3-CD2 4.3Å; W573-L598 HydrophobicContact CZ3-CD2 3.72Å
574	D	88.5	Confident	89.9	Confident	39 Å²	39	33.4 Å²	33.4	21%	0.209	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-3.1	172.5	72.7	6.7	0	0	0	113.5	H552 A553 D554 S572 S576	H552-D574 VanDerWaalsContact CA-OD2 3.29Å; H552-D574 WeakPolarHBondContact CA-OD2 3.36Å; H552-D574 IonicContact CG-OD2 2.81Å; H552-D574 IonicContact ND1-OD1 3.15Å; H552-D574 PolarHBondContact ND1-OD1 3.25Å; H552-D574 IonicContact ND1-OD2 3.32Å; H552-D574 PolarHBondContact ND1-OD2 3.12Å; H552-D574 VanDerWaalsContact ND1-OD2 3.1Å; A553-D574 HydrophobicContact CB-CB 4.07Å; A553-D574 PolarHBondContact N-OD2 3.18Å; D554-D574 HydrophobicContact CB-CB 3.76Å; S572-D574 WeakPolarHBondContact CB-OD1 3.3Å; S572-D574 PolarHBondContact O-N 2.08Å; S572-D574 PolarHBondContact OG-N 3.07Å; S572-D574 PolarHBondContact OG-OD1 3.36Å; D574-S576 VanDerWaalsContact C-N 3.29Å; D574-S576 PolarHBondContact O-N 2.71Å; D574-S576 WeakPolarHBondContact OD1-CA 3.2Å; D574-S576 WeakPolarHBondContact OD1-CB 3.32Å; D574-S576 PolarHBondContact OD1-N 2.73Å; D574-S576 PolarHBondContact OD1-OG 2.8Å; D574-S576 PolarHBondContact OD2-OG 2.83Å
575	G	85.9	Confident	89.9	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.01	14%	0.136	C	C	.	.	S	Bend	trans	75.2	16.7	-178.9	0	0	0	0	0	114.2	S572 W573 T592 S593 I595	S572-G575 PolarHBondContact O-N 3.03Å; S572-G575 VanDerWaalsContact O-N 3.1Å; W573-G575 PolarHBondContact O-N 2.79Å; G575-T592 WeakPolarHBondContact O-CA 3.32Å; G575-S593 PolarHBondContact O-N 2.82Å; G575-S593 PolarHBondContact O-OG 2.6Å; G575-I595 WeakPolarHBondContact CA-O 3.22Å
576	S	87	Confident	89.6	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	145.4	175.2	78.7	0	0	0	0	113.5	H552 S572 D574 R578 F591	H552-S576 PolarHBondContact CE1-OG 3.3Å; H552-S576 VanDerWaalsContact CE1-OG 3.29Å; H552-S576 PolarHBondContact ND1-OG 3.09Å; S572-S576 PolarHBondContact N-O 2.81Å; S572-S576 VanDerWaalsContact N-O 3.13Å; D574-S576 VanDerWaalsContact C-N 3.29Å; D574-S576 PolarHBondContact O-N 2.71Å; D574-S576 WeakPolarHBondContact OD1-CA 3.2Å; D574-S576 WeakPolarHBondContact OD1-CB 3.32Å; D574-S576 PolarHBondContact OD1-N 2.73Å; D574-S576 PolarHBondContact OD1-OG 2.8Å; D574-S576 PolarHBondContact OD2-OG 2.83Å; S576-R578 PolarHBondContact OG-NE 3.25Å; S576-F591 CarbonylContact C-O 3.48Å; S576-F591 WeakPolarHBondContact CA-O 3.19Å; S576-F591 VanDerWaalsContact CB-O 3.27Å; S576-F591 WeakPolarHBondContact CB-O 3.32Å
577	I	89.3	Confident	89.5	Confident	6 Å²	6	32 Å²	32	3%	0.031	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	119.9	170.3	-58.4	166.8	0	0	0	106.3	V569 T570 W590 F591 I597 V600 A611 L624	V569-I577 HydrophobicContact CG1-CG2 3.49Å; V569-I577 VanDerWaalsContact CG1-CG2 3.49Å; T570-I577 CarbonylContact O-C 3.57Å; T570-I577 VanDerWaalsContact O-CA 3.31Å; T570-I577 WeakPolarHBondContact O-CA 3.26Å; I577-W590 CarbonylContact O-C 3.59Å; I577-W590 VanDerWaalsContact O-CA 3.29Å; I577-W590 WeakPolarHBondContact O-CA 3.29Å; I577-F591 HydrophobicContact CB-CB 4.5Å; I577-F591 HydrophobicContact CB-CD2 4.5Å; I577-F591 PolarHBondContact N-O 3.41Å; I577-F591 PolarHBondContact O-N 2.87Å; I577-I597 HydrophobicContact CD1-CD1 4.15Å; I577-I597 HydrophobicContact CG1-CD1 4.09Å; I577-I597 HydrophobicContact CG1-CG1 3.91Å; I577-I597 HydrophobicContact CG1-CG2 4.36Å; I577-V600 HydrophobicContact CG1-CG1 4.39Å; I577-V600 HydrophobicContact CG2-CG1 4.38Å; I577-A611 HydrophobicContact CD1-CB 3.45Å; I577-A611 VanDerWaalsContact CD1-CB 3.45Å; I577-A611 HydrophobicContact CG1-CB 4.32Å; I577-L624 HydrophobicContact CD1-CD1 3.92Å
578	R	88.9	Confident	89.2	Confident	29 Å²	29	32.9 Å²	32.9	11%	0.109	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	141	-179.3	-59.6	-174.4	177.4	-131.9	3	110.4	G551 H552 V569 T570 S576 W580 W590	G551-R578 VanDerWaalsContact C-NH2 3.33Å; G551-R578 VanDerWaalsContact CA-NH1 3.31Å; G551-R578 PolarHBondContact O-NH1 3.06Å; G551-R578 VanDerWaalsContact O-NH1 3.13Å; G551-R578 PolarHBondContact O-NH2 2.94Å; H552-R578 VanDerWaalsContact CE1-CD 3.48Å; H552-R578 WeakPolarHBondContact CE1-CD 3.29Å; H552-R578 VanDerWaalsContact CE1-CG 3.47Å; H552-R578 WeakPolarHBondContact CE1-CG 3.47Å; V569-R578 CarbonylContact C-O 3.5Å; V569-R578 VanDerWaalsContact CA-O 3.26Å; V569-R578 WeakPolarHBondContact CA-O 3.42Å; T570-R578 PolarHBondContact N-O 3.36Å; T570-R578 PolarHBondContact O-N 3.17Å; S576-R578 PolarHBondContact OG-NE 3.25Å; R578-W580 HydrophobicContact CB-CZ2 3.6Å; R578-W580 VanDerWaalsContact CD-CZ2 3.46Å; R578-W580 HydrophobicContact CG-CZ2 4.15Å; R578-W590 HydrophobicContact CB-CB 4.38Å; R578-W590 HydrophobicContact CG-CB 3.73Å
579	V	90.7	Very high	88.7	Confident	10 Å²	10	33 Å²	33	6%	0.061	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	128.2	179.5	-175.4	0	0	0	0	108.1	V567 V568 V569 M588 C589 F591 L609	V567-V579 HydrophobicContact CG1-CG1 3.37Å; V568-V579 CarbonylContact O-C 3.46Å; V568-V579 WeakPolarHBondContact O-CA 3.46Å; V569-V579 HydrophobicContact CG1-CG2 4.46Å; V569-V579 HydrophobicContact CG2-CB 4.5Å; V569-V579 HydrophobicContact CG2-CG1 4.23Å; V569-V579 HydrophobicContact CG2-CG2 4.03Å; V579-M588 HydrophobicContact CG1-CB 4.5Å; V579-M588 PolarHBondContact O-N 3.32Å; V579-C589 PolarHBondContact N-O 3.33Å; V579-C589 PolarHBondContact O-N 2.82Å; V579-F591 HydrophobicContact CG2-CE2 4.14Å; V579-L609 HydrophobicContact CG2-CD1 4.03Å
580	W	90.4	Very high	88.2	Confident	5 Å²	5	37.5 Å²	37.5	2%	0.019	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146.4	-172.6	-44.9	85.9	0	0	0	110.1	L549 E550 V567 V568 T570 R578 N586 Q587	L549-W580 HydrophobicContact CB-CD2 3.96Å; L549-W580 HydrophobicContact CB-CE3 3.95Å; L549-W580 HydrophobicContact CB-CH2 4.09Å; L549-W580 HydrophobicContact CB-CZ2 4.06Å; L549-W580 HydrophobicContact CB-CZ3 4.02Å; L549-W580 HydrophobicContact CD1-CB 4.13Å; L549-W580 HydrophobicContact CD1-CD2 3.97Å; L549-W580 HydrophobicContact CD1-CG 3.73Å; L549-W580 HydrophobicContact CD2-CB 4.21Å; L549-W580 HydrophobicContact CD2-CD2 4.03Å; L549-W580 HydrophobicContact CD2-CE3 3.83Å; L549-W580 HydrophobicContact CD2-CG 4.2Å; L549-W580 HydrophobicContact CG-CD2 4.2Å; L549-W580 HydrophobicContact CG-CE3 4.32Å; L549-W580 HydrophobicContact CG-CG 4.4Å; E550-W580 WeakPolarHBondContact O-CH2 3.24Å; V567-W580 WeakPolarHBondContact CA-O 3.34Å; V568-W580 HydrophobicContact CB-CB 4.31Å; V568-W580 PolarHBondContact N-O 3.22Å; V568-W580 PolarHBondContact O-N 2.79Å; T570-W580 PolarHBondContact OG1-NE1 3.17Å; R578-W580 HydrophobicContact CB-CZ2 3.6Å; R578-W580 VanDerWaalsContact CD-CZ2 3.46Å; R578-W580 HydrophobicContact CG-CZ2 4.15Å; W580-N586 WeakPolarHBondContact CA-O 3.4Å; W580-Q587 HydrophobicContact CD2-CB 4.38Å; W580-Q587 HydrophobicContact CD2-CG 4.21Å; W580-Q587 HydrophobicContact CE3-CB 3.59Å; W580-Q587 HydrophobicContact CE3-CG 3.86Å; W580-Q587 HydrophobicContact CH2-CB 4.23Å; W580-Q587 HydrophobicContact CH2-CG 4.03Å; W580-Q587 HydrophobicContact CZ2-CG 4.39Å; W580-Q587 HydrophobicContact CZ3-CB 3.5Å; W580-Q587 HydrophobicContact CZ3-CG 3.77Å
581	R	88	Confident	87.6	Confident	80 Å²	80	38 Å²	38	30%	0.302	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.7	170.8	-170.7	-179	-63.3	149.7	-0.4	109.4	D13 R583 D584 G585 N586 M588	D13-R581 IonicContact OD2-NH2 3.97Å; D13-R581 PolarHBondContact OD2-NH2 3.47Å; R581-R583 PolarHBondContact O-N 2.89Å; R581-D584 WeakPolarHBondContact CD-OD2 3.19Å; R581-D584 IonicContact CZ-OD2 3Å; R581-D584 IonicContact NH1-OD2 3.49Å; R581-D584 PolarHBondContact NH1-OD2 2.78Å; R581-D584 PolarHBondContact O-N 2.84Å; R581-G585 WeakPolarHBondContact O-CA 3.37Å; R581-G585 PolarHBondContact O-N 3.2Å; R581-N586 PolarHBondContact N-O 3.43Å; R581-M588 HydrophobicContact CB-CG 4.09Å; R581-M588 HydrophobicContact CB-SD 4.01Å
582	I	89.6	Confident	87	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-45.2	-176.4	-72.1	170.7	0	0	0	111.7	Y525 I537 H547 I561 S565 E566 V568 D584	Y525-I582 HydrophobicContact CD1-CG2 3.79Å; Y525-I582 HydrophobicContact CD2-CG2 3.95Å; Y525-I582 HydrophobicContact CE1-CG2 3.75Å; Y525-I582 HydrophobicContact CE2-CG2 3.9Å; Y525-I582 HydrophobicContact CG-CG2 3.88Å; I537-I582 HydrophobicContact CD1-CG1 4.28Å; I537-I582 HydrophobicContact CG2-CG2 4.41Å; H547-I582 PolarHBondContact CD2-O 2.9Å; H547-I582 VanDerWaalsContact CD2-O 3.23Å; I561-I582 HydrophobicContact CG2-CD1 4Å; S565-I582 VanDerWaalsContact C-CD1 3.43Å; S565-I582 WeakPolarHBondContact O-CD1 3.24Å; E566-I582 PolarHBondContact O-N 3.26Å; V568-I582 HydrophobicContact CB-CG1 4.47Å; V568-I582 HydrophobicContact CG2-CD1 3.68Å; V568-I582 HydrophobicContact CG2-CG1 3.44Å; V568-I582 VanDerWaalsContact CG2-CG1 3.44Å; I582-D584 PolarHBondContact O-N 3.33Å
583	R	88.8	Confident	86.1	Confident	169 Å²	169	42.2 Å²	42.2	64%	0.638	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-43.5	-174.9	-63.6	-171.9	-176.1	176.1	6.9	113.2	H547 E566 R581	H547-R583 PolarHBondContact NE2-O 2.84Å; E566-R583 IonicContact OE1-NH2 3.57Å; R581-R583 PolarHBondContact O-N 2.89Å
584	D	86.1	Confident	85.3	Confident	74 Å²	74	42 Å²	42	40%	0.396	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-11.6	-172.6	-55.6	-30.3	0	0	0	113.1	R581 I582 N586	R581-D584 WeakPolarHBondContact CD-OD2 3.19Å; R581-D584 IonicContact CZ-OD2 3Å; R581-D584 IonicContact NH1-OD2 3.49Å; R581-D584 PolarHBondContact NH1-OD2 2.78Å; R581-D584 PolarHBondContact O-N 2.84Å; I582-D584 PolarHBondContact O-N 3.33Å; D584-N586 HydrophobicContact CB-CB 4.16Å; D584-N586 PolarHBondContact O-N 3.34Å
585	G	87	Confident	84.9	Confident	11 Å²	11	41.3 Å²	41.3	11%	0.113	20%	0.198	C	C	.	.			trans	67.7	-0.1	-171.1	0	0	0	0	0	114.1	H547 L549 R581	H547-G585 VanDerWaalsContact CD2-CA 3.47Å; H547-G585 WeakPolarHBondContact CD2-CA 3.38Å; H547-G585 PolarHBondContact CD2-N 2.72Å; H547-G585 VanDerWaalsContact CG-CA 3.47Å; H547-G585 PolarHBondContact NE2-N 3.11Å; L549-G585 WeakPolarHBondContact CD2-O 3.35Å; R581-G585 WeakPolarHBondContact O-CA 3.37Å; R581-G585 PolarHBondContact O-N 3.2Å
586	N	84.9	Confident	84.8	Confident	74 Å²	74	43.6 Å²	43.6	40%	0.396	21%	0.209	S	C	.	.			trans	-76.3	139.4	-173.5	-76.3	-28.3	0	0	0	112	W580 R581 D584 M588	W580-N586 WeakPolarHBondContact CA-O 3.4Å; R581-N586 PolarHBondContact N-O 3.43Å; D584-N586 HydrophobicContact CB-CB 4.16Å; D584-N586 PolarHBondContact O-N 3.34Å; N586-M588 PolarHBondContact O-N 2.59Å
587	Q	85.5	Confident	84.9	Confident	36 Å²	36	43.5 Å²	43.5	17%	0.168	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	117.5	170.4	-158.2	-171.1	-78.4	0	0	110.2	W580	W580-Q587 HydrophobicContact CD2-CB 4.38Å; W580-Q587 HydrophobicContact CD2-CG 4.21Å; W580-Q587 HydrophobicContact CE3-CB 3.59Å; W580-Q587 HydrophobicContact CE3-CG 3.86Å; W580-Q587 HydrophobicContact CH2-CB 4.23Å; W580-Q587 HydrophobicContact CH2-CG 4.03Å; W580-Q587 HydrophobicContact CZ2-CG 4.39Å; W580-Q587 HydrophobicContact CZ3-CB 3.5Å; W580-Q587 HydrophobicContact CZ3-CG 3.77Å
588	M	83.2	Confident	84.8	Confident	38 Å²	38	45.6 Å²	45.6	19%	0.187	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-50.5	176	-66.7	-176.1	59.6	0	0	110.9	G5 V579 R581 N586	G5-M588 WeakPolarHBondContact CA-O 3.47Å; V579-M588 HydrophobicContact CG1-CB 4.5Å; V579-M588 PolarHBondContact O-N 3.32Å; R581-M588 HydrophobicContact CB-CG 4.09Å; R581-M588 HydrophobicContact CB-SD 4.01Å; N586-M588 PolarHBondContact O-N 2.59Å
589	C	81.7	Confident	84.8	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	167.2	178.2	65.3	0	0	0	0	110.7	V579 F591	V579-C589 PolarHBondContact N-O 3.33Å; V579-C589 PolarHBondContact O-N 2.82Å; C589-F591 HydrophobicContact CB-CZ 4.44Å; C589-F591 VanDerWaalsContact SG-CE2 3.54Å
590	W	83	Confident	84.8	Confident	96 Å²	96	47.3 Å²	47.3	36%	0.364	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.6	172.4	67.1	-71.8	0	0	0	110	I577 R578 T592	I577-W590 CarbonylContact O-C 3.59Å; I577-W590 VanDerWaalsContact O-CA 3.29Å; I577-W590 WeakPolarHBondContact O-CA 3.29Å; R578-W590 HydrophobicContact CB-CB 4.38Å; R578-W590 HydrophobicContact CG-CB 3.73Å; W590-T592 HydrophobicContact CH2-CG2 4.36Å; W590-T592 HydrophobicContact CZ3-CG2 3.78Å
591	F	81.6	Confident	84.8	Confident	11 Å²	11	50.1 Å²	50.1	5%	0.048	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144.4	179.3	-51.1	-81.3	0	0	0	107.6	M1 A3 V17 S576 I577 V579 C589 L624	M1-F591 HydrophobicContact CE-CD1 4.33Å; A3-F591 HydrophobicContact CB-CD1 4.04Å; A3-F591 HydrophobicContact CB-CE1 3.82Å; V17-F591 HydrophobicContact CB-CE1 4.05Å; V17-F591 HydrophobicContact CG2-CE1 3.61Å; V17-F591 HydrophobicContact CG2-CZ 3.66Å; S576-F591 CarbonylContact C-O 3.48Å; S576-F591 WeakPolarHBondContact CA-O 3.19Å; S576-F591 VanDerWaalsContact CB-O 3.27Å; S576-F591 WeakPolarHBondContact CB-O 3.32Å; I577-F591 HydrophobicContact CB-CB 4.5Å; I577-F591 HydrophobicContact CB-CD2 4.5Å; I577-F591 PolarHBondContact N-O 3.41Å; I577-F591 PolarHBondContact O-N 2.87Å; V579-F591 HydrophobicContact CG2-CE2 4.14Å; C589-F591 HydrophobicContact CB-CZ 4.44Å; C589-F591 VanDerWaalsContact SG-CE2 3.54Å; F591-L624 HydrophobicContact CB-CD1 4.21Å; F591-L624 HydrophobicContact CD2-CD1 3.84Å; F591-L624 HydrophobicContact CE2-CD1 4.36Å; F591-L624 HydrophobicContact CG-CD1 3.92Å
592	T	82.2	Confident	84.8	Confident	53 Å²	53	47.5 Å²	47.5	33%	0.325	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.7	170.1	179.5	0	0	0	0	108.9	G575 W590 N594	G575-T592 WeakPolarHBondContact O-CA 3.32Å; W590-T592 HydrophobicContact CH2-CG2 4.36Å; W590-T592 HydrophobicContact CZ3-CG2 3.78Å; T592-N594 PolarHBondContact OG1-N 3.06Å
593	S	74.7	Confident	84.7	Confident	36 Å²	36	47.5 Å²	47.5	25%	0.252	23%	0.232	S	C	.	.			trans	-109.6	-4.7	175.7	66.2	0	0	0	0	112	G575 I595 I622	G575-S593 PolarHBondContact O-N 2.82Å; G575-S593 PolarHBondContact O-OG 2.6Å; S593-I595 PolarHBondContact O-N 3.17Å; S593-I595 VanDerWaalsContact O-N 3.13Å; S593-I595 WeakPolarHBondContact OG-CB 3.27Å; S593-I595 PolarHBondContact OG-N 2.9Å; S593-I595 PolarHBondContact OG-O 3.4Å; S593-I622 WeakPolarHBondContact OG-CD1 3.28Å
594	N	75.5	Confident	84.5	Confident	110 Å²	110	43 Å²	43	59%	0.588	22%	0.22	S	C	*	.	S	Bend	trans	50.9	21.7	-164.9	-56.3	-52.5	0	0	0	113.2	T592 R615	T592-N594 PolarHBondContact OG1-N 3.06Å; N594-R615 WeakPolarHBondContact O-CD 3.06Å; N594-R615 PolarHBondContact O-NH1 3.2Å
595	I	79.6	Confident	84.3	Confident	25 Å²	25	42.5 Å²	42.5	13%	0.128	22%	0.218	C	C	.	.	S	Bend	trans	-117.8	127.7	175.5	-61.5	159.5	0	0	0	106	G575 S593 I597 R615 K620 I622	G575-I595 WeakPolarHBondContact CA-O 3.22Å; S593-I595 PolarHBondContact O-N 3.17Å; S593-I595 VanDerWaalsContact O-N 3.13Å; S593-I595 WeakPolarHBondContact OG-CB 3.27Å; S593-I595 PolarHBondContact OG-N 2.9Å; S593-I595 PolarHBondContact OG-O 3.4Å; I595-I597 VanDerWaalsContact O-CD1 3.32Å; I595-I597 WeakPolarHBondContact O-CD1 3.35Å; I595-I597 PolarHBondContact O-N 3.24Å; I595-R615 HydrophobicContact CG1-CB 4.45Å; I595-R615 HydrophobicContact CG2-CB 4.04Å; I595-K620 HydrophobicContact CD1-CD 3.86Å; I595-I622 HydrophobicContact CD1-CD1 4.37Å
596	E	84.2	Confident	84	Confident	49 Å²	49	45 Å²	45	23%	0.229	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	120	-178.1	-59	88.6	155.1	0	0	109.9	W573 G613 E614 R615	W573-E596 HydrophobicContact CD2-CB 3.89Å; W573-E596 HydrophobicContact CD2-CG 3.89Å; W573-E596 HydrophobicContact CE3-CB 3.8Å; W573-E596 HydrophobicContact CE3-CG 4.3Å; W573-E596 HydrophobicContact CG-CB 4.39Å; W573-E596 HydrophobicContact CG-CG 4.21Å; W573-E596 HydrophobicContact CZ2-CG 4.22Å; W573-E596 HydrophobicContact CZ3-CB 4.19Å; E596-G613 CarbonylContact O-C 3.59Å; E596-G613 WeakPolarHBondContact O-CA 3.48Å; E596-E614 WeakPolarHBondContact CB-O 3.44Å; E596-E614 PolarHBondContact O-N 3.03Å; E596-R615 WeakPolarHBondContact OE2-CB 3.47Å; E596-R615 WeakPolarHBondContact OE2-CG 3.43Å
597	I	87.9	Confident	83.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	117.6	-172.8	-54.4	-61.8	0	0	0	109.8	S572 I577 I595 V600 A611 I622	S572-I597 WeakPolarHBondContact O-CB 3.19Å; S572-I597 PolarHBondContact O-N 2.89Å; I577-I597 HydrophobicContact CD1-CD1 4.15Å; I577-I597 HydrophobicContact CG1-CD1 4.09Å; I577-I597 HydrophobicContact CG1-CG1 3.91Å; I577-I597 HydrophobicContact CG1-CG2 4.36Å; I595-I597 VanDerWaalsContact O-CD1 3.32Å; I595-I597 WeakPolarHBondContact O-CD1 3.35Å; I595-I597 PolarHBondContact O-N 3.24Å; I597-V600 HydrophobicContact CG2-CG1 3.6Å; I597-A611 HydrophobicContact CD1-CB 4.36Å; I597-A611 HydrophobicContact CG2-CB 4.09Å; I597-I622 HydrophobicContact CD1-CD1 3.7Å
598	L	87.4	Confident	83.5	Confident	51 Å²	51	47 Å²	47	27%	0.267	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-41	-179.4	-60.4	-177.4	0	0	0	112.6	L557 S558 W573 L612 E614	L557-L598 HydrophobicContact CD1-CD2 3.82Å; S558-L598 WeakPolarHBondContact CB-O 3.27Å; W573-L598 HydrophobicContact CE3-CD2 4.3Å; W573-L598 HydrophobicContact CZ3-CD2 3.72Å; L598-L612 PolarHBondContact N-O 3.45Å; L598-E614 HydrophobicContact CD1-CB 3.71Å; L598-E614 HydrophobicContact CG-CB 4.2Å
599	Q	89.3	Confident	83.6	Confident	68 Å²	68	45.7 Å²	45.7	32%	0.318	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	139.7	-177.2	-166.8	178	34.7	0	0	110.5	S558 A611 L612	S558-Q599 WeakPolarHBondContact OG-CA 3.44Å; Q599-A611 CarbonylContact O-C 3.57Å; Q599-A611 WeakPolarHBondContact O-CA 3.36Å; Q599-L612 HydrophobicContact CB-CB 4.28Å; Q599-L612 HydrophobicContact CB-CD1 4.45Å; Q599-L612 PolarHBondContact N-O 2.95Å; Q599-L612 PolarHBondContact O-N 3.23Å
600	V	90.6	Very high	83.7	Confident	7 Å²	7	45.7 Å²	45.7	4%	0.042	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.7	170.1	-65.1	0	0	0	0	110.3	S558 A560 V569 I577 I597 V610 A611	S558-V600 PolarHBondContact OG-N 2.97Å; A560-V600 HydrophobicContact CB-CG2 4.05Å; V569-V600 HydrophobicContact CG1-CB 4.31Å; V569-V600 HydrophobicContact CG1-CG2 4.32Å; I577-V600 HydrophobicContact CG1-CG1 4.39Å; I577-V600 HydrophobicContact CG2-CG1 4.38Å; I597-V600 HydrophobicContact CG2-CG1 3.6Å; V600-V610 CarbonylContact C-O 3.53Å; V600-V610 WeakPolarHBondContact CA-O 3.07Å; V600-A611 HydrophobicContact CG1-CB 4.05Å
601	K	90.4	Very high	83.8	Confident	64 Å²	64	41.2 Å²	41.2	28%	0.278	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	146.3	171.4	-66.8	-164.8	176.6	-173.2	0	109.5	V263 I265 L609 V610	V263-K601 HydrophobicContact CG1-CD 4.23Å; V263-K601 VanDerWaalsContact O-CE 3.24Å; V263-K601 WeakPolarHBondContact O-CE 3.28Å; V263-K601 PolarHBondContact O-NZ 3.31Å; I265-K601 HydrophobicContact CD1-CB 3.83Å; I265-K601 HydrophobicContact CG1-CB 4.39Å; K601-L609 WeakPolarHBondContact O-CA 3.41Å; K601-V610 PolarHBondContact N-O 3.21Å; K601-V610 PolarHBondContact O-N 3.2Å
602	I	88.8	Confident	83.9	Confident	24 Å²	24	41.1 Å²	41.1	12%	0.123	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.8	174.9	-171.5	166.9	0	0	0	108.9	A560 I561 V567 V569 K606 L609	A560-I602 HydrophobicContact CB-CG2 4.31Å; I561-I602 WeakPolarHBondContact O-CG2 3.16Å; V567-I602 HydrophobicContact CG1-CD1 4.44Å; V569-I602 HydrophobicContact CG2-CD1 4.19Å; I602-K606 HydrophobicContact CD1-CB 4.31Å; I602-K606 HydrophobicContact CD1-CG 4.07Å; I602-L609 HydrophobicContact CB-CD2 3.67Å; I602-L609 HydrophobicContact CD1-CD2 3.82Å; I602-L609 HydrophobicContact CG1-CD2 3.55Å
603	S	86.3	Confident	83.7	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.007	19%	0.189	C	C	.	.			trans	-69.1	151.5	171.5	65.6	0	0	0	0	111	D605 K606 R607 A608	S603-D605 VanDerWaalsContact CB-OD1 3.29Å; S603-D605 WeakPolarHBondContact CB-OD1 3.47Å; S603-D605 PolarHBondContact O-N 3.18Å; S603-D605 PolarHBondContact OG-OD1 3.14Å; S603-K606 PolarHBondContact O-N 2.93Å; S603-R607 PolarHBondContact OG-N 3.04Å; S603-R607 VanDerWaalsContact OG-N 3.14Å; S603-A608 PolarHBondContact N-O 3.45Å; S603-A608 PolarHBondContact OG-N 3.29Å; S603-A608 PolarHBondContact OG-O 3.11Å
604	N	85.7	Confident	83.6	Confident	73 Å²	73	39.5 Å²	39.5	39%	0.39	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-30.1	-178.6	-69.3	-22.2	0	0	0	112.5	K267 S269 L563 K606	K267-N604 PolarHBondContact O-ND2 3.4Å; S269-N604 WeakPolarHBondContact OG-CB 3.26Å; S269-N604 PolarHBondContact OG-N 3.18Å; L563-N604 HydrophobicContact CB-CB 4.44Å; L563-N604 HydrophobicContact CD2-CB 3.91Å; N604-K606 VanDerWaalsContact C-N 3.3Å
605	D	80.9	Confident	83.3	Confident	65 Å²	65	38.9 Å²	38.9	35%	0.348	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	0.9	175.9	71.9	-9.4	0	0	0	114.4	S269 S603 R607	S269-D605 PolarHBondContact OG-N 2.75Å; S603-D605 VanDerWaalsContact CB-OD1 3.29Å; S603-D605 WeakPolarHBondContact CB-OD1 3.47Å; S603-D605 PolarHBondContact O-N 3.18Å; S603-D605 PolarHBondContact OG-OD1 3.14Å; D605-R607 HydrophobicContact CB-CG 4.3Å; D605-R607 PolarHBondContact O-N 3.31Å; D605-R607 VanDerWaalsContact O-N 3.14Å; D605-R607 WeakPolarHBondContact OD1-CB 3.49Å; D605-R607 PolarHBondContact OD1-N 2.98Å; D605-R607 WeakPolarHBondContact OD2-CB 3.49Å; D605-R607 VanDerWaalsContact OD2-CD 3.25Å; D605-R607 WeakPolarHBondContact OD2-CD 3.34Å; D605-R607 WeakPolarHBondContact OD2-CG 3.4Å; D605-R607 IonicContact OD2-NE 3.84Å
606	K	81.4	Confident	82.5	Confident	62 Å²	62	42.8 Å²	42.8	27%	0.27	21%	0.207	S	C	.	.	S	Bend	trans	59	15.4	-175.6	-57.7	-178.1	-79	-174.3	0	114.4	D564 E566 V567 I602 S603 N604	D564-K606 IonicContact OD1-NZ 2.71Å; D564-K606 WeakPolarHBondContact OD2-CE 3.34Å; D564-K606 IonicContact OD2-NZ 3.54Å; D564-K606 PolarHBondContact OD2-NZ 3.17Å; E566-K606 IonicContact OE2-NZ 3.83Å; E566-K606 PolarHBondContact OE2-NZ 3.13Å; V567-K606 HydrophobicContact CG2-CD 4.18Å; I602-K606 HydrophobicContact CD1-CB 4.31Å; I602-K606 HydrophobicContact CD1-CG 4.07Å; S603-K606 PolarHBondContact O-N 2.93Å; N604-K606 VanDerWaalsContact C-N 3.3Å
607	R	78.6	Confident	81.3	Confident	150 Å²	150	41.9 Å²	41.9	57%	0.566	21%	0.211	S	C	*	.	S	Bend	trans	-89.6	-21.6	-178.6	-64.6	-170.2	-179.7	176	-0.7	114.4	S603 D605 Q625 V626	S603-R607 PolarHBondContact OG-N 3.04Å; S603-R607 VanDerWaalsContact OG-N 3.14Å; D605-R607 HydrophobicContact CB-CG 4.3Å; D605-R607 PolarHBondContact O-N 3.31Å; D605-R607 VanDerWaalsContact O-N 3.14Å; D605-R607 WeakPolarHBondContact OD1-CB 3.49Å; D605-R607 PolarHBondContact OD1-N 2.98Å; D605-R607 WeakPolarHBondContact OD2-CB 3.49Å; D605-R607 VanDerWaalsContact OD2-CD 3.25Å; D605-R607 WeakPolarHBondContact OD2-CD 3.34Å; D605-R607 WeakPolarHBondContact OD2-CG 3.4Å; D605-R607 IonicContact OD2-NE 3.84Å; R607-Q625 CarbonylContact O-C 3.56Å; R607-Q625 WeakPolarHBondContact O-CA 3.47Å; R607-V626 PolarHBondContact O-N 3.06Å
608	A	81.3	Confident	80.2	Confident	2 Å²	2	46.7 Å²	46.7	2%	0.017	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.9	179.4	0	0	0	0	0	110.4	T286 S603 L624	T286-A608 HydrophobicContact CG2-CB 4.27Å; S603-A608 PolarHBondContact N-O 3.45Å; S603-A608 PolarHBondContact OG-N 3.29Å; S603-A608 PolarHBondContact OG-O 3.11Å; A608-L624 CarbonylContact C-O 3.57Å; A608-L624 WeakPolarHBondContact CA-O 3.5Å
609	L	84.1	Confident	79.3	Confident	12 Å²	12	47.9 Å²	47.9	6%	0.063	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.3	171.9	-70.6	168.2	0	0	0	107	V569 V579 K601 I602 L624	V569-L609 HydrophobicContact CB-CD2 4.34Å; V569-L609 HydrophobicContact CG1-CD2 4.21Å; V569-L609 HydrophobicContact CG2-CD2 3.65Å; V579-L609 HydrophobicContact CG2-CD1 4.03Å; K601-L609 WeakPolarHBondContact O-CA 3.41Å; I602-L609 HydrophobicContact CB-CD2 3.67Å; I602-L609 HydrophobicContact CD1-CD2 3.82Å; I602-L609 HydrophobicContact CG1-CD2 3.55Å; L609-L624 HydrophobicContact CB-CB 3.96Å; L609-L624 PolarHBondContact N-O 3.4Å; L609-L624 PolarHBondContact O-N 3.29Å
610	V	84.7	Confident	78.4	Confident	1 Å²	1	50 Å²	50	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.3	-178.5	-173.8	0	0	0	0	108	V263 I265 V272 V600 K601 L621 I622 M623	V263-V610 HydrophobicContact CG1-CG1 4.28Å; V263-V610 HydrophobicContact CG2-CG1 3.64Å; I265-V610 HydrophobicContact CD1-CB 4.29Å; I265-V610 HydrophobicContact CD1-CG2 3.86Å; I265-V610 HydrophobicContact CG1-CG2 4.29Å; V272-V610 HydrophobicContact CG1-CG1 4.3Å; V272-V610 HydrophobicContact CG1-CG2 4.46Å; V272-V610 HydrophobicContact CG2-CG2 3.7Å; V600-V610 CarbonylContact C-O 3.53Å; V600-V610 WeakPolarHBondContact CA-O 3.07Å; K601-V610 PolarHBondContact N-O 3.21Å; K601-V610 PolarHBondContact O-N 3.2Å; V610-L621 HydrophobicContact CG1-CD1 3.48Å; V610-L621 VanDerWaalsContact CG1-CD1 3.48Å; V610-L621 HydrophobicContact CG1-CG 4.41Å; V610-I622 CarbonylContact C-O 3.53Å; V610-I622 WeakPolarHBondContact CA-O 3.49Å; V610-M623 HydrophobicContact CG2-CG 4.39Å
611	A	84.4	Confident	77.9	Confident	2 Å²	2	51 Å²	51	2%	0.017	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.5	177.4	0	0	0	0	0	110.8	I577 I597 Q599 V600 I622	I577-A611 HydrophobicContact CD1-CB 3.45Å; I577-A611 VanDerWaalsContact CD1-CB 3.45Å; I577-A611 HydrophobicContact CG1-CB 4.32Å; I597-A611 HydrophobicContact CD1-CB 4.36Å; I597-A611 HydrophobicContact CG2-CB 4.09Å; Q599-A611 CarbonylContact O-C 3.57Å; Q599-A611 WeakPolarHBondContact O-CA 3.36Å; V600-A611 HydrophobicContact CG1-CB 4.05Å; A611-I622 HydrophobicContact CB-CB 4.27Å; A611-I622 PolarHBondContact N-O 2.99Å; A611-I622 PolarHBondContact O-N 3.41Å
612	L	83.5	Confident	77.2	Confident	9 Å²	9	48.8 Å²	48.8	5%	0.047	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.8	167.5	-64.1	179	0	0	0	107.6	V260 V263 L598 Q599 L621	V260-L612 HydrophobicContact CB-CD2 4.01Å; V260-L612 HydrophobicContact CG1-CD2 3.44Å; V260-L612 VanDerWaalsContact CG1-CD2 3.44Å; V263-L612 HydrophobicContact CB-CD1 4.16Å; V263-L612 HydrophobicContact CB-CD2 4.19Å; V263-L612 HydrophobicContact CB-CG 4.26Å; V263-L612 HydrophobicContact CG1-CD1 3.77Å; V263-L612 HydrophobicContact CG1-CD2 4.21Å; V263-L612 HydrophobicContact CG1-CG 3.77Å; L598-L612 PolarHBondContact N-O 3.45Å; Q599-L612 HydrophobicContact CB-CB 4.28Å; Q599-L612 HydrophobicContact CB-CD1 4.45Å; Q599-L612 PolarHBondContact N-O 2.95Å; Q599-L612 PolarHBondContact O-N 3.23Å; L612-L621 HydrophobicContact CD2-CD1 3.76Å
613	G	78.8	Confident	76.7	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	149.8	174.3	0	0	0	0	0	111	E596 R619 K620	E596-G613 CarbonylContact O-C 3.59Å; E596-G613 WeakPolarHBondContact O-CA 3.48Å; G613-R619 CarbonylContact O-C 3.45Å; G613-R619 VanDerWaalsContact O-CA 3.29Å; G613-R619 WeakPolarHBondContact O-CA 3.29Å; G613-K620 PolarHBondContact N-O 3.37Å; G613-K620 PolarHBondContact O-N 3.46Å
614	E	72.7	Confident	76.3	Confident	54 Å²	54	48.4 Å²	48.4	25%	0.252	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131	172.9	-173.2	171.7	155.6	0	0	109.4	E596 L598 H618 R619	E596-E614 WeakPolarHBondContact CB-O 3.44Å; E596-E614 PolarHBondContact O-N 3.03Å; L598-E614 HydrophobicContact CD1-CB 3.71Å; L598-E614 HydrophobicContact CG-CB 4.2Å; E614-H618 WeakPolarHBondContact CA-O 3.38Å; E614-R619 HydrophobicContact CB-CG 4.02Å; E614-R619 HydrophobicContact CG-CG 3.86Å; E614-R619 IonicContact OE2-CZ 2.59Å; E614-R619 IonicContact OE2-NE 3.96Å; E614-R619 PolarHBondContact OE2-NE 2.87Å; E614-R619 IonicContact OE2-NH2 3.37Å; E614-R619 PolarHBondContact OE2-NH2 3.26Å
615	R	67.8	Low	75.6	Confident	97 Å²	97	46.6 Å²	46.6	37%	0.366	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	131.5	170	-174.4	165	176.8	168.1	4.1	110.5	N594 I595 E596 G617 H618	N594-R615 WeakPolarHBondContact O-CD 3.06Å; N594-R615 PolarHBondContact O-NH1 3.2Å; I595-R615 HydrophobicContact CG1-CB 4.45Å; I595-R615 HydrophobicContact CG2-CB 4.04Å; E596-R615 WeakPolarHBondContact OE2-CB 3.47Å; E596-R615 WeakPolarHBondContact OE2-CG 3.43Å; R615-G617 PolarHBondContact O-N 3.42Å; R615-H618 PolarHBondContact N-O 3.28Å; R615-H618 PolarHBondContact O-N 3.02Å
616	S	62.7	Low	74.9	Confident	106 Å²	106	44.7 Å²	44.7	74%	0.741	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	33.9	178.9	-54.3	0	0	0	0	113.6	H618	S616-H618 VanDerWaalsContact C-N 3.27Å; S616-H618 PolarHBondContact O-CD2 3.43Å; S616-H618 PolarHBondContact O-N 2.86Å
617	G	59	Low	73.7	Confident	30 Å²	30	45.5 Å²	45.5	31%	0.309	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	3.3	-178.5	0	0	0	0	0	115	K259 R615	K259-G617 WeakPolarHBondContact CE-O 3.46Å; K259-G617 PolarHBondContact NZ-O 3.11Å; R615-G617 PolarHBondContact O-N 3.42Å
618	H	64.8	Low	72.3	Confident	101 Å²	101	45.9 Å²	45.9	47%	0.468	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	120.2	173	-59.3	-73.9	0	0	0	110.1	E614 R615 S616	E614-H618 WeakPolarHBondContact CA-O 3.38Å; R615-H618 PolarHBondContact N-O 3.28Å; R615-H618 PolarHBondContact O-N 3.02Å; S616-H618 VanDerWaalsContact C-N 3.27Å; S616-H618 PolarHBondContact O-CD2 3.43Å; S616-H618 PolarHBondContact O-N 2.86Å
619	R	70.1	Confident	70.5	Confident	76 Å²	76	52 Å²	52	29%	0.287	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.2	174.2	-67.8	179.9	173.8	-170.5	-12.5	110.4	K259 V260 D261 G613 E614	K259-R619 HydrophobicContact CB-CB 4.21Å; V260-R619 WeakPolarHBondContact O-CB 3.42Å; V260-R619 WeakPolarHBondContact O-CD 3.43Å; D261-R619 WeakPolarHBondContact OD1-CD 3.38Å; D261-R619 IonicContact OD1-CZ 2.8Å; D261-R619 IonicContact OD1-NE 3.3Å; D261-R619 IonicContact OD1-NH1 2.83Å; D261-R619 PolarHBondContact OD1-NH1 3.27Å; G613-R619 CarbonylContact O-C 3.45Å; G613-R619 VanDerWaalsContact O-CA 3.29Å; G613-R619 WeakPolarHBondContact O-CA 3.29Å; E614-R619 HydrophobicContact CB-CG 4.02Å; E614-R619 HydrophobicContact CG-CG 3.86Å; E614-R619 IonicContact OE2-CZ 2.59Å; E614-R619 IonicContact OE2-NE 3.96Å; E614-R619 PolarHBondContact OE2-NE 2.87Å; E614-R619 IonicContact OE2-NH2 3.37Å; E614-R619 PolarHBondContact OE2-NH2 3.26Å
620	K	70.8	Confident	68.3	Low	114 Å²	114	60.2 Å²	60.2	50%	0.496	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140.2	-177.4	-65.1	-174.5	176.7	-174.1	0	110.5	I595 G613	I595-K620 HydrophobicContact CD1-CD 3.86Å; G613-K620 PolarHBondContact N-O 3.37Å; G613-K620 PolarHBondContact O-N 3.46Å
621	L	78.2	Confident	66	Low	27 Å²	27	64.2 Å²	64.2	14%	0.141	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.8	168.1	-174.3	74	0	0	0	109.4	V260 V263 T274 V610 L612	V260-L621 HydrophobicContact CG2-CB 4.32Å; V263-L621 HydrophobicContact CG2-CD1 4.02Å; T274-L621 HydrophobicContact CG2-CD1 3.91Å; T274-L621 HydrophobicContact CG2-CD2 3.76Å; T274-L621 HydrophobicContact CG2-CG 4.4Å; V610-L621 HydrophobicContact CG1-CD1 3.48Å; V610-L621 VanDerWaalsContact CG1-CD1 3.48Å; V610-L621 HydrophobicContact CG1-CG 4.41Å; L612-L621 HydrophobicContact CD2-CD1 3.76Å
622	I	77.3	Confident	63.4	Low	18 Å²	18	72.2 Å²	72.2	9%	0.092	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	112.9	172.4	-58.1	169.2	0	0	0	107	S593 I595 I597 V610 A611 L624	S593-I622 WeakPolarHBondContact OG-CD1 3.28Å; I595-I622 HydrophobicContact CD1-CD1 4.37Å; I597-I622 HydrophobicContact CD1-CD1 3.7Å; V610-I622 CarbonylContact C-O 3.53Å; V610-I622 WeakPolarHBondContact CA-O 3.49Å; A611-I622 HydrophobicContact CB-CB 4.27Å; A611-I622 PolarHBondContact N-O 2.99Å; A611-I622 PolarHBondContact O-N 3.41Å; I622-L624 HydrophobicContact CG2-CD2 4.22Å; I622-L624 HydrophobicContact CG2-CG 4.07Å
623	M	78.3	Confident	60.8	Low	11 Å²	11	76.9 Å²	76.9	5%	0.054	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	126.3	172.5	-167.3	179.2	-60.8	0	0	109.4	V272 W284 V610	V272-M623 HydrophobicContact CB-CE 3.91Å; V272-M623 HydrophobicContact CG1-CE 4.2Å; V272-M623 HydrophobicContact CG2-CE 3.91Å; W284-M623 HydrophobicContact CB-CE 4.08Å; V610-M623 HydrophobicContact CG2-CG 4.39Å
624	L	76.6	Confident	58.7	Low	5 Å²	5	80.6 Å²	80.6	3%	0.026	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	116	-179	-68.8	179	0	0	0	108.1	V17 L19 I577 F591 A608 L609 I622	V17-L624 HydrophobicContact CG1-CB 3.75Å; V17-L624 HydrophobicContact CG1-CD2 3.57Å; V17-L624 HydrophobicContact CG1-CG 4.21Å; L19-L624 HydrophobicContact CD2-CD2 4.06Å; I577-L624 HydrophobicContact CD1-CD1 3.92Å; F591-L624 HydrophobicContact CB-CD1 4.21Å; F591-L624 HydrophobicContact CD2-CD1 3.84Å; F591-L624 HydrophobicContact CE2-CD1 4.36Å; F591-L624 HydrophobicContact CG-CD1 3.92Å; A608-L624 CarbonylContact C-O 3.57Å; A608-L624 WeakPolarHBondContact CA-O 3.5Å; L609-L624 HydrophobicContact CB-CB 3.96Å; L609-L624 PolarHBondContact N-O 3.4Å; L609-L624 PolarHBondContact O-N 3.29Å; I622-L624 HydrophobicContact CG2-CD2 4.22Å; I622-L624 HydrophobicContact CG2-CG 4.07Å
625	Q	71	Confident	56.7	Low	35 Å²	35	84 Å²	84	16%	0.164	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	130.8	177.7	-168.7	-172.6	17.5	0	0	111.7	V17 Q287 R607 L627	V17-Q625 WeakPolarHBondContact CA-O 3.45Å; V17-Q625 WeakPolarHBondContact CG1-O 3.31Å; V17-Q625 WeakPolarHBondContact CG2-O 3.38Å; Q287-Q625 PolarHBondContact O-NE2 3.26Å; Q287-Q625 PolarHBondContact O-OE1 2.85Å; Q287-Q625 VanDerWaalsContact O-OE1 3.13Å; R607-Q625 CarbonylContact O-C 3.56Å; R607-Q625 WeakPolarHBondContact O-CA 3.47Å; Q625-L627 HydrophobicContact CG-CD2 4.28Å; Q625-L627 HydrophobicContact CG-CG 4.44Å; Q625-L627 PolarHBondContact O-N 3.45Å
626	V	66.2	Low	55	Low	25 Å²	25	85.3 Å²	85.3	15%	0.152	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	98.9	173.9	176.6	0	0	0	0	108.9	I15 R607 N629	I15-V626 HydrophobicContact CG2-CB 4.47Å; I15-V626 HydrophobicContact CG2-CG1 4.08Å; I15-V626 HydrophobicContact CG2-CG2 4.16Å; R607-V626 PolarHBondContact O-N 3.06Å; V626-N629 WeakPolarHBondContact CG1-OD1 2.87Å
627	L	56.2	Low	53.6	Low	79 Å²	79	88.4 Å²	88.4	41%	0.414	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-24.8	-175.3	-70	162.9	0	0	0	113.8	V16 V18 Q625	V16-L627 WeakPolarHBondContact O-CB 3.42Å; V16-L627 PolarHBondContact O-N 3.23Å; V18-L627 HydrophobicContact CB-CD1 3.83Å; V18-L627 HydrophobicContact CG2-CD1 3.28Å; Q625-L627 HydrophobicContact CG-CD2 4.28Å; Q625-L627 HydrophobicContact CG-CG 4.44Å; Q625-L627 PolarHBondContact O-N 3.45Å
628	R	49.8	Very low	52.2	Low	158 Å²	158	98.3 Å²	98.3	60%	0.596	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.6	123.5	-177	-65.1	-174.8	179.1	161.7	1.5	111.2	E14	E14-R628 VanDerWaalsContact O-O 3.12Å
629	N	43.9	Very low	50.5	Low	130 Å²	130	99.7 Å²	99.7	70%	0.695	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	83.7	163.2	-71.1	-6.4	0	0	0	107.9	V626	V626-N629 WeakPolarHBondContact CG1-OD1 2.87Å
630	R	38.2	Very low	48.7	Very low	185 Å²	185	100.5 Å²	100.5	70%	0.698	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	105	165.8	-81.3	-172.5	177.7	173.1	-0.3	108.4	E14 R632	E14-R630 PolarHBondContact N-O 3.32Å; R630-R632 PolarHBondContact O-N 3.01Å
631	T	35.4	Very low	46.7	Very low	85 Å²	85	102.8 Å²	102.8	52%	0.521	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	103.1	164.5	59.1	0	0	0	0	106.7	D13 T633	D13-T631 WeakPolarHBondContact OD1-CA 3.42Å; D13-T631 VanDerWaalsContact OD1-CB 3.23Å; D13-T631 WeakPolarHBondContact OD1-CB 3.27Å; D13-T631 WeakPolarHBondContact OD1-CG2 3.23Å; T631-T633 VanDerWaalsContact C-N 3.29Å; T631-T633 PolarHBondContact O-N 3.46Å
632	R	31.1	Very low	44.6	Very low	171 Å²	171	106.3 Å²	106.3	65%	0.645	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.7	91.3	174.3	-166.8	175	167	172.8	-4.6	106.6	M12 R630 T634	M12-R632 PolarHBondContact O-N 2.76Å; R630-R632 PolarHBondContact O-N 3.01Å; R632-T634 PolarHBondContact O-N 2.93Å
633	T	29.1	Very low	42.2	Very low	107 Å²	107	116.2 Å²	116.2	66%	0.656	59%	0.587	S	S	*	*			trans	-59.4	108.2	165.2	40.3	0	0	0	0	106.7	T631 T635	T631-T633 VanDerWaalsContact C-N 3.29Å; T631-T633 PolarHBondContact O-N 3.46Å; T633-T635 VanDerWaalsContact C-N 3.35Å; T633-T635 PolarHBondContact O-N 2.84Å
634	T	34.7	Very low	39.8	Very low	78 Å²	78	122.2 Å²	122.2	48%	0.479	62%	0.618	S	S	.	*			trans	-60.4	102.8	173.3	50.4	0	0	0	0	106.6	R632 N636	R632-T634 PolarHBondContact O-N 2.93Å; T634-N636 PolarHBondContact O-N 2.91Å
635	T	30.7	Very low	37.6	Very low	125 Å²	125	128.7 Å²	128.7	77%	0.767	65%	0.652	S	S	*	*			trans	-55	109.6	168.7	44.7	0	0	0	0	106.4	T633 L637	T633-T635 VanDerWaalsContact C-N 3.35Å; T633-T635 PolarHBondContact O-N 2.84Å; T635-L637 PolarHBondContact O-N 3.47Å
636	N	31.4	Very low	35.6	Very low	126 Å²	126	132 Å²	132	67%	0.674	68%	0.679	S	S	*	*			trans	-50.5	112.2	171.9	-70.5	-42.2	0	0	0	106.7	T634 R638	T634-N636 PolarHBondContact O-N 2.91Å; N636-R638 VanDerWaalsContact C-N 3.35Å; N636-R638 PolarHBondContact O-N 2.95Å
637	L	34	Very low	34	Very low	171 Å²	171	135.8 Å²	135.8	90%	0.895	71%	0.707	S	S	*	*			trans	-55.7	107.7	167.6	-83	162	0	0	0	105.6	T635 T639	T635-L637 PolarHBondContact O-N 3.47Å; L637-T639 PolarHBondContact O-N 2.84Å
638	R	28.4	Very low	32.6	Very low	237 Å²	237	140.8 Å²	140.8	89%	0.894	73%	0.733	S	S	*	*			trans	-51.2	126	175.1	-80.2	-179.7	170.1	174.5	-2.9	107	N636 A640	N636-R638 VanDerWaalsContact C-N 3.35Å; N636-R638 PolarHBondContact O-N 2.95Å; R638-A640 VanDerWaalsContact C-N 3.34Å; R638-A640 PolarHBondContact O-N 3.34Å
639	T	29.7	Very low	31.5	Very low	130 Å²	130	137.3 Å²	137.3	80%	0.798	73%	0.733	S	S	*	*			trans	-49.7	93.7	172.4	32.8	0	0	0	0	110	L637 N641	L637-T639 PolarHBondContact O-N 2.84Å; T639-N641 VanDerWaalsContact C-N 3.33Å; T639-N641 PolarHBondContact O-N 3.41Å
640	A	31.6	Very low	30.8	Very low	93 Å²	93	136.9 Å²	136.9	77%	0.769	74%	0.737	S	S	*	*			trans	-74.6	94.9	166.6	0	0	0	0	0	107.4	R638 S642	R638-A640 VanDerWaalsContact C-N 3.34Å; R638-A640 PolarHBondContact O-N 3.34Å; A640-S642 PolarHBondContact O-N 3.21Å
641	N	29.4	Very low	30.4	Very low	162 Å²	162	134 Å²	134	87%	0.866	74%	0.742	S	S	*	*			trans	-55	101	162.2	-83.3	-27.8	0	0	0	109.7	T639	T639-N641 VanDerWaalsContact C-N 3.33Å; T639-N641 PolarHBondContact O-N 3.41Å
642	S	33.4	Very low	30	Very low	101 Å²	101	135.9 Å²	135.9	71%	0.706	75%	0.754	S	S	*	*			trans	-157.9	92.9	153.4	64.3	0	0	0	0	111.6	A640	A640-S642 PolarHBondContact O-N 3.21Å
643	R	28	Very low	29.8	Very low	227 Å²	227	133.9 Å²	133.9	86%	0.857	76%	0.763	S	S	*	*			trans	25	119.2	131.8	-66.1	179.9	-176.6	175.6	0.9	118.2
644	I	28.4	Very low	29.6	Very low	137 Å²	137	132 Å²	132	70%	0.703	76%	0.764	S	S	*	*				61.3	99.4	122	-54.4	163.9	0	0	0	116
645	N	28.6	Very low	29.2	Very low	141 Å²	141	139.6 Å²	139.6	75%	0.754	79%	0.786	S	S	*	*				166.2	127.7	107.9	-99.2	-22	0	0	0	113.4
646	S	28.9	Very low	29	Very low	103 Å²	103	137.5 Å²	137.5	72%	0.72	78%	0.777	S	S	*	*			trans	17	108.9	139.4	60.5	0	0	0	0	119.5
647	S	32.7	Very low	29.3	Very low	105 Å²	105	138.1 Å²	138.1	73%	0.734	79%	0.787	S	S	*	*				-162	110.9	121.3	66.7	0	0	0	0	109.5	S649	S647-S649 PolarHBondContact O-N 3.26Å; S647-S649 VanDerWaalsContact O-N 3.11Å
648	L	27	Very low	28.9	Very low	185 Å²	185	134.7 Å²	134.7	97%	0.969	78%	0.778	S	S	*	*			trans	-67.8	100.6	165.4	-81	93.3	0	0	0	108.6
649	S	27.3	Very low	28.7	Very low	85 Å²	85	127.7 Å²	127.7	59%	0.594	77%	0.765	S	S	*	*			trans	-139	117.4	153.7	52.5	0	0	0	0	107.1	S647 P651	S647-S649 PolarHBondContact O-N 3.26Å; S647-S649 VanDerWaalsContact O-N 3.11Å; S649-P651 WeakPolarHBondContact O-CD 3.44Å
650	P	28.4	Very low	28.7	Very low	120 Å²	120	127.2 Å²	127.2	78%	0.779	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-64.5	125.2	179.3	25	-29.6	0	0	0	108.4	T652	P650-T652 PolarHBondContact O-N 3.44Å; P650-T652 VanDerWaalsContact O-N 3.14Å
651	P	30.3	Very low	28.3	Very low	124 Å²	124	129 Å²	129	81%	0.805	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-64.5	119.6	175.6	24.5	-29.1	0	0	0	108.4	S649	S649-P651 WeakPolarHBondContact O-CD 3.44Å
652	T	26.4	Very low	27.9	Very low	126 Å²	126	129.4 Å²	129.4	77%	0.773	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-50.3	141.4	165.9	33.2	0	0	0	0	110.1	P650 G654	P650-T652 PolarHBondContact O-N 3.44Å; P650-T652 VanDerWaalsContact O-N 3.14Å; T652-G654 PolarHBondContact O-N 3.3Å
653	P	27.4	Very low	27.3	Very low	129 Å²	129	132.5 Å²	132.5	84%	0.838	77%	0.765	S	S	*	*			trans	-73.5	80.6	-176.3	29.3	-31.9	0	0	0	110.1
654	G	25.7	Very low	27.1	Very low	66 Å²	66	129.5 Å²	129.5	68%	0.68	79%	0.789	S	S	*	*			trans	-79.5	110.7	163.4	0	0	0	0	0	108.9	T652 S656	T652-G654 PolarHBondContact O-N 3.3Å; G654-S656 PolarHBondContact O-N 3.26Å
655	Y	26.3	Very low	27	Very low	239 Å²	239	129.2 Å²	129.2	94%	0.937	79%	0.794	S	S	*	*			trans	-23.3	108.4	167.1	-71.8	-97.4	0	0	0	114.1
656	S	26.3	Very low	27	Very low	81 Å²	81	128.5 Å²	128.5	57%	0.566	80%	0.796	S	S	*	*			trans	-114.3	142.6	157.3	86.1	0	0	0	0	108.9	G654 S658	G654-S656 PolarHBondContact O-N 3.26Å; S656-S658 PolarHBondContact O-N 2.91Å
657	P	37.6	Very low	26.9	Very low	138 Å²	138	129.9 Å²	129.9	90%	0.896	80%	0.8	S	S	*	*	S	Bend	trans	-80.1	28.8	-163.2	1.2	17.3	0	0	0	113.8
658	S	25.5	Very low	26.5	Very low	99 Å²	99	131.4 Å²	131.4	69%	0.692	80%	0.804	S	S	*	*			trans	-108.3	50.4	178.8	61.8	0	0	0	0	111.4	S656	S656-S658 PolarHBondContact O-N 2.91Å
659	S	24.8	Very low	26.5	Very low	91 Å²	91	128.1 Å²	128.1	64%	0.636	79%	0.793	S	S	*	*			trans	-96.5	116.4	156.5	43.3	0	0	0	0	107.5	I661	S659-I661 PolarHBondContact O-N 2.97Å
660	P	28	Very low	26.4	Very low	119 Å²	119	130.9 Å²	130.9	77%	0.773	81%	0.807	S	S	*	*			trans	-65.1	112.4	171.3	26.3	-29.2	0	0	0	107.2	I662	P660-I662 PolarHBondContact O-N 2.96Å; P660-I662 VanDerWaalsContact O-N 3.11Å
661	I	24.4	Very low	26.3	Very low	132 Å²	132	131.7 Å²	131.7	68%	0.677	81%	0.809	S	S	*	*			trans	-54.2	114.8	170.5	-68.4	167.2	0	0	0	107.3	S659 M663	S659-I661 PolarHBondContact O-N 2.97Å; I661-M663 VanDerWaalsContact C-N 3.29Å; I661-M663 HydrophobicContact CG2-CB 4.18Å; I661-M663 HydrophobicContact CG2-CE 4.1Å; I661-M663 HydrophobicContact CG2-CG 3.65Å; I661-M663 HydrophobicContact CG2-SD 4.17Å; I661-M663 PolarHBondContact O-N 3.35Å
662	I	21.4	Very low	26	Very low	170 Å²	170	132.3 Å²	132.3	87%	0.872	81%	0.809	S	S	*	*			trans	-69.4	92.4	164.1	-60.3	168.9	0	0	0	105.2	P660	P660-I662 PolarHBondContact O-N 2.96Å; P660-I662 VanDerWaalsContact O-N 3.11Å
663	M	20.8	Very low	25.9	Very low	166 Å²	166	132.8 Å²	132.8	82%	0.818	81%	0.812	S	S	*	*			trans	-103.3	122.7	165	-97.1	179.8	-167.7	0	0	108.3	I661	I661-M663 VanDerWaalsContact C-N 3.29Å; I661-M663 HydrophobicContact CG2-CB 4.18Å; I661-M663 HydrophobicContact CG2-CE 4.1Å; I661-M663 HydrophobicContact CG2-CG 3.65Å; I661-M663 HydrophobicContact CG2-SD 4.17Å; I661-M663 PolarHBondContact O-N 3.35Å
664	A	23.2	Very low	25.8	Very low	164 Å²	164	133.2 Å²	133.2	100%	1.355	81%	0.809	S	S	*	*			trans	-53.8	0	-175.7	0	0	0	0	0	114.2

Retrieved 664 of 664 residues in 1048.7 ms (Link to these results)

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