A0A096M2F5_POEFO Loading...

X-ray radiation resistance associated 1

AlphaFold DB , UniProt , Accession A0A096M2F5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 587 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	Y	66.8	Low	66.2	Low	195 Å²	195	95.6 Å²	95.6	77%	0.765	53%	0.525	S	S	*	.				0	157.8	0	-62.9	-81.1	0	0	0	110.3	N26 A28 Y29	Y1-N26 HydrophobicContact CD2-CB 3.8Å; Y1-N26 HydrophobicContact CE2-CB 3.98Å; Y1-N26 PolarHBondContact N-O 3.35Å; Y1-A28 PolarHBondContact O-N 3.26Å; Y1-Y29 PolarHBondContact O-N 2.86Å
2	T	74.5	Confident	64.3	Low	82 Å²	82	101.1 Å²	101.1	50%	0.503	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.8	121	-179.2	-59.3	0	0	0	0	106.3	Y4 Y29	T2-Y4 HydrophobicContact CG2-CD2 4.26Å; T2-Y4 HydrophobicContact CG2-CE2 3.44Å; T2-Y4 VanDerWaalsContact CG2-CE2 3.44Å; T2-Y29 WeakPolarHBondContact CA-O 3.21Å; T2-Y29 HydrophobicContact CG2-CD1 3.29Å; T2-Y29 HydrophobicContact CG2-CE1 3.76Å; T2-Y29 HydrophobicContact CG2-CG 4.06Å
3	L	82.4	Confident	63.1	Low	31 Å²	31	99 Å²	99	16%	0.162	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.3	-177.7	-177.7	66.8	0	0	0	109.8	I5 L21 V27 Y29 V30 D31 F45	L3-I5 HydrophobicContact CD2-CD1 4.13Å; L3-I5 HydrophobicContact CD2-CG1 4.19Å; L3-I5 HydrophobicContact CG-CG1 4.13Å; L3-L21 HydrophobicContact CD2-CD2 4.46Å; L3-V27 HydrophobicContact CB-CG1 4.09Å; L3-V27 HydrophobicContact CB-CG2 4.48Å; L3-Y29 PolarHBondContact N-O 3.35Å; L3-V30 HydrophobicContact CB-CG2 4.25Å; L3-V30 HydrophobicContact CD2-CG2 4.48Å; L3-V30 CarbonylContact O-C 3.57Å; L3-V30 WeakPolarHBondContact O-CA 3.48Å; L3-D31 PolarHBondContact O-N 3.24Å; L3-F45 HydrophobicContact CD2-CE2 4.12Å; L3-F45 HydrophobicContact CD2-CZ 3.7Å
4	Y	79.9	Confident	62.4	Low	151 Å²	151	99.3 Å²	99.3	59%	0.592	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.1	123.8	172.9	-66.3	-84.1	0	0	0	108.9	T2 Y29 D31	T2-Y4 HydrophobicContact CG2-CD2 4.26Å; T2-Y4 HydrophobicContact CG2-CE2 3.44Å; T2-Y4 VanDerWaalsContact CG2-CE2 3.44Å; Y4-Y29 AromaticContact CE1-CE1 3.94Å; Y4-Y29 HydrophobicContact CE1-CE1 3.94Å; Y4-D31 CarbonylContact C-O 3.48Å; Y4-D31 WeakPolarHBondContact CA-O 3.37Å; Y4-D31 HydrophobicContact CD1-CB 3.58Å; Y4-D31 HydrophobicContact CE1-CB 3.79Å
5	I	77.2	Confident	62.1	Low	23 Å²	23	95.9 Å²	95.9	12%	0.118	54%	0.541	C	S	.	.			trans	-110	97.7	178.1	-57.2	-175.5	0	0	0	108	L3 V30 D31 A32 N35 L37 F42	L3-I5 HydrophobicContact CD2-CD1 4.13Å; L3-I5 HydrophobicContact CD2-CG1 4.19Å; L3-I5 HydrophobicContact CG-CG1 4.13Å; I5-V30 HydrophobicContact CD1-CG1 4.43Å; I5-D31 PolarHBondContact N-O 3.24Å; I5-A32 HydrophobicContact CB-CB 4.21Å; I5-A32 HydrophobicContact CD1-CB 4.49Å; I5-N35 PolarHBondContact O-ND2 3.46Å; I5-L37 HydrophobicContact CG2-CD1 4.05Å; I5-F42 HydrophobicContact CD1-CE1 3.72Å; I5-F42 HydrophobicContact CD1-CZ 4.24Å
6	S	71.5	Confident	62.2	Low	103 Å²	103	91.4 Å²	91.4	72%	0.72	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-84.7	137.8	173.2	62.1	0	0	0	0	111.2
7	R	64.6	Low	62.4	Low	90 Å²	90	92.2 Å²	92.2	34%	0.34	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-61.1	131.1	178.3	-173.1	163.8	163.6	-164.6	-9.2	112.5	D34 N35	R7-D34 WeakPolarHBondContact CD-O 3.27Å; R7-D34 PolarHBondContact NH1-O 2.9Å; R7-D34 IonicContact NH1-OD1 3.87Å; R7-D34 PolarHBondContact NH1-OD1 3.16Å; R7-D34 VanDerWaalsContact NH1-OD1 3.14Å; R7-N35 WeakPolarHBondContact CA-OD1 3.34Å; R7-N35 WeakPolarHBondContact CB-OD1 3.45Å; R7-N35 PolarHBondContact N-OD1 2.98Å
8	P	57.3	Low	62.4	Low	60 Å²	60	89.3 Å²	89.3	39%	0.39	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-65	139.4	178	25.8	-34	0	0	0	111.2	S10	P8-S10 CarbonylContact O-C 3.24Å; P8-S10 PolarHBondContact O-N 3.47Å; P8-S10 VanDerWaalsContact O-N 3.14Å
9	T	53.6	Low	62.5	Low	158 Å²	158	91.6 Å²	91.6	97%	0.969	51%	0.507	S	S	*	.	S	Bend	trans	-61.4	-21.5	177.7	49.9	0	0	0	0	113.1
10	S	51	Low	62.7	Low	73 Å²	73	93.7 Å²	93.7	51%	0.51	51%	0.512	S	S	.	.	S	Bend	trans	-86	112.2	165.9	56.1	0	0	0	0	110.9	P8 L12	P8-S10 CarbonylContact O-C 3.24Å; P8-S10 PolarHBondContact O-N 3.47Å; P8-S10 VanDerWaalsContact O-N 3.14Å; S10-L12 PolarHBondContact O-N 3.38Å
11	A	49.1	Very low	63	Low	86 Å²	86	89.9 Å²	89.9	71%	0.711	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	37.5	-173.5	0	0	0	0	0	116
12	L	43.8	Very low	63.2	Low	161 Å²	161	87.5 Å²	87.5	84%	0.843	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-10.1	-168.7	-74.4	169.9	0	0	0	115.6	S10	S10-L12 PolarHBondContact O-N 3.38Å
13	S	48.3	Very low	63	Low	74 Å²	74	90.5 Å²	90.5	52%	0.517	49%	0.494	S	S	.	.			trans	-100.8	121.1	169.9	-157.7	0	0	0	0	111.2	S15	S13-S15 PolarHBondContact OG-O 3.12Å
14	T	54.2	Low	62.5	Low	103 Å²	103	92 Å²	92	63%	0.632	50%	0.5	S	S	*	.			trans	-113.8	7.3	174.5	56.8	0	0	0	0	112.3	F36	T14-F36 HydrophobicContact CG2-CD2 4.29Å
15	S	57.6	Low	62.1	Low	48 Å²	48	88.5 Å²	88.5	34%	0.336	49%	0.494	S	S	.	.			trans	-139.9	142.7	179	-173.4	0	0	0	0	108.4	S13 E17	S13-S15 PolarHBondContact OG-O 3.12Å; S15-E17 WeakPolarHBondContact CB-OE1 3.46Å; S15-E17 PolarHBondContact OG-OE1 2.98Å
16	V	63.9	Low	62.4	Low	24 Å²	24	92.4 Å²	92.4	15%	0.145	52%	0.515	C	S	.	.			trans	-106.3	121	156.5	174.4	0	0	0	0	105.3	L21 L37	V16-L21 HydrophobicContact CG1-CD1 3.57Å; V16-L21 HydrophobicContact CG1-CD2 4.21Å; V16-L21 HydrophobicContact CG1-CG 3.79Å; V16-L37 HydrophobicContact CB-CD2 4.24Å; V16-L37 HydrophobicContact CG2-CD1 3.88Å; V16-L37 HydrophobicContact CG2-CD2 3.85Å
17	E	65.4	Low	63	Low	105 Å²	105	87.6 Å²	87.6	49%	0.491	48%	0.481	S	S	.	.			trans	-71.4	124.7	179.7	-64.8	-54.2	122	0	0	108.9	S15 E19 E20	S15-E17 WeakPolarHBondContact CB-OE1 3.46Å; S15-E17 PolarHBondContact OG-OE1 2.98Å; E17-E19 PolarHBondContact O-N 3.08Å; E17-E20 PolarHBondContact O-N 3.41Å
18	P	62	Low	64.2	Low	41 Å²	41	84.9 Å²	84.9	27%	0.266	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-12.3	-171.9	25.8	-34.8	0	0	0	112.9	L21 R22	P18-L21 PolarHBondContact O-N 3.04Å; P18-R22 VanDerWaalsContact O-CG 3.31Å; P18-R22 WeakPolarHBondContact O-CG 3.36Å; P18-R22 PolarHBondContact O-N 3Å
19	E	64.7	Low	65.8	Low	132 Å²	132	85 Å²	85	62%	0.617	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-36.3	173.4	-53.6	-146.3	138	0	0	112.8	E17 L21 R22	E17-E19 PolarHBondContact O-N 3.08Å; E19-L21 PolarHBondContact O-N 2.98Å; E19-R22 PolarHBondContact O-N 3.38Å; E19-R22 IonicContact OE1-CZ 3.59Å; E19-R22 IonicContact OE1-NH2 2.86Å; E19-R22 PolarHBondContact OE1-NH2 3.44Å
20	E	66.6	Low	67.5	Low	133 Å²	133	77.4 Å²	77.4	62%	0.621	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-15.3	178.2	-60.2	-173.3	161.3	0	0	112.7	E17	E17-E20 PolarHBondContact O-N 3.41Å
21	L	69.6	Low	69.3	Low	14 Å²	14	75.5 Å²	75.5	7%	0.073	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-8.9	-177.7	-63.8	-176.6	0	0	0	113.7	L3 V16 P18 E19 D23 F24 C44 F45	L3-L21 HydrophobicContact CD2-CD2 4.46Å; V16-L21 HydrophobicContact CG1-CD1 3.57Å; V16-L21 HydrophobicContact CG1-CD2 4.21Å; V16-L21 HydrophobicContact CG1-CG 3.79Å; P18-L21 PolarHBondContact O-N 3.04Å; E19-L21 PolarHBondContact O-N 2.98Å; L21-D23 PolarHBondContact O-N 3.24Å; L21-F24 PolarHBondContact O-N 3.36Å; L21-C44 WeakPolarHBondContact CB-SG 3.33Å; L21-F45 HydrophobicContact CB-CE1 4.02Å; L21-F45 HydrophobicContact CB-CZ 3.72Å; L21-F45 HydrophobicContact CD1-CE2 3.9Å; L21-F45 HydrophobicContact CD1-CZ 3.77Å; L21-F45 HydrophobicContact CD2-CZ 4.11Å; L21-F45 HydrophobicContact CG-CZ 4.07Å; L21-F45 WeakPolarHBondContact O-CE1 3.15Å
22	R	69.6	Low	71.2	Confident	146 Å²	146	71.4 Å²	71.4	55%	0.551	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.3	-175	-70.5	-173.7	-172.5	-169.5	15.1	114.4	P18 E19 F24 V25 C44	P18-R22 VanDerWaalsContact O-CG 3.31Å; P18-R22 WeakPolarHBondContact O-CG 3.36Å; P18-R22 PolarHBondContact O-N 3Å; E19-R22 PolarHBondContact O-N 3.38Å; E19-R22 IonicContact OE1-CZ 3.59Å; E19-R22 IonicContact OE1-NH2 2.86Å; E19-R22 PolarHBondContact OE1-NH2 3.44Å; R22-F24 PolarHBondContact O-N 3.27Å; R22-V25 WeakPolarHBondContact O-CG2 3.47Å; R22-C44 HydrophobicContact CG-CB 4.33Å
23	D	71.1	Confident	73.3	Confident	144 Å²	144	65.8 Å²	65.8	77%	0.77	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-21.5	-177.4	-68.2	-21.3	0	0	0	112.6	L21 V25	L21-D23 PolarHBondContact O-N 3.24Å; D23-V25 VanDerWaalsContact C-N 3.32Å; D23-V25 PolarHBondContact O-N 2.97Å; D23-V25 VanDerWaalsContact O-N 3.13Å
24	F	71.8	Confident	75.2	Confident	64 Å²	64	66.7 Å²	66.7	28%	0.281	35%	0.348	S	S	.	.			trans	-91.5	53.8	-176.7	-48.4	-87.2	0	0	0	113.3	L21 R22 N26 V27 F45 I410	L21-F24 PolarHBondContact O-N 3.36Å; R22-F24 PolarHBondContact O-N 3.27Å; F24-N26 PolarHBondContact O-N 3.24Å; F24-V27 HydrophobicContact CB-CG2 3.56Å; F24-V27 WeakPolarHBondContact O-CG2 3.48Å; F24-V27 PolarHBondContact O-N 3.14Å; F24-F45 HydrophobicContact CB-CE1 4.02Å; F24-I410 HydrophobicContact CZ-CD1 4.31Å
25	V	72.3	Confident	76.6	Confident	77 Å²	77	62.1 Å²	62.1	47%	0.467	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-25.1	-174.8	-171.2	0	0	0	0	114.5	R22 D23 S47	R22-V25 WeakPolarHBondContact O-CG2 3.47Å; D23-V25 VanDerWaalsContact C-N 3.32Å; D23-V25 PolarHBondContact O-N 2.97Å; D23-V25 VanDerWaalsContact O-N 3.13Å; V25-S47 WeakPolarHBondContact O-CB 3.47Å; V25-S47 PolarHBondContact O-OG 2.9Å
26	N	81.8	Confident	78	Confident	104 Å²	104	63.1 Å²	63.1	56%	0.556	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	23.3	-175.7	-69.9	-43.5	0	0	0	113.8	Y1 F24	Y1-N26 HydrophobicContact CD2-CB 3.8Å; Y1-N26 HydrophobicContact CE2-CB 3.98Å; Y1-N26 PolarHBondContact N-O 3.35Å; F24-N26 PolarHBondContact O-N 3.24Å
27	V	85.5	Confident	78.9	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.018	31%	0.314	C	S	.	.			trans	-75.8	126.9	171.6	175.7	0	0	0	0	109.4	L3 F24 Y29 V30 F45 S47 L48	L3-V27 HydrophobicContact CB-CG1 4.09Å; L3-V27 HydrophobicContact CB-CG2 4.48Å; F24-V27 HydrophobicContact CB-CG2 3.56Å; F24-V27 WeakPolarHBondContact O-CG2 3.48Å; F24-V27 PolarHBondContact O-N 3.14Å; V27-Y29 WeakPolarHBondContact CG1-O 3.42Å; V27-V30 HydrophobicContact CG1-CG2 3.44Å; V27-V30 VanDerWaalsContact CG1-CG2 3.44Å; V27-F45 HydrophobicContact CB-CD1 4.01Å; V27-F45 HydrophobicContact CB-CE1 4.26Å; V27-F45 HydrophobicContact CB-CG 4.42Å; V27-F45 HydrophobicContact CG2-CD1 4.41Å; V27-F45 HydrophobicContact CG2-CE1 4.2Å; V27-S47 CarbonylContact O-C 3.15Å; V27-S47 VanDerWaalsContact O-C 3.29Å; V27-S47 WeakPolarHBondContact O-CB 3.43Å; V27-L48 HydrophobicContact CG1-CD1 4.48Å; V27-L48 PolarHBondContact O-N 2.95Å
28	A	89.4	Confident	80	Confident	33 Å²	33	59.4 Å²	59.4	27%	0.273	30%	0.304	S	S	.	.			trans	-115.6	-25	-178.9	0	0	0	0	0	112.2	Y1 R49 E50	Y1-A28 PolarHBondContact O-N 3.26Å; A28-R49 WeakPolarHBondContact O-CA 3.48Å; A28-R49 WeakPolarHBondContact O-CB 3.45Å; A28-R49 PolarHBondContact O-N 2.68Å; A28-E50 PolarHBondContact O-N 3.45Å
29	Y	91.6	Very high	81.1	Confident	61 Å²	61	57.4 Å²	57.4	24%	0.239	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	134.3	174.3	172.9	-79	0	0	0	109.1	Y1 T2 L3 Y4 V27 D31 E50	Y1-Y29 PolarHBondContact O-N 2.86Å; T2-Y29 WeakPolarHBondContact CA-O 3.21Å; T2-Y29 HydrophobicContact CG2-CD1 3.29Å; T2-Y29 HydrophobicContact CG2-CE1 3.76Å; T2-Y29 HydrophobicContact CG2-CG 4.06Å; L3-Y29 PolarHBondContact N-O 3.35Å; Y4-Y29 AromaticContact CE1-CE1 3.94Å; Y4-Y29 HydrophobicContact CE1-CE1 3.94Å; V27-Y29 WeakPolarHBondContact CG1-O 3.42Å; Y29-D31 HydrophobicContact CE1-CB 3.67Å; Y29-E50 CarbonylContact C-O 3.53Å; Y29-E50 WeakPolarHBondContact CA-O 3.42Å; Y29-E50 HydrophobicContact CD2-CB 3.73Å; Y29-E50 WeakPolarHBondContact CD2-OE2 3.44Å; Y29-E50 HydrophobicContact CG-CB 4.45Å
30	V	89.4	Confident	82.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.1	168.9	178.2	0	0	0	0	109.5	L3 I5 V27 A32 F42 F45 L48 E50 L51 D52	L3-V30 HydrophobicContact CB-CG2 4.25Å; L3-V30 HydrophobicContact CD2-CG2 4.48Å; L3-V30 CarbonylContact O-C 3.57Å; L3-V30 WeakPolarHBondContact O-CA 3.48Å; I5-V30 HydrophobicContact CD1-CG1 4.43Å; V27-V30 HydrophobicContact CG1-CG2 3.44Å; V27-V30 VanDerWaalsContact CG1-CG2 3.44Å; V30-A32 HydrophobicContact CG1-CB 4.26Å; V30-F42 HydrophobicContact CG1-CD1 3.88Å; V30-F42 HydrophobicContact CG1-CE1 3.58Å; V30-F42 HydrophobicContact CG2-CD1 4.45Å; V30-F45 HydrophobicContact CG2-CD2 3.97Å; V30-F45 HydrophobicContact CG2-CE2 3.95Å; V30-L48 HydrophobicContact CB-CD1 4.17Å; V30-L48 HydrophobicContact CG2-CD1 3.6Å; V30-E50 PolarHBondContact N-O 3.49Å; V30-L51 HydrophobicContact CB-CD1 3.77Å; V30-L51 HydrophobicContact CG1-CD1 3.86Å; V30-L51 CarbonylContact O-C 3.27Å; V30-L51 WeakPolarHBondContact O-CA 3.42Å; V30-D52 PolarHBondContact O-N 3.47Å
31	D	88.8	Confident	83	Confident	33 Å²	33	46.4 Å²	46.4	18%	0.176	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	115.7	162.5	176.2	4.8	0	0	0	108.6	L3 Y4 I5 Y29 S33 D52	L3-D31 PolarHBondContact O-N 3.24Å; Y4-D31 CarbonylContact C-O 3.48Å; Y4-D31 WeakPolarHBondContact CA-O 3.37Å; Y4-D31 HydrophobicContact CD1-CB 3.58Å; Y4-D31 HydrophobicContact CE1-CB 3.79Å; I5-D31 PolarHBondContact N-O 3.24Å; Y29-D31 HydrophobicContact CE1-CB 3.67Å; D31-S33 VanDerWaalsContact OD1-CB 3.23Å; D31-S33 WeakPolarHBondContact OD1-CB 3.44Å; D31-S33 PolarHBondContact OD1-N 2.84Å; D31-S33 PolarHBondContact OD1-OG 3.42Å; D31-D52 HydrophobicContact CB-CB 4.47Å
32	A	88.1	Confident	83.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.243	C	C	.	.			trans	-124.6	30	174.7	0	0	0	0	0	110.9	I5 V30 N35 L37 F42 D52 L53 N56	I5-A32 HydrophobicContact CB-CB 4.21Å; I5-A32 HydrophobicContact CD1-CB 4.49Å; V30-A32 HydrophobicContact CG1-CB 4.26Å; A32-N35 VanDerWaalsContact C-ND2 3.32Å; A32-N35 PolarHBondContact O-ND2 3.15Å; A32-L37 HydrophobicContact CB-CD1 4.33Å; A32-F42 HydrophobicContact CB-CE1 4.04Å; A32-F42 HydrophobicContact CB-CE2 4.41Å; A32-F42 HydrophobicContact CB-CZ 3.52Å; A32-D52 CarbonylContact C-O 3.5Å; A32-D52 WeakPolarHBondContact CA-O 3.48Å; A32-D52 PolarHBondContact N-O 2.86Å; A32-L53 HydrophobicContact CB-CD2 3.97Å; A32-N56 PolarHBondContact O-ND2 3.13Å
33	S	87.9	Confident	84.5	Confident	43 Å²	43	40.2 Å²	40.2	30%	0.301	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	153.1	177.7	59.8	0	0	0	0	113.6	D31 N35 T54	D31-S33 VanDerWaalsContact OD1-CB 3.23Å; D31-S33 WeakPolarHBondContact OD1-CB 3.44Å; D31-S33 PolarHBondContact OD1-N 2.84Å; D31-S33 PolarHBondContact OD1-OG 3.42Å; S33-N35 VanDerWaalsContact C-N 3.3Å; S33-N35 PolarHBondContact O-N 2.9Å; S33-N35 PolarHBondContact O-ND2 3.11Å; S33-T54 CarbonylContact C-O 3.27Å; S33-T54 VanDerWaalsContact CA-O 3.28Å; S33-T54 WeakPolarHBondContact CA-O 3.23Å
34	D	87.1	Confident	85.1	Confident	92 Å²	92	34.7 Å²	34.7	49%	0.492	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	38.1	-175	-167.8	20.7	0	0	0	115.3	R7 T54 F55	R7-D34 WeakPolarHBondContact CD-O 3.27Å; R7-D34 PolarHBondContact NH1-O 2.9Å; R7-D34 IonicContact NH1-OD1 3.87Å; R7-D34 PolarHBondContact NH1-OD1 3.16Å; R7-D34 VanDerWaalsContact NH1-OD1 3.14Å; D34-T54 PolarHBondContact N-O 2.91Å; D34-F55 HydrophobicContact CB-CB 4.44Å
35	N	85.1	Confident	85.8	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.043	19%	0.186	C	C	.	.	S	Bend	trans	-108.3	-156.2	171.2	-71.5	-81.2	0	0	0	111.9	I5 R7 A32 S33 L37 N56	I5-N35 PolarHBondContact O-ND2 3.46Å; R7-N35 WeakPolarHBondContact CA-OD1 3.34Å; R7-N35 WeakPolarHBondContact CB-OD1 3.45Å; R7-N35 PolarHBondContact N-OD1 2.98Å; A32-N35 VanDerWaalsContact C-ND2 3.32Å; A32-N35 PolarHBondContact O-ND2 3.15Å; S33-N35 VanDerWaalsContact C-N 3.3Å; S33-N35 PolarHBondContact O-N 2.9Å; S33-N35 PolarHBondContact O-ND2 3.11Å; N35-L37 HydrophobicContact CB-CD1 4.11Å; N35-L37 HydrophobicContact CB-CG 3.96Å; N35-N56 VanDerWaalsContact CA-OD1 3.31Å; N35-N56 WeakPolarHBondContact CA-OD1 3.44Å; N35-N56 WeakPolarHBondContact CB-OD1 3.45Å; N35-N56 PolarHBondContact N-OD1 3.28Å; N35-N56 WeakPolarHBondContact O-CA 3.38Å; N35-N56 PolarHBondContact O-OD1 2.97Å
36	F	85.3	Confident	86.5	Confident	69 Å²	69	31.6 Å²	31.6	30%	0.303	19%	0.186	S	C	.	.			trans	-129.1	28.2	169	-62.2	-52.2	0	0	0	111.1	T14 N56 R57	T14-F36 HydrophobicContact CG2-CD2 4.29Å; F36-N56 PolarHBondContact N-OD1 3.42Å; F36-R57 HydrophobicContact CE1-CG 4.49Å
37	L	84.8	Confident	86.8	Confident	9 Å²	9	28.3 Å²	28.3	5%	0.047	17%	0.171	C	C	.	.			trans	-90.6	149	-172.5	-59	174.5	0	0	0	110.8	I5 V16 A32 N35 F42 N56 I58	I5-L37 HydrophobicContact CG2-CD1 4.05Å; V16-L37 HydrophobicContact CB-CD2 4.24Å; V16-L37 HydrophobicContact CG2-CD1 3.88Å; V16-L37 HydrophobicContact CG2-CD2 3.85Å; A32-L37 HydrophobicContact CB-CD1 4.33Å; N35-L37 HydrophobicContact CB-CD1 4.11Å; N35-L37 HydrophobicContact CB-CG 3.96Å; L37-F42 HydrophobicContact CB-CE2 3.99Å; L37-F42 HydrophobicContact CB-CZ 4.16Å; L37-F42 HydrophobicContact CD1-CZ 3.89Å; L37-N56 PolarHBondContact N-OD1 3.21Å; L37-N56 PolarHBondContact O-OD1 3.35Å; L37-I58 WeakPolarHBondContact O-CD1 3.48Å; L37-I58 WeakPolarHBondContact O-CG1 3.5Å
38	S	87.1	Confident	87.1	Confident	41 Å²	41	28.1 Å²	28.1	29%	0.287	17%	0.17	S	C	.	.			trans	-107.7	167.7	174.8	70.7	0	0	0	0	110.1	G40 S41 F42	S38-G40 PolarHBondContact O-N 3.33Å; S38-S41 PolarHBondContact O-N 3.22Å; S38-F42 VanDerWaalsContact O-CD2 3.27Å; S38-F42 WeakPolarHBondContact O-CD2 3.38Å; S38-F42 VanDerWaalsContact O-CE2 3.32Å; S38-F42 WeakPolarHBondContact O-CE2 3.33Å
39	L	86.1	Confident	87.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-54.1	-37.8	178	-152	87.7	0	0	0	112.5	S41 F42 L51 L53 M61 F63 F68 L74 F92	L39-S41 PolarHBondContact O-N 2.88Å; L39-S41 VanDerWaalsContact O-N 3.16Å; L39-F42 WeakPolarHBondContact O-CB 3.45Å; L39-F42 PolarHBondContact O-N 3.09Å; L39-L51 HydrophobicContact CD1-CD2 3.51Å; L39-L51 HydrophobicContact CG-CD2 4.28Å; L39-L53 HydrophobicContact CD1-CD1 3.84Å; L39-M61 HydrophobicContact CB-SD 3.68Å; L39-F63 HydrophobicContact CB-CB 4.38Å; L39-F63 HydrophobicContact CB-CD1 4.23Å; L39-F63 HydrophobicContact CB-CG 4.45Å; L39-F63 HydrophobicContact CD2-CB 4.01Å; L39-F63 HydrophobicContact CD2-CD1 3.74Å; L39-F63 HydrophobicContact CD2-CD2 3.76Å; L39-F63 HydrophobicContact CD2-CE1 4.09Å; L39-F63 HydrophobicContact CD2-CE2 4.12Å; L39-F63 HydrophobicContact CD2-CG 3.56Å; L39-F63 HydrophobicContact CD2-CZ 4.26Å; L39-F68 HydrophobicContact CD2-CD2 4.01Å; L39-F68 HydrophobicContact CD2-CE2 3.75Å; L39-F68 HydrophobicContact CD2-CZ 4.24Å; L39-F68 HydrophobicContact CG-CE2 4.05Å; L39-F68 HydrophobicContact CG-CZ 4.04Å; L39-F68 VanDerWaalsContact O-CZ 3.3Å; L39-F68 WeakPolarHBondContact O-CZ 3.35Å; L39-L74 HydrophobicContact CD1-CD1 3.71Å; L39-L74 HydrophobicContact CD1-CD2 4.18Å; L39-F92 HydrophobicContact CD2-CE2 4.19Å; L39-F92 HydrophobicContact CD2-CZ 3.58Å
40	G	84.9	Confident	87.5	Confident	21 Å²	21	33.5 Å²	33.5	22%	0.216	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-59.1	-26.6	-178.3	0	0	0	0	0	115	S38 F42 S43	S38-G40 PolarHBondContact O-N 3.33Å; G40-F42 PolarHBondContact O-N 3.07Å; G40-F42 VanDerWaalsContact O-N 3.16Å; G40-S43 WeakPolarHBondContact O-CB 3.43Å; G40-S43 PolarHBondContact O-N 3.34Å; G40-S43 PolarHBondContact O-OG 3.07Å
41	S	85.3	Confident	87.8	Confident	12 Å²	12	33.7 Å²	33.7	8%	0.084	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-62.8	-18.1	173.7	-61.8	0	0	0	0	113.3	S38 L39	S38-S41 PolarHBondContact O-N 3.22Å; L39-S41 PolarHBondContact O-N 2.88Å; L39-S41 VanDerWaalsContact O-N 3.16Å
42	F	86.5	Confident	88	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-104	2.8	-174.9	-56.8	-80.4	0	0	0	113.5	I5 V30 A32 L37 S38 L39 G40 C44 F45 L48 L51 L53 F68	I5-F42 HydrophobicContact CD1-CE1 3.72Å; I5-F42 HydrophobicContact CD1-CZ 4.24Å; V30-F42 HydrophobicContact CG1-CD1 3.88Å; V30-F42 HydrophobicContact CG1-CE1 3.58Å; V30-F42 HydrophobicContact CG2-CD1 4.45Å; A32-F42 HydrophobicContact CB-CE1 4.04Å; A32-F42 HydrophobicContact CB-CE2 4.41Å; A32-F42 HydrophobicContact CB-CZ 3.52Å; L37-F42 HydrophobicContact CB-CE2 3.99Å; L37-F42 HydrophobicContact CB-CZ 4.16Å; L37-F42 HydrophobicContact CD1-CZ 3.89Å; S38-F42 VanDerWaalsContact O-CD2 3.27Å; S38-F42 WeakPolarHBondContact O-CD2 3.38Å; S38-F42 VanDerWaalsContact O-CE2 3.32Å; S38-F42 WeakPolarHBondContact O-CE2 3.33Å; L39-F42 WeakPolarHBondContact O-CB 3.45Å; L39-F42 PolarHBondContact O-N 3.09Å; G40-F42 PolarHBondContact O-N 3.07Å; G40-F42 VanDerWaalsContact O-N 3.16Å; F42-C44 PolarHBondContact O-N 3.16Å; F42-C44 VanDerWaalsContact O-N 3.11Å; F42-F45 HydrophobicContact CB-CD2 4.09Å; F42-F45 AromaticContact CD1-CD2 3.97Å; F42-F45 HydrophobicContact CD1-CD2 3.97Å; F42-F45 AromaticContact CD1-CE2 3.79Å; F42-F45 HydrophobicContact CD1-CE2 3.79Å; F42-F45 WeakPolarHBondContact O-CB 3.4Å; F42-F45 PolarHBondContact O-N 3.21Å; F42-L48 HydrophobicContact CB-CD2 4.24Å; F42-L51 HydrophobicContact CB-CD2 4.23Å; F42-L51 HydrophobicContact CD1-CD1 4.1Å; F42-L51 HydrophobicContact CD2-CD1 4.24Å; F42-L51 HydrophobicContact CD2-CD2 4.17Å; F42-L51 HydrophobicContact CE1-CD1 4.36Å; F42-L51 HydrophobicContact CE2-CD1 4.49Å; F42-L51 HydrophobicContact CG-CD1 4.06Å; F42-L51 HydrophobicContact CG-CD2 4.16Å; F42-L53 HydrophobicContact CD2-CD2 4.42Å; F42-L53 HydrophobicContact CE2-CD2 3.66Å; F42-L53 HydrophobicContact CZ-CD2 4.18Å; F42-F68 HydrophobicContact CB-CE1 3.89Å; F42-F68 HydrophobicContact CB-CZ 4.13Å; F42-F68 WeakPolarHBondContact O-CE1 3.37Å
43	S	85.3	Confident	88.2	Confident	31 Å²	31	33.6 Å²	33.6	22%	0.217	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.4	-177.6	49	0	0	0	0	114.7	G40 F45 D67	G40-S43 WeakPolarHBondContact O-CB 3.43Å; G40-S43 PolarHBondContact O-N 3.34Å; G40-S43 PolarHBondContact O-OG 3.07Å; S43-F45 VanDerWaalsContact C-N 3.26Å; S43-F45 PolarHBondContact O-N 3.14Å; S43-D67 VanDerWaalsContact CB-OD2 3.26Å; S43-D67 WeakPolarHBondContact CB-OD2 3.29Å
44	C	83.9	Confident	88.4	Confident	27 Å²	27	32.3 Å²	32.3	18%	0.182	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-19.1	175.4	58.4	0	0	0	0	114	L21 R22 F42 T46	L21-C44 WeakPolarHBondContact CB-SG 3.33Å; R22-C44 HydrophobicContact CG-CB 4.33Å; F42-C44 PolarHBondContact O-N 3.16Å; F42-C44 VanDerWaalsContact O-N 3.11Å; C44-T46 PolarHBondContact O-N 3.31Å; C44-T46 VanDerWaalsContact O-N 3.1Å
45	F	86.1	Confident	88.5	Confident	1 Å²	1	31.7 Å²	31.7	0%	0.004	17%	0.17	C	C	.	.			trans	-88	72.8	-174.7	-60	-46.7	0	0	0	112.8	L3 L21 F24 V27 V30 F42 S43 S47 L48	L3-F45 HydrophobicContact CD2-CE2 4.12Å; L3-F45 HydrophobicContact CD2-CZ 3.7Å; L21-F45 HydrophobicContact CB-CE1 4.02Å; L21-F45 HydrophobicContact CB-CZ 3.72Å; L21-F45 HydrophobicContact CD1-CE2 3.9Å; L21-F45 HydrophobicContact CD1-CZ 3.77Å; L21-F45 HydrophobicContact CD2-CZ 4.11Å; L21-F45 HydrophobicContact CG-CZ 4.07Å; L21-F45 WeakPolarHBondContact O-CE1 3.15Å; F24-F45 HydrophobicContact CB-CE1 4.02Å; V27-F45 HydrophobicContact CB-CD1 4.01Å; V27-F45 HydrophobicContact CB-CE1 4.26Å; V27-F45 HydrophobicContact CB-CG 4.42Å; V27-F45 HydrophobicContact CG2-CD1 4.41Å; V27-F45 HydrophobicContact CG2-CE1 4.2Å; V30-F45 HydrophobicContact CG2-CD2 3.97Å; V30-F45 HydrophobicContact CG2-CE2 3.95Å; F42-F45 HydrophobicContact CB-CD2 4.09Å; F42-F45 AromaticContact CD1-CD2 3.97Å; F42-F45 HydrophobicContact CD1-CD2 3.97Å; F42-F45 AromaticContact CD1-CE2 3.79Å; F42-F45 HydrophobicContact CD1-CE2 3.79Å; F42-F45 WeakPolarHBondContact O-CB 3.4Å; F42-F45 PolarHBondContact O-N 3.21Å; S43-F45 VanDerWaalsContact C-N 3.26Å; S43-F45 PolarHBondContact O-N 3.14Å; F45-S47 PolarHBondContact O-N 3.29Å; F45-L48 HydrophobicContact CB-CB 3.86Å; F45-L48 HydrophobicContact CB-CD2 4.26Å; F45-L48 HydrophobicContact CB-CG 4.49Å; F45-L48 WeakPolarHBondContact O-CB 3.27Å; F45-L48 PolarHBondContact O-N 3.48Å
46	T	85.7	Confident	88.6	Confident	75 Å²	75	31.5 Å²	31.5	46%	0.46	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.8	179	56.9	0	0	0	0	114.9	C44	C44-T46 PolarHBondContact O-N 3.31Å; C44-T46 VanDerWaalsContact O-N 3.1Å
47	S	89.1	Confident	88.7	Confident	35 Å²	35	35.9 Å²	35.9	25%	0.245	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	1.7	177.2	-61.1	0	0	0	0	114.7	V25 V27 F45	V25-S47 WeakPolarHBondContact O-CB 3.47Å; V25-S47 PolarHBondContact O-OG 2.9Å; V27-S47 CarbonylContact O-C 3.15Å; V27-S47 VanDerWaalsContact O-C 3.29Å; V27-S47 WeakPolarHBondContact O-CB 3.43Å; F45-S47 PolarHBondContact O-N 3.29Å
48	L	92	Very high	88.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.			trans	-64.6	134.1	-172.2	-169	60.7	0	0	0	112	V27 V30 F42 F45 E50 L51 F68 H70 L71	V27-L48 HydrophobicContact CG1-CD1 4.48Å; V27-L48 PolarHBondContact O-N 2.95Å; V30-L48 HydrophobicContact CB-CD1 4.17Å; V30-L48 HydrophobicContact CG2-CD1 3.6Å; F42-L48 HydrophobicContact CB-CD2 4.24Å; F45-L48 HydrophobicContact CB-CB 3.86Å; F45-L48 HydrophobicContact CB-CD2 4.26Å; F45-L48 HydrophobicContact CB-CG 4.49Å; F45-L48 WeakPolarHBondContact O-CB 3.27Å; F45-L48 PolarHBondContact O-N 3.48Å; L48-E50 WeakPolarHBondContact CD1-O 3.41Å; L48-L51 HydrophobicContact CD2-CB 4.16Å; L48-L51 HydrophobicContact CD2-CD2 4.09Å; L48-F68 HydrophobicContact CD2-CD1 4.04Å; L48-F68 HydrophobicContact CD2-CE1 3.94Å; L48-H70 CarbonylContact O-C 2.73Å; L48-L71 HydrophobicContact CD2-CD1 4.43Å; L48-L71 HydrophobicContact CG-CD1 4.18Å; L48-L71 PolarHBondContact O-N 3.12Å
49	R	94.1	Very high	88.8	Confident	120 Å²	120	40.2 Å²	40.2	45%	0.453	20%	0.197	S	C	.	.			trans	-121.4	-34.5	178.6	-62	-175.7	-178.4	-126.1	9.4	112.8	A28 E72 V73	A28-R49 WeakPolarHBondContact O-CA 3.48Å; A28-R49 WeakPolarHBondContact O-CB 3.45Å; A28-R49 PolarHBondContact O-N 2.68Å; R49-E72 IonicContact CZ-OE1 2.69Å; R49-E72 IonicContact NH1-OE1 3.14Å; R49-E72 PolarHBondContact NH1-OE1 3.34Å; R49-E72 PolarHBondContact O-N 3.35Å; R49-V73 PolarHBondContact O-N 3.47Å
50	E	95.8	Very high	88.5	Confident	86 Å²	86	45.1 Å²	45.1	40%	0.402	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.6	-175.9	-53.6	-169.9	-172.9	0	0	109.4	A28 Y29 V30 L48 V73	A28-E50 PolarHBondContact O-N 3.45Å; Y29-E50 CarbonylContact C-O 3.53Å; Y29-E50 WeakPolarHBondContact CA-O 3.42Å; Y29-E50 HydrophobicContact CD2-CB 3.73Å; Y29-E50 WeakPolarHBondContact CD2-OE2 3.44Å; Y29-E50 HydrophobicContact CG-CB 4.45Å; V30-E50 PolarHBondContact N-O 3.49Å; L48-E50 WeakPolarHBondContact CD1-O 3.41Å; E50-V73 WeakPolarHBondContact CA-O 3.49Å; E50-V73 HydrophobicContact CB-CB 4.21Å; E50-V73 HydrophobicContact CG-CB 3.93Å; E50-V73 HydrophobicContact CG-CG2 3.96Å
51	L	94.9	Very high	88.3	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	121.5	-179.6	177	56.7	0	0	0	110.6	V30 L39 F42 L48 L53 L71 V73 L74 N75	V30-L51 HydrophobicContact CB-CD1 3.77Å; V30-L51 HydrophobicContact CG1-CD1 3.86Å; V30-L51 CarbonylContact O-C 3.27Å; V30-L51 WeakPolarHBondContact O-CA 3.42Å; L39-L51 HydrophobicContact CD1-CD2 3.51Å; L39-L51 HydrophobicContact CG-CD2 4.28Å; F42-L51 HydrophobicContact CB-CD2 4.23Å; F42-L51 HydrophobicContact CD1-CD1 4.1Å; F42-L51 HydrophobicContact CD2-CD1 4.24Å; F42-L51 HydrophobicContact CD2-CD2 4.17Å; F42-L51 HydrophobicContact CE1-CD1 4.36Å; F42-L51 HydrophobicContact CE2-CD1 4.49Å; F42-L51 HydrophobicContact CG-CD1 4.06Å; F42-L51 HydrophobicContact CG-CD2 4.16Å; L48-L51 HydrophobicContact CD2-CB 4.16Å; L48-L51 HydrophobicContact CD2-CD2 4.09Å; L51-L53 HydrophobicContact CD1-CD2 4.45Å; L51-L53 HydrophobicContact CD1-CG 4.12Å; L51-L53 HydrophobicContact CD2-CD1 3.93Å; L51-L53 HydrophobicContact CD2-CG 4.35Å; L51-L53 HydrophobicContact CG-CD1 4.13Å; L51-L53 HydrophobicContact CG-CG 4.02Å; L51-L71 HydrophobicContact CB-CD1 4.03Å; L51-V73 PolarHBondContact N-O 3.39Å; L51-V73 VanDerWaalsContact N-O 3.09Å; L51-L74 HydrophobicContact CB-CD1 4.11Å; L51-L74 HydrophobicContact CD2-CD1 4.19Å; L51-L74 HydrophobicContact CG-CD1 4.16Å; L51-N75 PolarHBondContact O-N 2.99Å
52	D	93.3	Very high	88	Confident	32 Å²	32	51 Å²	51	17%	0.171	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121	171.2	-155.2	-46.9	0	0	0	111.6	V30 D31 A32 T54 N75	V30-D52 PolarHBondContact O-N 3.47Å; D31-D52 HydrophobicContact CB-CB 4.47Å; A32-D52 CarbonylContact C-O 3.5Å; A32-D52 WeakPolarHBondContact CA-O 3.48Å; A32-D52 PolarHBondContact N-O 2.86Å; D52-T54 WeakPolarHBondContact OD1-CB 3.38Å; D52-T54 PolarHBondContact OD1-N 3.47Å; D52-T54 PolarHBondContact OD1-OG1 3.15Å; D52-N75 HydrophobicContact CB-CB 4.43Å; D52-N75 PolarHBondContact OD1-ND2 3.05Å; D52-N75 PolarHBondContact OD2-ND2 3.43Å
53	L	92.7	Very high	87.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.256	C	S	.	.			trans	-126	28.9	176.8	-73.1	172.9	0	0	0	111.3	A32 L39 F42 L51 N56 I58 N75 L76 N79	A32-L53 HydrophobicContact CB-CD2 3.97Å; L39-L53 HydrophobicContact CD1-CD1 3.84Å; F42-L53 HydrophobicContact CD2-CD2 4.42Å; F42-L53 HydrophobicContact CE2-CD2 3.66Å; F42-L53 HydrophobicContact CZ-CD2 4.18Å; L51-L53 HydrophobicContact CD1-CD2 4.45Å; L51-L53 HydrophobicContact CD1-CG 4.12Å; L51-L53 HydrophobicContact CD2-CD1 3.93Å; L51-L53 HydrophobicContact CD2-CG 4.35Å; L51-L53 HydrophobicContact CG-CD1 4.13Å; L51-L53 HydrophobicContact CG-CG 4.02Å; L53-N56 VanDerWaalsContact C-ND2 3.27Å; L53-N56 WeakPolarHBondContact CA-ND2 3.45Å; L53-N56 WeakPolarHBondContact O-CB 3.32Å; L53-N56 PolarHBondContact O-N 2.95Å; L53-N56 PolarHBondContact O-ND2 2.86Å; L53-N56 VanDerWaalsContact O-ND2 3.12Å; L53-I58 HydrophobicContact CB-CD1 4.07Å; L53-I58 HydrophobicContact CD1-CD1 4.13Å; L53-N75 WeakPolarHBondContact CA-O 3.36Å; L53-N75 PolarHBondContact N-O 2.93Å; L53-L76 HydrophobicContact CB-CD2 3.9Å; L53-L76 HydrophobicContact CD1-CD2 4.07Å; L53-N79 PolarHBondContact O-ND2 3.32Å
54	T	91.1	Very high	87.8	Confident	15 Å²	15	55.5 Å²	55.5	9%	0.092	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	142.6	177.3	-56.2	0	0	0	0	111.3	S33 D34 D52 N56 N75 S77 F78	S33-T54 CarbonylContact C-O 3.27Å; S33-T54 VanDerWaalsContact CA-O 3.28Å; S33-T54 WeakPolarHBondContact CA-O 3.23Å; D34-T54 PolarHBondContact N-O 2.91Å; D52-T54 WeakPolarHBondContact OD1-CB 3.38Å; D52-T54 PolarHBondContact OD1-N 3.47Å; D52-T54 PolarHBondContact OD1-OG1 3.15Å; T54-N56 PolarHBondContact O-N 2.85Å; T54-N56 VanDerWaalsContact O-N 3.14Å; T54-N56 PolarHBondContact O-ND2 3.05Å; T54-N56 VanDerWaalsContact O-ND2 3.11Å; T54-N75 VanDerWaalsContact OG1-CG 3.23Å; T54-N75 PolarHBondContact OG1-ND2 3.43Å; T54-N75 PolarHBondContact OG1-OD1 3.09Å; T54-S77 VanDerWaalsContact CA-O 3.27Å; T54-S77 WeakPolarHBondContact CA-O 3.41Å; T54-S77 WeakPolarHBondContact CG2-O 3.45Å; T54-F78 HydrophobicContact CG2-CD2 3.98Å
55	F	89.4	Confident	87.8	Confident	80 Å²	80	55.5 Å²	55.5	35%	0.351	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	12.6	178.4	-64.7	-64.5	0	0	0	117.3	D34 R57 S77 F78	D34-F55 HydrophobicContact CB-CB 4.44Å; F55-R57 PolarHBondContact O-N 3.39Å; F55-R57 VanDerWaalsContact O-N 3.15Å; F55-S77 PolarHBondContact N-O 3.25Å; F55-F78 HydrophobicContact CD1-CB 3.37Å; F55-F78 HydrophobicContact CD1-CD2 4.48Å; F55-F78 HydrophobicContact CD1-CG 4.08Å; F55-F78 HydrophobicContact CE1-CB 3.25Å; F55-F78 HydrophobicContact CE1-CD1 4.09Å; F55-F78 AromaticContact CE1-CD2 3.76Å; F55-F78 HydrophobicContact CE1-CD2 3.76Å; F55-F78 AromaticContact CE1-CG 3.42Å; F55-F78 HydrophobicContact CE1-CG 3.42Å; F55-F78 VanDerWaalsContact CE1-CG 3.42Å; F55-F78 HydrophobicContact CE2-CD2 4.05Å; F55-F78 HydrophobicContact CG-CB 4.14Å; F55-F78 HydrophobicContact CZ-CB 3.92Å; F55-F78 HydrophobicContact CZ-CD1 4.41Å; F55-F78 AromaticContact CZ-CD2 3.48Å; F55-F78 HydrophobicContact CZ-CD2 3.48Å; F55-F78 VanDerWaalsContact CZ-CD2 3.48Å; F55-F78 HydrophobicContact CZ-CE2 4.1Å; F55-F78 AromaticContact CZ-CG 3.67Å; F55-F78 HydrophobicContact CZ-CG 3.67Å
56	N	86.8	Confident	87.8	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.021	30%	0.296	C	S	.	.			trans	-75.1	0.6	-178	-84.7	-92.9	0	0	0	115.6	A32 N35 F36 L37 L53 T54 I58 N79	A32-N56 PolarHBondContact O-ND2 3.13Å; N35-N56 VanDerWaalsContact CA-OD1 3.31Å; N35-N56 WeakPolarHBondContact CA-OD1 3.44Å; N35-N56 WeakPolarHBondContact CB-OD1 3.45Å; N35-N56 PolarHBondContact N-OD1 3.28Å; N35-N56 WeakPolarHBondContact O-CA 3.38Å; N35-N56 PolarHBondContact O-OD1 2.97Å; F36-N56 PolarHBondContact N-OD1 3.42Å; L37-N56 PolarHBondContact N-OD1 3.21Å; L37-N56 PolarHBondContact O-OD1 3.35Å; L53-N56 VanDerWaalsContact C-ND2 3.27Å; L53-N56 WeakPolarHBondContact CA-ND2 3.45Å; L53-N56 WeakPolarHBondContact O-CB 3.32Å; L53-N56 PolarHBondContact O-N 2.95Å; L53-N56 PolarHBondContact O-ND2 2.86Å; L53-N56 VanDerWaalsContact O-ND2 3.12Å; T54-N56 PolarHBondContact O-N 2.85Å; T54-N56 VanDerWaalsContact O-N 3.14Å; T54-N56 PolarHBondContact O-ND2 3.05Å; T54-N56 VanDerWaalsContact O-ND2 3.11Å; N56-I58 HydrophobicContact CB-CD1 3.74Å; N56-I58 HydrophobicContact CB-CG1 3.62Å; N56-I58 PolarHBondContact O-N 3.45Å; N56-N79 VanDerWaalsContact C-OD1 3.27Å; N56-N79 WeakPolarHBondContact CA-OD1 3.43Å; N56-N79 PolarHBondContact N-OD1 2.78Å
57	R	87.7	Confident	87.9	Confident	160 Å²	160	57.9 Å²	57.9	60%	0.604	29%	0.288	S	S	*	.			trans	57.8	23.2	-177.6	-50.1	-174.3	-178.3	178.3	-4.5	114.7	F36 F55 K59 N79	F36-R57 HydrophobicContact CE1-CG 4.49Å; F55-R57 PolarHBondContact O-N 3.39Å; F55-R57 VanDerWaalsContact O-N 3.15Å; R57-K59 PolarHBondContact O-N 2.89Å; R57-N79 PolarHBondContact N-OD1 3.17Å
58	I	88.2	Confident	88	Confident	12 Å²	12	56.2 Å²	56.2	6%	0.062	28%	0.277	C	S	.	.			trans	-64.7	132.7	-175.3	-53.2	165.4	0	0	0	109.9	L37 L53 N56 N60 M61 L76 N79 L80 L81	L37-I58 WeakPolarHBondContact O-CD1 3.48Å; L37-I58 WeakPolarHBondContact O-CG1 3.5Å; L53-I58 HydrophobicContact CB-CD1 4.07Å; L53-I58 HydrophobicContact CD1-CD1 4.13Å; N56-I58 HydrophobicContact CB-CD1 3.74Å; N56-I58 HydrophobicContact CB-CG1 3.62Å; N56-I58 PolarHBondContact O-N 3.45Å; I58-N60 WeakPolarHBondContact CG2-O 3.26Å; I58-M61 HydrophobicContact CB-CE 4.26Å; I58-M61 HydrophobicContact CD1-CE 4.07Å; I58-M61 HydrophobicContact CD1-SD 4.44Å; I58-M61 HydrophobicContact CG2-CE 3.55Å; I58-M61 HydrophobicContact CG2-CG 3.3Å; I58-M61 HydrophobicContact CG2-SD 3.97Å; I58-L76 HydrophobicContact CD1-CD2 4.04Å; I58-N79 HydrophobicContact CB-CB 4.29Å; I58-N79 WeakPolarHBondContact CG1-OD1 3.21Å; I58-N79 PolarHBondContact N-OD1 2.91Å; I58-L80 CarbonylContact O-C 3.59Å; I58-L80 VanDerWaalsContact O-C 3.24Å; I58-L80 WeakPolarHBondContact O-CA 3.45Å; I58-L80 PolarHBondContact O-N 3.01Å; I58-L81 HydrophobicContact CB-CD2 4.4Å; I58-L81 HydrophobicContact CG2-CD2 4.22Å; I58-L81 PolarHBondContact O-N 2.96Å
59	K	86.5	Confident	87.9	Confident	129 Å²	129	58.4 Å²	58.4	56%	0.561	29%	0.291	S	S	*	.			trans	-109.9	-55	176.8	-72.9	178	177.2	-179.3	0	112	R57 L80 S82	R57-K59 PolarHBondContact O-N 2.89Å; K59-L80 WeakPolarHBondContact CA-O 3.44Å; K59-L80 HydrophobicContact CG-CB 3.64Å; K59-L80 HydrophobicContact CG-CD1 4.33Å; K59-S82 PolarHBondContact O-N 3.28Å; K59-S82 PolarHBondContact O-OG 2.92Å
60	N	79.7	Confident	87.9	Confident	104 Å²	104	55.9 Å²	55.9	56%	0.556	28%	0.284	S	S	*	.			trans	-121.5	158.1	173.9	-64.1	-15	0	0	0	107.9	I58 S82	I58-N60 WeakPolarHBondContact CG2-O 3.26Å; N60-S82 PolarHBondContact OD1-OG 3.04Å
61	M	80.6	Confident	87.8	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.025	27%	0.265	C	S	.	.			trans	-140.3	136	173.6	-60.4	-176.7	-135.1	0	0	109	L39 I58 F63 L76 L81 V85	L39-M61 HydrophobicContact CB-SD 3.68Å; I58-M61 HydrophobicContact CB-CE 4.26Å; I58-M61 HydrophobicContact CD1-CE 4.07Å; I58-M61 HydrophobicContact CD1-SD 4.44Å; I58-M61 HydrophobicContact CG2-CE 3.55Å; I58-M61 HydrophobicContact CG2-CG 3.3Å; I58-M61 HydrophobicContact CG2-SD 3.97Å; M61-F63 HydrophobicContact CB-CD1 3.84Å; M61-F63 HydrophobicContact CB-CE1 4.16Å; M61-L76 HydrophobicContact CE-CD1 3.81Å; M61-L76 HydrophobicContact CE-CD2 3.42Å; M61-L76 VanDerWaalsContact CE-CD2 3.42Å; M61-L76 HydrophobicContact CE-CG 4.26Å; M61-L76 HydrophobicContact SD-CD2 4.44Å; M61-L81 HydrophobicContact CE-CD2 3.37Å; M61-V85 HydrophobicContact CE-CG1 4.02Å
62	D	78.2	Confident	87.9	Confident	150 Å²	150	53.4 Å²	53.4	80%	0.802	27%	0.272	S	S	*	.			trans	-103.9	123	165.2	-55.9	-47.2	0	0	0	107
63	F	83.3	Confident	88.1	Confident	33 Å²	33	53.6 Å²	53.6	15%	0.145	28%	0.275	C	S	.	.			trans	-155.4	151.5	176.5	62.4	-92.5	0	0	0	109.4	L39 M61 V65 F68 L88 L89 F92	L39-F63 HydrophobicContact CB-CB 4.38Å; L39-F63 HydrophobicContact CB-CD1 4.23Å; L39-F63 HydrophobicContact CB-CG 4.45Å; L39-F63 HydrophobicContact CD2-CB 4.01Å; L39-F63 HydrophobicContact CD2-CD1 3.74Å; L39-F63 HydrophobicContact CD2-CD2 3.76Å; L39-F63 HydrophobicContact CD2-CE1 4.09Å; L39-F63 HydrophobicContact CD2-CE2 4.12Å; L39-F63 HydrophobicContact CD2-CG 3.56Å; L39-F63 HydrophobicContact CD2-CZ 4.26Å; M61-F63 HydrophobicContact CB-CD1 3.84Å; M61-F63 HydrophobicContact CB-CE1 4.16Å; F63-V65 HydrophobicContact CE2-CG2 4.07Å; F63-F68 HydrophobicContact CB-CE2 4.28Å; F63-L88 HydrophobicContact CE1-CB 4.09Å; F63-L88 HydrophobicContact CE1-CD1 4.48Å; F63-L88 HydrophobicContact CE2-CB 4.3Å; F63-L88 HydrophobicContact CZ-CB 3.55Å; F63-L89 HydrophobicContact CE1-CD2 4.22Å; F63-L89 HydrophobicContact CZ-CD2 3.94Å; F63-F92 HydrophobicContact CD2-CE1 4.23Å; F63-F92 AromaticContact CD2-CZ 3.71Å; F63-F92 HydrophobicContact CD2-CZ 3.71Å; F63-F92 AromaticContact CE2-CE1 3.89Å; F63-F92 HydrophobicContact CE2-CE1 3.89Å; F63-F92 AromaticContact CE2-CE2 3.84Å; F63-F92 HydrophobicContact CE2-CE2 3.84Å; F63-F92 AromaticContact CE2-CZ 3.21Å; F63-F92 HydrophobicContact CE2-CZ 3.21Å; F63-F92 HydrophobicContact CZ-CE2 4.05Å; F63-F92 AromaticContact CZ-CZ 3.85Å; F63-F92 HydrophobicContact CZ-CZ 3.85Å
64	D	84.6	Confident	88.3	Confident	94 Å²	94	53.6 Å²	53.6	50%	0.503	28%	0.275	S	S	.	.			trans	-89.8	138.1	163.9	-160.5	-33.1	0	0	0	109.1	A66 D67	D64-A66 PolarHBondContact O-N 3.25Å; D64-A66 WeakPolarHBondContact OD1-CB 3.21Å; D64-A66 PolarHBondContact OD1-N 3.12Å; D64-D67 PolarHBondContact O-N 3.08Å
65	V	83.9	Confident	88.5	Confident	26 Å²	26	54.1 Å²	54.1	16%	0.158	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-66	-29.3	174	-179.9	0	0	0	0	110.4	F63 D67 F68 Q91 F92	F63-V65 HydrophobicContact CE2-CG2 4.07Å; V65-D67 PolarHBondContact O-N 3.33Å; V65-F68 PolarHBondContact O-N 2.88Å; V65-Q91 HydrophobicContact CB-CB 4.45Å; V65-Q91 HydrophobicContact CG1-CB 4.05Å; V65-Q91 WeakPolarHBondContact CG1-O 3.25Å; V65-Q91 HydrophobicContact CG2-CB 3.63Å; V65-F92 HydrophobicContact CB-CE1 4.46Å; V65-F92 HydrophobicContact CG1-CD1 3.85Å; V65-F92 HydrophobicContact CG1-CE1 4.21Å
66	A	85.9	Confident	88.8	Confident	71 Å²	71	50.3 Å²	50.3	59%	0.587	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-63.1	-25.9	177.7	0	0	0	0	0	113.5	D64 F68	D64-A66 PolarHBondContact O-N 3.25Å; D64-A66 WeakPolarHBondContact OD1-CB 3.21Å; D64-A66 PolarHBondContact OD1-N 3.12Å; A66-F68 VanDerWaalsContact C-N 3.26Å; A66-F68 PolarHBondContact O-N 2.95Å
67	D	87.7	Confident	89.1	Confident	55 Å²	55	50.4 Å²	50.4	29%	0.294	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-70.1	-23.3	178.8	-64.2	-25.2	0	0	0	112.5	S43 D64 V65 P69	S43-D67 VanDerWaalsContact CB-OD2 3.26Å; S43-D67 WeakPolarHBondContact CB-OD2 3.29Å; D64-D67 PolarHBondContact O-N 3.08Å; V65-D67 PolarHBondContact O-N 3.33Å; D67-P69 WeakPolarHBondContact O-CD 3.45Å
68	F	91.5	Very high	89.4	Confident	1 Å²	1	46 Å²	46	0%	0.004	25%	0.246	C	C	.	.			trans	-119.9	55.3	-173.5	-56.4	-78	0	0	0	113	L39 F42 L48 F63 V65 A66 H70 L71 F92	L39-F68 HydrophobicContact CD2-CD2 4.01Å; L39-F68 HydrophobicContact CD2-CE2 3.75Å; L39-F68 HydrophobicContact CD2-CZ 4.24Å; L39-F68 HydrophobicContact CG-CE2 4.05Å; L39-F68 HydrophobicContact CG-CZ 4.04Å; L39-F68 VanDerWaalsContact O-CZ 3.3Å; L39-F68 WeakPolarHBondContact O-CZ 3.35Å; F42-F68 HydrophobicContact CB-CE1 3.89Å; F42-F68 HydrophobicContact CB-CZ 4.13Å; F42-F68 WeakPolarHBondContact O-CE1 3.37Å; L48-F68 HydrophobicContact CD2-CD1 4.04Å; L48-F68 HydrophobicContact CD2-CE1 3.94Å; F63-F68 HydrophobicContact CB-CE2 4.28Å; V65-F68 PolarHBondContact O-N 2.88Å; A66-F68 VanDerWaalsContact C-N 3.26Å; A66-F68 PolarHBondContact O-N 2.95Å; F68-H70 PolarHBondContact O-N 3.1Å; F68-L71 HydrophobicContact CB-CB 4.1Å; F68-L71 HydrophobicContact CB-CD2 4.44Å; F68-L71 PolarHBondContact O-N 3.41Å; F68-F92 HydrophobicContact CB-CD1 4.14Å; F68-F92 HydrophobicContact CB-CE1 3.69Å; F68-F92 AromaticContact CD2-CE1 3.97Å; F68-F92 HydrophobicContact CD2-CE1 3.97Å; F68-F92 HydrophobicContact CD2-CZ 4.27Å; F68-F92 HydrophobicContact CG-CE1 4.18Å
69	P	90.1	Very high	89.7	Confident	46 Å²	46	45.5 Å²	45.5	30%	0.299	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-10.6	-171.8	32	-38.2	0	0	0	113.7	D67	D67-P69 WeakPolarHBondContact O-CD 3.45Å
70	H	93.7	Very high	89.8	Confident	67 Å²	67	42.7 Å²	42.7	31%	0.31	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	5.2	-172.5	-66.4	-11.9	0	0	0	114.1	L48 F68 E72 R94	L48-H70 CarbonylContact O-C 2.73Å; F68-H70 PolarHBondContact O-N 3.1Å; H70-E72 WeakPolarHBondContact O-CG 3.43Å; H70-E72 PolarHBondContact O-N 2.85Å; H70-R94 PolarHBondContact ND1-NH1 3.35Å
71	L	95.1	Very high	90.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	21%	0.211	C	C	.	.			trans	-66.2	120.4	-179.6	-167.5	70.4	0	0	0	110.8	L48 L51 F68 L74 F92 R94 L95	L48-L71 HydrophobicContact CD2-CD1 4.43Å; L48-L71 HydrophobicContact CG-CD1 4.18Å; L48-L71 PolarHBondContact O-N 3.12Å; L51-L71 HydrophobicContact CB-CD1 4.03Å; F68-L71 HydrophobicContact CB-CB 4.1Å; F68-L71 HydrophobicContact CB-CD2 4.44Å; F68-L71 PolarHBondContact O-N 3.41Å; L71-L74 HydrophobicContact CD2-CB 4.25Å; L71-L74 HydrophobicContact CD2-CD2 4.25Å; L71-F92 HydrophobicContact CD2-CD2 4.42Å; L71-F92 HydrophobicContact CD2-CE2 4.27Å; L71-F92 HydrophobicContact CD2-CZ 4.39Å; L71-R94 CarbonylContact O-C 3.14Å; L71-L95 HydrophobicContact CG-CD1 4.41Å; L71-L95 WeakPolarHBondContact O-CA 3.44Å; L71-L95 PolarHBondContact O-N 2.88Å
72	E	96.1	Very high	90.4	Very high	37 Å²	37	39.5 Å²	39.5	17%	0.173	22%	0.22	C	C	.	.			trans	-110.6	-33.3	-178.7	-57.5	-170.4	-148.2	0	0	111.9	R49 H70 K96 T97	R49-E72 IonicContact CZ-OE1 2.69Å; R49-E72 IonicContact NH1-OE1 3.14Å; R49-E72 PolarHBondContact NH1-OE1 3.34Å; R49-E72 PolarHBondContact O-N 3.35Å; H70-E72 WeakPolarHBondContact O-CG 3.43Å; H70-E72 PolarHBondContact O-N 2.85Å; E72-K96 PolarHBondContact O-N 3.05Å; E72-K96 WeakPolarHBondContact OE2-CE 2.97Å; E72-K96 IonicContact OE2-NZ 2.93Å; E72-K96 PolarHBondContact OE2-NZ 3.01Å; E72-T97 PolarHBondContact O-N 3.39Å
73	V	96.9	Very high	90.3	Very high	36 Å²	36	34.2 Å²	34.2	22%	0.218	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.3	-179.2	-174.7	0	0	0	0	110	R49 E50 L51 T97	R49-V73 PolarHBondContact O-N 3.47Å; E50-V73 WeakPolarHBondContact CA-O 3.49Å; E50-V73 HydrophobicContact CB-CB 4.21Å; E50-V73 HydrophobicContact CG-CB 3.93Å; E50-V73 HydrophobicContact CG-CG2 3.96Å; L51-V73 PolarHBondContact N-O 3.39Å; L51-V73 VanDerWaalsContact N-O 3.09Å; V73-T97 WeakPolarHBondContact CA-O 3.23Å; V73-T97 HydrophobicContact CG1-CG2 4.03Å
74	L	96.9	Very high	90	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.3	174.8	179.9	57.3	0	0	0	110.2	L39 L51 L71 L76 L89 F92 L95 T97 L98 H99	L39-L74 HydrophobicContact CD1-CD1 3.71Å; L39-L74 HydrophobicContact CD1-CD2 4.18Å; L51-L74 HydrophobicContact CB-CD1 4.11Å; L51-L74 HydrophobicContact CD2-CD1 4.19Å; L51-L74 HydrophobicContact CG-CD1 4.16Å; L71-L74 HydrophobicContact CD2-CB 4.25Å; L71-L74 HydrophobicContact CD2-CD2 4.25Å; L74-L76 HydrophobicContact CD1-CD2 4.46Å; L74-L76 HydrophobicContact CD1-CG 4.16Å; L74-L76 HydrophobicContact CD2-CD1 3.79Å; L74-L76 HydrophobicContact CD2-CG 4.3Å; L74-L76 HydrophobicContact CG-CD1 3.99Å; L74-L76 HydrophobicContact CG-CG 3.96Å; L74-L89 HydrophobicContact CD2-CD2 3.73Å; L74-F92 HydrophobicContact CD2-CE2 4.32Å; L74-L95 HydrophobicContact CB-CD1 3.72Å; L74-T97 PolarHBondContact N-O 2.82Å; L74-L98 HydrophobicContact CB-CD1 4.26Å; L74-L98 HydrophobicContact CD2-CD1 4.33Å; L74-L98 HydrophobicContact CG-CD1 4.29Å; L74-L98 WeakPolarHBondContact O-CA 3.4Å; L74-H99 PolarHBondContact O-N 2.97Å
75	N	95.8	Very high	90	Very high	25 Å²	25	35.2 Å²	35.2	13%	0.134	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.3	174.2	-175.1	6.4	0	0	0	110.8	L51 D52 L53 T54 S77 H99	L51-N75 PolarHBondContact O-N 2.99Å; D52-N75 HydrophobicContact CB-CB 4.43Å; D52-N75 PolarHBondContact OD1-ND2 3.05Å; D52-N75 PolarHBondContact OD2-ND2 3.43Å; L53-N75 WeakPolarHBondContact CA-O 3.36Å; L53-N75 PolarHBondContact N-O 2.93Å; T54-N75 VanDerWaalsContact OG1-CG 3.23Å; T54-N75 PolarHBondContact OG1-ND2 3.43Å; T54-N75 PolarHBondContact OG1-OD1 3.09Å; N75-S77 VanDerWaalsContact OD1-CB 3.23Å; N75-S77 WeakPolarHBondContact OD1-CB 3.4Å; N75-S77 PolarHBondContact OD1-N 3.06Å; N75-S77 PolarHBondContact OD1-OG 3.04Å; N75-H99 HydrophobicContact CB-CB 4.27Å; N75-H99 VanDerWaalsContact OD1-CB 3.32Å; N75-H99 WeakPolarHBondContact OD1-CB 3.49Å
76	L	95.3	Very high	90	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.192	C	C	.	.			trans	-120.4	26.5	178.2	-69.8	167.3	0	0	0	111.6	L53 I58 M61 L74 N79 L81 L89 L98 H99 L100 N103	L53-L76 HydrophobicContact CB-CD2 3.9Å; L53-L76 HydrophobicContact CD1-CD2 4.07Å; I58-L76 HydrophobicContact CD1-CD2 4.04Å; M61-L76 HydrophobicContact CE-CD1 3.81Å; M61-L76 HydrophobicContact CE-CD2 3.42Å; M61-L76 VanDerWaalsContact CE-CD2 3.42Å; M61-L76 HydrophobicContact CE-CG 4.26Å; M61-L76 HydrophobicContact SD-CD2 4.44Å; L74-L76 HydrophobicContact CD1-CD2 4.46Å; L74-L76 HydrophobicContact CD1-CG 4.16Å; L74-L76 HydrophobicContact CD2-CD1 3.79Å; L74-L76 HydrophobicContact CD2-CG 4.3Å; L74-L76 HydrophobicContact CG-CD1 3.99Å; L74-L76 HydrophobicContact CG-CG 3.96Å; L76-N79 VanDerWaalsContact C-ND2 3.28Å; L76-N79 PolarHBondContact O-ND2 2.93Å; L76-L81 HydrophobicContact CB-CD1 3.99Å; L76-L81 HydrophobicContact CD1-CD1 4.11Å; L76-L89 HydrophobicContact CD1-CD1 3.59Å; L76-L89 HydrophobicContact CD1-CD2 4.16Å; L76-L98 HydrophobicContact CD1-CD1 4.45Å; L76-H99 CarbonylContact C-O 3.03Å; L76-H99 WeakPolarHBondContact CA-O 3.39Å; L76-H99 PolarHBondContact N-O 2.91Å; L76-L100 HydrophobicContact CB-CD2 4.24Å; L76-L100 HydrophobicContact CD1-CD2 4.42Å; L76-N103 PolarHBondContact O-ND2 3.21Å
77	S	93.9	Very high	89.8	Confident	7 Å²	7	33.3 Å²	33.3	5%	0.049	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	148.1	-177.1	-58.3	0	0	0	0	112.7	T54 F55 N75 N79 H99 T101	T54-S77 VanDerWaalsContact CA-O 3.27Å; T54-S77 WeakPolarHBondContact CA-O 3.41Å; T54-S77 WeakPolarHBondContact CG2-O 3.45Å; F55-S77 PolarHBondContact N-O 3.25Å; N75-S77 VanDerWaalsContact OD1-CB 3.23Å; N75-S77 WeakPolarHBondContact OD1-CB 3.4Å; N75-S77 PolarHBondContact OD1-N 3.06Å; N75-S77 PolarHBondContact OD1-OG 3.04Å; S77-N79 VanDerWaalsContact C-N 3.25Å; S77-N79 PolarHBondContact O-N 2.99Å; S77-N79 PolarHBondContact O-ND2 2.88Å; S77-H99 WeakPolarHBondContact OG-CB 3.32Å; S77-T101 CarbonylContact C-O 3.47Å; S77-T101 VanDerWaalsContact CA-O 3.31Å; S77-T101 WeakPolarHBondContact CA-O 3.5Å
78	F	94.2	Very high	89.6	Confident	66 Å²	66	33.8 Å²	33.8	29%	0.289	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	38.6	179	-54.5	-74.9	0	0	0	114.5	T54 F55 T101 E141	T54-F78 HydrophobicContact CG2-CD2 3.98Å; F55-F78 HydrophobicContact CD1-CB 3.37Å; F55-F78 HydrophobicContact CD1-CD2 4.48Å; F55-F78 HydrophobicContact CD1-CG 4.08Å; F55-F78 HydrophobicContact CE1-CB 3.25Å; F55-F78 HydrophobicContact CE1-CD1 4.09Å; F55-F78 AromaticContact CE1-CD2 3.76Å; F55-F78 HydrophobicContact CE1-CD2 3.76Å; F55-F78 AromaticContact CE1-CG 3.42Å; F55-F78 HydrophobicContact CE1-CG 3.42Å; F55-F78 VanDerWaalsContact CE1-CG 3.42Å; F55-F78 HydrophobicContact CE2-CD2 4.05Å; F55-F78 HydrophobicContact CG-CB 4.14Å; F55-F78 HydrophobicContact CZ-CB 3.92Å; F55-F78 HydrophobicContact CZ-CD1 4.41Å; F55-F78 AromaticContact CZ-CD2 3.48Å; F55-F78 HydrophobicContact CZ-CD2 3.48Å; F55-F78 VanDerWaalsContact CZ-CD2 3.48Å; F55-F78 HydrophobicContact CZ-CE2 4.1Å; F55-F78 AromaticContact CZ-CG 3.67Å; F55-F78 HydrophobicContact CZ-CG 3.67Å; F78-T101 HydrophobicContact CE1-CG2 4.21Å; F78-T101 HydrophobicContact CE2-CG2 4.02Å; F78-T101 HydrophobicContact CZ-CG2 3.69Å; F78-T101 PolarHBondContact N-O 3.26Å; F78-E141 WeakPolarHBondContact CE1-OE2 3.32Å
79	N	92.8	Very high	89.4	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.011	18%	0.181	C	C	.	.			trans	-98.8	-163.1	167.2	-75.7	-72.7	0	0	0	110.2	L53 N56 R57 I58 L76 S77 L81 N103	L53-N79 PolarHBondContact O-ND2 3.32Å; N56-N79 VanDerWaalsContact C-OD1 3.27Å; N56-N79 WeakPolarHBondContact CA-OD1 3.43Å; N56-N79 PolarHBondContact N-OD1 2.78Å; R57-N79 PolarHBondContact N-OD1 3.17Å; I58-N79 HydrophobicContact CB-CB 4.29Å; I58-N79 WeakPolarHBondContact CG1-OD1 3.21Å; I58-N79 PolarHBondContact N-OD1 2.91Å; L76-N79 VanDerWaalsContact C-ND2 3.28Å; L76-N79 PolarHBondContact O-ND2 2.93Å; S77-N79 VanDerWaalsContact C-N 3.25Å; S77-N79 PolarHBondContact O-N 2.99Å; S77-N79 PolarHBondContact O-ND2 2.88Å; N79-L81 HydrophobicContact CB-CD2 4.49Å; N79-L81 HydrophobicContact CB-CG 4.18Å; N79-N103 WeakPolarHBondContact CA-OD1 3.18Å; N79-N103 VanDerWaalsContact CB-OD1 3.24Å; N79-N103 WeakPolarHBondContact CB-OD1 3.33Å; N79-N103 PolarHBondContact N-OD1 3.11Å; N79-N103 PolarHBondContact O-OD1 3.45Å
80	L	89.9	Confident	89.2	Confident	70 Å²	70	31.7 Å²	31.7	37%	0.366	17%	0.168	S	C	.	.			trans	-131.7	38.5	-175.7	-64.5	173.4	0	0	0	110.6	I58 K59 N103	I58-L80 CarbonylContact O-C 3.59Å; I58-L80 VanDerWaalsContact O-C 3.24Å; I58-L80 WeakPolarHBondContact O-CA 3.45Å; I58-L80 PolarHBondContact O-N 3.01Å; K59-L80 WeakPolarHBondContact CA-O 3.44Å; K59-L80 HydrophobicContact CG-CB 3.64Å; K59-L80 HydrophobicContact CG-CD1 4.33Å; L80-N103 PolarHBondContact N-OD1 3.19Å
81	L	89.5	Confident	88.9	Confident	10 Å²	10	33.8 Å²	33.8	5%	0.052	18%	0.178	C	C	.	.			trans	-60.5	139	-166.6	-64.3	173.8	0	0	0	113.9	I58 M61 L76 N79 V85 L86 L100 N103	I58-L81 HydrophobicContact CB-CD2 4.4Å; I58-L81 HydrophobicContact CG2-CD2 4.22Å; I58-L81 PolarHBondContact O-N 2.96Å; M61-L81 HydrophobicContact CE-CD2 3.37Å; L76-L81 HydrophobicContact CB-CD1 3.99Å; L76-L81 HydrophobicContact CD1-CD1 4.11Å; N79-L81 HydrophobicContact CB-CD2 4.49Å; N79-L81 HydrophobicContact CB-CG 4.18Å; L81-V85 HydrophobicContact CD2-CG1 4.25Å; L81-L86 HydrophobicContact CD1-CD2 4.44Å; L81-L100 HydrophobicContact CD1-CD2 3.45Å; L81-L100 VanDerWaalsContact CD1-CD2 3.45Å; L81-N103 WeakPolarHBondContact CD1-OD1 3.35Å; L81-N103 WeakPolarHBondContact CG-OD1 3.35Å; L81-N103 PolarHBondContact N-OD1 3.31Å
82	S	83.3	Confident	88.6	Confident	32 Å²	32	33.9 Å²	33.9	22%	0.224	18%	0.178	C	C	.	.			trans	-81.4	156.2	167.2	66.2	0	0	0	0	111.9	K59 N60 E84 V85	K59-S82 PolarHBondContact O-N 3.28Å; K59-S82 PolarHBondContact O-OG 2.92Å; N60-S82 PolarHBondContact OD1-OG 3.04Å; S82-E84 PolarHBondContact O-N 3.12Å; S82-V85 PolarHBondContact O-N 3.29Å
83	A	76.4	Confident	88.2	Confident	40 Å²	40	36.2 Å²	36.2	33%	0.331	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-21	177.2	0	0	0	0	0	113.1	L86 P109	A83-L86 PolarHBondContact O-N 2.92Å; A83-P109 WeakPolarHBondContact O-CG 3.42Å
84	E	77.2	Confident	88	Confident	143 Å²	143	40.4 Å²	40.4	67%	0.668	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-41.7	177.5	-67.5	170.2	-174.3	0	0	111.5	S82 L86 L87	S82-E84 PolarHBondContact O-N 3.12Å; E84-L86 PolarHBondContact O-N 3.25Å; E84-L87 WeakPolarHBondContact O-CB 3.25Å; E84-L87 PolarHBondContact O-N 3.28Å; E84-L87 VanDerWaalsContact O-N 3.08Å
85	V	83.2	Confident	87.9	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.024	21%	0.208	C	C	.	.	H	α-helix	trans	-59.1	-37.9	176.6	176.6	0	0	0	0	111.2	M61 L81 S82 L87 L88 L89	M61-V85 HydrophobicContact CE-CG1 4.02Å; L81-V85 HydrophobicContact CD2-CG1 4.25Å; S82-V85 PolarHBondContact O-N 3.29Å; V85-L87 PolarHBondContact O-N 3.23Å; V85-L88 WeakPolarHBondContact O-CB 3.06Å; V85-L88 PolarHBondContact O-N 2.79Å; V85-L89 HydrophobicContact CG1-CD1 4.33Å; V85-L89 HydrophobicContact CG1-CD2 4.46Å; V85-L89 HydrophobicContact CG1-CG 4.14Å; V85-L89 WeakPolarHBondContact O-CG 3.4Å; V85-L89 PolarHBondContact O-N 2.94Å
86	L	83.8	Confident	87.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.6	-23.9	179.8	-57.6	-178.5	0	0	0	113.4	L81 A83 E84 L89 G90 L100 L105 L108 P109 F112 F131	L81-L86 HydrophobicContact CD1-CD2 4.44Å; A83-L86 PolarHBondContact O-N 2.92Å; E84-L86 PolarHBondContact O-N 3.25Å; L86-L89 HydrophobicContact CD2-CD1 4.02Å; L86-G90 PolarHBondContact O-N 3.02Å; L86-L100 HydrophobicContact CD2-CD1 3.72Å; L86-L100 HydrophobicContact CD2-CD2 3.77Å; L86-L100 HydrophobicContact CD2-CG 4.43Å; L86-L105 HydrophobicContact CD1-CD1 4.04Å; L86-L105 HydrophobicContact CD1-CD2 4.09Å; L86-L108 HydrophobicContact CD1-CD2 3.8Å; L86-P109 HydrophobicContact CB-CG 4.05Å; L86-F112 HydrophobicContact CB-CE2 3.74Å; L86-F112 HydrophobicContact CB-CZ 3.93Å; L86-F131 WeakPolarHBondContact O-CZ 3.31Å
87	L	81.5	Confident	88	Confident	57 Å²	57	44.2 Å²	44.2	30%	0.298	23%	0.226	S	C	.	.	H	α-helix	trans	-70.5	-42.2	172.5	-66.9	172.1	0	0	0	111.6	E84 V85 G90 P109 N111	E84-L87 WeakPolarHBondContact O-CB 3.25Å; E84-L87 PolarHBondContact O-N 3.28Å; E84-L87 VanDerWaalsContact O-N 3.08Å; V85-L87 PolarHBondContact O-N 3.23Å; L87-G90 PolarHBondContact O-N 3.14Å; L87-P109 HydrophobicContact CD1-CB 4.38Å; L87-P109 HydrophobicContact CD2-CB 3.72Å; L87-P109 HydrophobicContact CD2-CG 3.73Å; L87-P109 HydrophobicContact CG-CB 3.91Å; L87-P109 HydrophobicContact CG-CG 3.9Å; L87-N111 HydrophobicContact CD2-CB 3.63Å
88	L	84.3	Confident	88.1	Confident	66 Å²	66	43.9 Å²	43.9	35%	0.346	22%	0.224	S	C	.	.	H	α-helix	trans	-68.2	-42.4	179	-58.5	175	0	0	0	111.2	F63 V85 G90 Q91	F63-L88 HydrophobicContact CE1-CB 4.09Å; F63-L88 HydrophobicContact CE1-CD1 4.48Å; F63-L88 HydrophobicContact CE2-CB 4.3Å; F63-L88 HydrophobicContact CZ-CB 3.55Å; V85-L88 WeakPolarHBondContact O-CB 3.06Å; V85-L88 PolarHBondContact O-N 2.79Å; L88-G90 PolarHBondContact O-N 3.25Å; L88-G90 VanDerWaalsContact O-N 3.12Å; L88-Q91 WeakPolarHBondContact O-CB 3.49Å; L88-Q91 PolarHBondContact O-N 3.37Å
89	L	88.5	Confident	88.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-27.3	174.5	-61.7	-177.8	0	0	0	112.7	F63 L74 L76 V85 L86 Q91 F92 L98 F131	F63-L89 HydrophobicContact CE1-CD2 4.22Å; F63-L89 HydrophobicContact CZ-CD2 3.94Å; L74-L89 HydrophobicContact CD2-CD2 3.73Å; L76-L89 HydrophobicContact CD1-CD1 3.59Å; L76-L89 HydrophobicContact CD1-CD2 4.16Å; V85-L89 HydrophobicContact CG1-CD1 4.33Å; V85-L89 HydrophobicContact CG1-CD2 4.46Å; V85-L89 HydrophobicContact CG1-CG 4.14Å; V85-L89 WeakPolarHBondContact O-CG 3.4Å; V85-L89 PolarHBondContact O-N 2.94Å; L86-L89 HydrophobicContact CD2-CD1 4.02Å; L89-Q91 PolarHBondContact O-N 3.02Å; L89-F92 HydrophobicContact CD2-CD2 4.48Å; L89-F92 HydrophobicContact CD2-CE2 3.75Å; L89-F92 VanDerWaalsContact O-CD2 3.3Å; L89-F92 WeakPolarHBondContact O-CD2 3.23Å; L89-L98 HydrophobicContact CD1-CD1 4.28Å; L89-L98 HydrophobicContact CD1-CD2 4.41Å; L89-F131 HydrophobicContact CB-CE1 4.22Å; L89-F131 HydrophobicContact CB-CZ 4.03Å; L89-F131 WeakPolarHBondContact O-CE1 3.48Å
90	G	84.3	Confident	88.3	Confident	2 Å²	2	43.1 Å²	43.1	2%	0.021	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-20	177	0	0	0	0	0	114.2	L86 L87 L88 F92 P130 F131	L86-G90 PolarHBondContact O-N 3.02Å; L87-G90 PolarHBondContact O-N 3.14Å; L88-G90 PolarHBondContact O-N 3.25Å; L88-G90 VanDerWaalsContact O-N 3.12Å; G90-F92 VanDerWaalsContact C-N 3.33Å; G90-P130 CarbonylContact O-C 3.28Å; G90-P130 VanDerWaalsContact O-CA 3.22Å; G90-P130 WeakPolarHBondContact O-CA 3.27Å; G90-F131 PolarHBondContact O-N 2.95Å
91	Q	87.1	Confident	88.5	Confident	111 Å²	111	40.3 Å²	40.3	52%	0.519	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-11.8	-176.2	-62.4	176.6	-9.4	0	0	113	V65 L88 L89 P93	V65-Q91 HydrophobicContact CB-CB 4.45Å; V65-Q91 HydrophobicContact CG1-CB 4.05Å; V65-Q91 WeakPolarHBondContact CG1-O 3.25Å; V65-Q91 HydrophobicContact CG2-CB 3.63Å; L88-Q91 WeakPolarHBondContact O-CB 3.49Å; L88-Q91 PolarHBondContact O-N 3.37Å; L89-Q91 PolarHBondContact O-N 3.02Å; Q91-P93 WeakPolarHBondContact O-CD 2.89Å
92	F	89.9	Confident	88.6	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.018	21%	0.21	C	C	.	.			trans	-63.7	120	179.6	-71.6	-53.9	0	0	0	112.2	L39 F63 V65 F68 L71 L74 L89 G90 R94 L95	L39-F92 HydrophobicContact CD2-CE2 4.19Å; L39-F92 HydrophobicContact CD2-CZ 3.58Å; F63-F92 HydrophobicContact CD2-CE1 4.23Å; F63-F92 AromaticContact CD2-CZ 3.71Å; F63-F92 HydrophobicContact CD2-CZ 3.71Å; F63-F92 AromaticContact CE2-CE1 3.89Å; F63-F92 HydrophobicContact CE2-CE1 3.89Å; F63-F92 AromaticContact CE2-CE2 3.84Å; F63-F92 HydrophobicContact CE2-CE2 3.84Å; F63-F92 AromaticContact CE2-CZ 3.21Å; F63-F92 HydrophobicContact CE2-CZ 3.21Å; F63-F92 HydrophobicContact CZ-CE2 4.05Å; F63-F92 AromaticContact CZ-CZ 3.85Å; F63-F92 HydrophobicContact CZ-CZ 3.85Å; V65-F92 HydrophobicContact CB-CE1 4.46Å; V65-F92 HydrophobicContact CG1-CD1 3.85Å; V65-F92 HydrophobicContact CG1-CE1 4.21Å; F68-F92 HydrophobicContact CB-CD1 4.14Å; F68-F92 HydrophobicContact CB-CE1 3.69Å; F68-F92 AromaticContact CD2-CE1 3.97Å; F68-F92 HydrophobicContact CD2-CE1 3.97Å; F68-F92 HydrophobicContact CD2-CZ 4.27Å; F68-F92 HydrophobicContact CG-CE1 4.18Å; L71-F92 HydrophobicContact CD2-CD2 4.42Å; L71-F92 HydrophobicContact CD2-CE2 4.27Å; L71-F92 HydrophobicContact CD2-CZ 4.39Å; L74-F92 HydrophobicContact CD2-CE2 4.32Å; L89-F92 HydrophobicContact CD2-CD2 4.48Å; L89-F92 HydrophobicContact CD2-CE2 3.75Å; L89-F92 VanDerWaalsContact O-CD2 3.3Å; L89-F92 WeakPolarHBondContact O-CD2 3.23Å; G90-F92 VanDerWaalsContact C-N 3.33Å; F92-R94 PolarHBondContact O-N 3.38Å; F92-R94 VanDerWaalsContact O-N 3.14Å; F92-L95 HydrophobicContact CB-CB 3.8Å; F92-L95 HydrophobicContact CD2-CD2 4.31Å
93	P	87.6	Confident	89.1	Confident	86 Å²	86	39 Å²	39	56%	0.558	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-12.8	-167.7	29	-36.8	0	0	0	114.3	Q91	Q91-P93 WeakPolarHBondContact O-CD 2.89Å
94	R	93.2	Very high	89.7	Confident	123 Å²	123	42 Å²	42	46%	0.464	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.8	3.6	-173.8	-68.5	-170.8	175.6	-177.2	2.2	114.7	H70 L71 F92 K96	H70-R94 PolarHBondContact ND1-NH1 3.35Å; L71-R94 CarbonylContact O-C 3.14Å; F92-R94 PolarHBondContact O-N 3.38Å; F92-R94 VanDerWaalsContact O-N 3.14Å; R94-K96 PolarHBondContact O-N 3.42Å; R94-K96 VanDerWaalsContact O-N 3.15Å
95	L	94.9	Very high	90.4	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.177	C	C	.	.			trans	-66.2	115.1	-176.9	-170.4	71.7	0	0	0	110.5	L71 L74 F92 L98 F131 A133 L134	L71-L95 HydrophobicContact CG-CD1 4.41Å; L71-L95 WeakPolarHBondContact O-CA 3.44Å; L71-L95 PolarHBondContact O-N 2.88Å; L74-L95 HydrophobicContact CB-CD1 3.72Å; F92-L95 HydrophobicContact CB-CB 3.8Å; F92-L95 HydrophobicContact CD2-CD2 4.31Å; L95-L98 HydrophobicContact CD2-CB 4.21Å; L95-L98 HydrophobicContact CD2-CD1 4.46Å; L95-L98 HydrophobicContact CD2-CD2 4.3Å; L95-F131 HydrophobicContact CD2-CD1 4.4Å; L95-F131 HydrophobicContact CD2-CE1 4.12Å; L95-A133 CarbonylContact O-C 3.18Å; L95-A133 VanDerWaalsContact O-C 3.27Å; L95-L134 HydrophobicContact CG-CD1 4.42Å; L95-L134 WeakPolarHBondContact O-CA 3.11Å; L95-L134 PolarHBondContact O-N 2.82Å
96	K	95.6	Very high	90.7	Very high	77 Å²	77	42.6 Å²	42.6	34%	0.335	21%	0.207	S	C	.	.			trans	-101.5	-35.8	179.5	-66.4	170.7	-171.4	168.7	0	111.9	E72 R94 L134 E135 V136	E72-K96 PolarHBondContact O-N 3.05Å; E72-K96 WeakPolarHBondContact OE2-CE 2.97Å; E72-K96 IonicContact OE2-NZ 2.93Å; E72-K96 PolarHBondContact OE2-NZ 3.01Å; R94-K96 PolarHBondContact O-N 3.42Å; R94-K96 VanDerWaalsContact O-N 3.15Å; K96-L134 WeakPolarHBondContact O-CD1 3.11Å; K96-E135 PolarHBondContact O-N 3.2Å; K96-V136 PolarHBondContact O-N 3.16Å
97	T	96.9	Very high	90.8	Very high	27 Å²	27	45.7 Å²	45.7	17%	0.166	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123.5	-173.3	-58.3	0	0	0	0	110	E72 V73 L74 H99 V136	E72-T97 PolarHBondContact O-N 3.39Å; V73-T97 WeakPolarHBondContact CA-O 3.23Å; V73-T97 HydrophobicContact CG1-CG2 4.03Å; L74-T97 PolarHBondContact N-O 2.82Å; T97-H99 VanDerWaalsContact CG2-NE2 3.3Å; T97-H99 WeakPolarHBondContact CG2-NE2 3.25Å; T97-V136 WeakPolarHBondContact CA-O 3.45Å; T97-V136 HydrophobicContact CG2-CB 4.01Å; T97-V136 HydrophobicContact CG2-CG1 4.01Å
98	L	96.7	Very high	91.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	121.3	177.9	178.9	56.2	0	0	0	110.3	L74 L76 L89 L95 L100 F131 L134 V136 L137 M138	L74-L98 HydrophobicContact CB-CD1 4.26Å; L74-L98 HydrophobicContact CD2-CD1 4.33Å; L74-L98 HydrophobicContact CG-CD1 4.29Å; L74-L98 WeakPolarHBondContact O-CA 3.4Å; L76-L98 HydrophobicContact CD1-CD1 4.45Å; L89-L98 HydrophobicContact CD1-CD1 4.28Å; L89-L98 HydrophobicContact CD1-CD2 4.41Å; L95-L98 HydrophobicContact CD2-CB 4.21Å; L95-L98 HydrophobicContact CD2-CD1 4.46Å; L95-L98 HydrophobicContact CD2-CD2 4.3Å; L98-L100 HydrophobicContact CD1-CD2 4.2Å; L98-L100 HydrophobicContact CD1-CG 4.21Å; L98-L100 HydrophobicContact CD2-CD1 3.9Å; L98-L100 HydrophobicContact CD2-CG 4.28Å; L98-L100 HydrophobicContact CG-CD1 4.06Å; L98-L100 HydrophobicContact CG-CD2 4.41Å; L98-L100 HydrophobicContact CG-CG 3.93Å; L98-F131 HydrophobicContact CD2-CE1 3.67Å; L98-F131 HydrophobicContact CD2-CZ 4.11Å; L98-L134 HydrophobicContact CB-CD1 3.85Å; L98-V136 PolarHBondContact N-O 3.46Å; L98-L137 HydrophobicContact CB-CD1 4.2Å; L98-L137 HydrophobicContact CD2-CD1 4.22Å; L98-L137 HydrophobicContact CG-CD1 4.22Å; L98-M138 PolarHBondContact O-N 3.23Å
99	H	96.1	Very high	91	Very high	53 Å²	53	40.6 Å²	40.6	25%	0.245	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.5	173.2	-57.5	-112.9	0	0	0	110.7	L74 N75 L76 S77 T97 M138	L74-H99 PolarHBondContact O-N 2.97Å; N75-H99 HydrophobicContact CB-CB 4.27Å; N75-H99 VanDerWaalsContact OD1-CB 3.32Å; N75-H99 WeakPolarHBondContact OD1-CB 3.49Å; L76-H99 CarbonylContact C-O 3.03Å; L76-H99 WeakPolarHBondContact CA-O 3.39Å; L76-H99 PolarHBondContact N-O 2.91Å; S77-H99 WeakPolarHBondContact OG-CB 3.32Å; T97-H99 VanDerWaalsContact CG2-NE2 3.3Å; T97-H99 WeakPolarHBondContact CG2-NE2 3.25Å; H99-M138 HydrophobicContact CB-CB 4.41Å; H99-M138 WeakPolarHBondContact ND1-CG 2.98Å
100	L	95.1	Very high	89.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.23	C	C	.	.			trans	-128.8	21.2	-179.8	-64.9	169.5	0	0	0	111.3	L76 L81 L86 L98 N103 L105 L137 M138 L139 N142	L76-L100 HydrophobicContact CB-CD2 4.24Å; L76-L100 HydrophobicContact CD1-CD2 4.42Å; L81-L100 HydrophobicContact CD1-CD2 3.45Å; L81-L100 VanDerWaalsContact CD1-CD2 3.45Å; L86-L100 HydrophobicContact CD2-CD1 3.72Å; L86-L100 HydrophobicContact CD2-CD2 3.77Å; L86-L100 HydrophobicContact CD2-CG 4.43Å; L98-L100 HydrophobicContact CD1-CD2 4.2Å; L98-L100 HydrophobicContact CD1-CG 4.21Å; L98-L100 HydrophobicContact CD2-CD1 3.9Å; L98-L100 HydrophobicContact CD2-CG 4.28Å; L98-L100 HydrophobicContact CG-CD1 4.06Å; L98-L100 HydrophobicContact CG-CD2 4.41Å; L98-L100 HydrophobicContact CG-CG 3.93Å; L100-N103 VanDerWaalsContact C-ND2 3.29Å; L100-N103 PolarHBondContact O-ND2 3.2Å; L100-L105 HydrophobicContact CB-CD1 4.36Å; L100-L137 HydrophobicContact CD1-CD1 4.15Å; L100-M138 WeakPolarHBondContact CA-O 3.46Å; L100-M138 WeakPolarHBondContact CB-O 3.47Å; L100-M138 PolarHBondContact N-O 3.47Å; L100-L139 HydrophobicContact CB-CD2 3.85Å; L100-L139 HydrophobicContact CD1-CD2 3.78Å; L100-L139 HydrophobicContact CG-CD2 4.47Å; L100-N142 PolarHBondContact O-ND2 3.24Å
101	T	94.1	Very high	88.8	Confident	11 Å²	11	48.4 Å²	48.4	7%	0.067	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	139.8	177.9	-59	0	0	0	0	111.4	S77 F78 N103 D140 E141	S77-T101 CarbonylContact C-O 3.47Å; S77-T101 VanDerWaalsContact CA-O 3.31Å; S77-T101 WeakPolarHBondContact CA-O 3.5Å; F78-T101 HydrophobicContact CE1-CG2 4.21Å; F78-T101 HydrophobicContact CE2-CG2 4.02Å; F78-T101 HydrophobicContact CZ-CG2 3.69Å; F78-T101 PolarHBondContact N-O 3.26Å; T101-N103 VanDerWaalsContact C-N 3.29Å; T101-N103 PolarHBondContact O-N 3.23Å; T101-N103 PolarHBondContact O-ND2 3.34Å; T101-N103 VanDerWaalsContact O-ND2 3.14Å; T101-D140 CarbonylContact C-O 3.58Å; T101-D140 WeakPolarHBondContact CA-O 3.5Å; T101-D140 WeakPolarHBondContact CB-OD2 3.28Å; T101-D140 WeakPolarHBondContact CG2-OD2 3.45Å; T101-D140 PolarHBondContact OG1-OD1 2.94Å; T101-D140 PolarHBondContact OG1-OD2 3.47Å; T101-E141 HydrophobicContact CG2-CB 4.3Å; T101-E141 HydrophobicContact CG2-CG 4.16Å
102	G	92.1	Very high	87.8	Confident	12 Å²	12	43.2 Å²	43.2	12%	0.124	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	15.3	167.1	0	0	0	0	0	116.4	Q104 D140 E141	G102-Q104 VanDerWaalsContact C-N 3.35Å; G102-Q104 PolarHBondContact O-N 3.04Å; G102-D140 PolarHBondContact N-O 3.39Å; G102-E141 VanDerWaalsContact CA-O 3.3Å; G102-E141 WeakPolarHBondContact CA-O 3.41Å
103	N	92.1	Very high	85.8	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.016	23%	0.225	C	C	.	.	S	Bend	trans	-85.9	1.7	-175.9	-85.6	-80.9	0	0	0	115	L76 N79 L80 L81 L100 T101 L105 N142	L76-N103 PolarHBondContact O-ND2 3.21Å; N79-N103 WeakPolarHBondContact CA-OD1 3.18Å; N79-N103 VanDerWaalsContact CB-OD1 3.24Å; N79-N103 WeakPolarHBondContact CB-OD1 3.33Å; N79-N103 PolarHBondContact N-OD1 3.11Å; N79-N103 PolarHBondContact O-OD1 3.45Å; L80-N103 PolarHBondContact N-OD1 3.19Å; L81-N103 WeakPolarHBondContact CD1-OD1 3.35Å; L81-N103 WeakPolarHBondContact CG-OD1 3.35Å; L81-N103 PolarHBondContact N-OD1 3.31Å; L100-N103 VanDerWaalsContact C-ND2 3.29Å; L100-N103 PolarHBondContact O-ND2 3.2Å; T101-N103 VanDerWaalsContact C-N 3.29Å; T101-N103 PolarHBondContact O-N 3.23Å; T101-N103 PolarHBondContact O-ND2 3.34Å; T101-N103 VanDerWaalsContact O-ND2 3.14Å; N103-L105 HydrophobicContact CB-CD1 4.19Å; N103-L105 HydrophobicContact CB-CD2 4.45Å; N103-L105 HydrophobicContact CB-CG 3.86Å; N103-L105 PolarHBondContact O-N 3.12Å; N103-N142 WeakPolarHBondContact CA-OD1 3.44Å; N103-N142 PolarHBondContact N-OD1 2.84Å
104	Q	90.5	Very high	83.6	Confident	102 Å²	102	41.9 Å²	41.9	48%	0.477	22%	0.217	S	C	.	.			trans	61	21.2	-178.9	-44.5	-179.8	33.9	0	0	114.5	G102 K106 N142	G102-Q104 VanDerWaalsContact C-N 3.35Å; G102-Q104 PolarHBondContact O-N 3.04Å; Q104-K106 PolarHBondContact O-N 3.28Å; Q104-N142 PolarHBondContact N-OD1 2.95Å
105	L	90.5	Very high	81.4	Confident	8 Å²	8	39.9 Å²	39.9	4%	0.042	22%	0.222	C	C	.	.			trans	-61.6	128.6	-178.8	-62	172	0	0	0	110.9	L86 L100 N103 L108 L139 N142 R143 L144	L86-L105 HydrophobicContact CD1-CD1 4.04Å; L86-L105 HydrophobicContact CD1-CD2 4.09Å; L100-L105 HydrophobicContact CB-CD1 4.36Å; N103-L105 HydrophobicContact CB-CD1 4.19Å; N103-L105 HydrophobicContact CB-CD2 4.45Å; N103-L105 HydrophobicContact CB-CG 3.86Å; N103-L105 PolarHBondContact O-N 3.12Å; L105-L108 HydrophobicContact CD1-CD2 4.41Å; L105-L139 HydrophobicContact CD1-CD2 4.01Å; L105-N142 HydrophobicContact CB-CB 4.29Å; L105-N142 WeakPolarHBondContact CB-OD1 3.22Å; L105-N142 WeakPolarHBondContact CG-OD1 3.39Å; L105-N142 PolarHBondContact N-OD1 3.1Å; L105-R143 CarbonylContact O-C 3.07Å; L105-R143 VanDerWaalsContact O-CA 3.31Å; L105-R143 WeakPolarHBondContact O-CA 3.22Å; L105-R143 PolarHBondContact O-N 3.19Å; L105-L144 HydrophobicContact CB-CD2 4.08Å; L105-L144 PolarHBondContact O-N 3.35Å
106	K	90.2	Very high	79	Confident	151 Å²	151	48.2 Å²	48.2	66%	0.657	26%	0.26	S	S	*	.	S	Bend	trans	-94.5	-25.2	177.1	-65.9	179.9	-179.8	178.5	0	113.6	Q104 R143	Q104-K106 PolarHBondContact O-N 3.28Å; K106-R143 HydrophobicContact CG-CB 4.2Å
107	S	86.8	Confident	76.3	Confident	65 Å²	65	48.4 Å²	48.4	46%	0.455	27%	0.271	S	S	.	.			trans	-159.1	155.4	-179.7	54.8	0	0	0	0	109.6
108	L	87.3	Confident	73.6	Confident	7 Å²	7	55.2 Å²	55.2	4%	0.037	31%	0.307	C	S	.	.			trans	-95	148	169.3	-60.7	177.7	0	0	0	109.7	L86 L105 F112 L139 L144 V148 S151 L152	L86-L108 HydrophobicContact CD1-CD2 3.8Å; L105-L108 HydrophobicContact CD1-CD2 4.41Å; L108-F112 HydrophobicContact CD1-CD1 4.14Å; L108-F112 HydrophobicContact CD1-CE1 4.32Å; L108-L139 HydrophobicContact CD1-CD1 3.93Å; L108-L139 HydrophobicContact CD2-CD2 4.06Å; L108-L144 HydrophobicContact CG-CD2 4.34Å; L108-V148 HydrophobicContact CD1-CG2 3.57Å; L108-V148 HydrophobicContact CG-CG2 4.02Å; L108-S151 PolarHBondContact O-OG 2.86Å; L108-L152 HydrophobicContact CD1-CD2 3.65Å; L108-L152 HydrophobicContact CD1-CG 4.15Å
109	P	81.1	Confident	70.8	Confident	10 Å²	10	65.4 Å²	65.4	7%	0.065	35%	0.345	C	S	.	.			trans	-67.8	156.4	-178	30.8	-37.2	0	0	0	111.8	A83 L86 L87 N111 F112	A83-P109 WeakPolarHBondContact O-CG 3.42Å; L86-P109 HydrophobicContact CB-CG 4.05Å; L87-P109 HydrophobicContact CD1-CB 4.38Å; L87-P109 HydrophobicContact CD2-CB 3.72Å; L87-P109 HydrophobicContact CD2-CG 3.73Å; L87-P109 HydrophobicContact CG-CB 3.91Å; L87-P109 HydrophobicContact CG-CG 3.9Å; P109-N111 PolarHBondContact O-N 2.85Å; P109-N111 VanDerWaalsContact O-N 3.11Å; P109-F112 HydrophobicContact CG-CD2 3.68Å; P109-F112 HydrophobicContact CG-CE2 3.61Å; P109-F112 PolarHBondContact O-N 3.32Å
110	P	65.1	Low	68.4	Low	88 Å²	88	69.2 Å²	69.2	57%	0.571	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-61.9	-26.5	-168.2	23.5	-34.8	0	0	0	114.2	F112 G113	P110-F112 VanDerWaalsContact C-N 3.27Å; P110-F112 PolarHBondContact O-N 2.86Å; P110-G113 CarbonylContact O-C 3.58Å; P110-G113 VanDerWaalsContact O-C 3.28Å; P110-G113 WeakPolarHBondContact O-CA 3.45Å; P110-G113 PolarHBondContact O-N 2.77Å; P110-G113 VanDerWaalsContact O-O 3.13Å
111	N	62.2	Low	65.7	Low	78 Å²	78	75.7 Å²	75.7	42%	0.417	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-75.2	-9	-175.8	-59.8	-6.7	0	0	0	114.2	L87 P109 G113 P130	L87-N111 HydrophobicContact CD2-CB 3.63Å; P109-N111 PolarHBondContact O-N 2.85Å; P109-N111 VanDerWaalsContact O-N 3.11Å; N111-G113 PolarHBondContact O-N 3.12Å; N111-P130 HydrophobicContact CB-CG 4.31Å; N111-P130 WeakPolarHBondContact O-CG 3.44Å
112	F	66.8	Low	63	Low	1 Å²	1	82.4 Å²	82.4	0%	0.004	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-66	-24.1	163.3	-75.4	-123.5	0	0	0	110.5	L86 L108 P109 P110 F131 S151 L152 N154 L155	L86-F112 HydrophobicContact CB-CE2 3.74Å; L86-F112 HydrophobicContact CB-CZ 3.93Å; L108-F112 HydrophobicContact CD1-CD1 4.14Å; L108-F112 HydrophobicContact CD1-CE1 4.32Å; P109-F112 HydrophobicContact CG-CD2 3.68Å; P109-F112 HydrophobicContact CG-CE2 3.61Å; P109-F112 PolarHBondContact O-N 3.32Å; P110-F112 VanDerWaalsContact C-N 3.27Å; P110-F112 PolarHBondContact O-N 2.86Å; F112-F131 HydrophobicContact CD1-CD2 4.17Å; F112-F131 HydrophobicContact CD1-CE2 4.05Å; F112-F131 HydrophobicContact CD2-CE2 4Å; F112-F131 HydrophobicContact CE1-CD2 4.01Å; F112-F131 AromaticContact CE1-CE2 3.54Å; F112-F131 HydrophobicContact CE1-CE2 3.54Å; F112-F131 HydrophobicContact CE1-CZ 4.02Å; F112-F131 HydrophobicContact CE2-CD2 4.39Å; F112-F131 AromaticContact CE2-CE2 3.48Å; F112-F131 HydrophobicContact CE2-CE2 3.48Å; F112-F131 VanDerWaalsContact CE2-CE2 3.48Å; F112-F131 HydrophobicContact CE2-CZ 4.15Å; F112-F131 HydrophobicContact CG-CD2 4.43Å; F112-F131 HydrophobicContact CG-CE2 4.26Å; F112-F131 HydrophobicContact CZ-CD2 4.13Å; F112-F131 AromaticContact CZ-CE2 3.22Å; F112-F131 HydrophobicContact CZ-CE2 3.22Å; F112-F131 AromaticContact CZ-CZ 3.58Å; F112-F131 HydrophobicContact CZ-CZ 3.58Å; F112-S151 CarbonylContact C-O 3.56Å; F112-S151 WeakPolarHBondContact CA-O 3.28Å; F112-S151 WeakPolarHBondContact CB-O 3.39Å; F112-L152 HydrophobicContact CD1-CD2 4.31Å; F112-N154 WeakPolarHBondContact O-CB 3.4Å; F112-N154 PolarHBondContact O-N 3.35Å; F112-L155 HydrophobicContact CD1-CD1 4.41Å
113	G	47.8	Very low	60.6	Low	2 Å²	2	89.9 Å²	89.9	2%	0.021	48%	0.478	C	S	.	.	S	Bend	trans	-124.4	-161.4	-172.4	0	0	0	0	0	112.9	P110 N111 S115 S151 N154	P110-G113 CarbonylContact O-C 3.58Å; P110-G113 VanDerWaalsContact O-C 3.28Å; P110-G113 WeakPolarHBondContact O-CA 3.45Å; P110-G113 PolarHBondContact O-N 2.77Å; P110-G113 VanDerWaalsContact O-O 3.13Å; N111-G113 PolarHBondContact O-N 3.12Å; G113-S115 PolarHBondContact O-N 3.13Å; G113-S151 WeakPolarHBondContact CA-O 3.28Å; G113-S151 PolarHBondContact N-O 3.49Å; G113-N154 PolarHBondContact O-ND2 2.98Å
114	P	41.3	Very low	58.3	Low	61 Å²	61	95.2 Å²	95.2	40%	0.396	52%	0.516	S	S	.	.			trans	-80.2	119.4	-175.1	0.2	18.8	0	0	0	109.8	H116 Y150 T153	P114-H116 VanDerWaalsContact C-N 3.28Å; P114-H116 PolarHBondContact O-N 3.25Å; P114-Y150 WeakPolarHBondContact CD-O 3.49Å; P114-T153 WeakPolarHBondContact CD-OG1 3.29Å; P114-T153 WeakPolarHBondContact CG-OG1 3.42Å
115	S	46	Very low	55.9	Low	80 Å²	80	98.8 Å²	98.8	56%	0.559	53%	0.532	S	S	*	.			trans	-72.1	80.6	172.3	57.6	0	0	0	0	111	G113 S117	G113-S115 PolarHBondContact O-N 3.13Å; S115-S117 PolarHBondContact O-N 2.85Å
116	H	44.6	Very low	53.7	Low	176 Å²	176	106.9 Å²	106.9	82%	0.815	57%	0.57	S	S	*	*			trans	-75	68	162.7	-74.1	-70.5	0	0	0	110	P114	P114-H116 VanDerWaalsContact C-N 3.28Å; P114-H116 PolarHBondContact O-N 3.25Å
117	S	39.5	Very low	51.8	Low	81 Å²	81	103.5 Å²	103.5	57%	0.566	58%	0.578	S	S	*	*			trans	-117.5	100.2	174.3	54.7	0	0	0	0	109.7	S115 R119	S115-S117 PolarHBondContact O-N 2.85Å; S117-R119 PolarHBondContact O-N 3.5Å
118	D	40.1	Very low	50.3	Low	170 Å²	170	104.5 Å²	104.5	91%	0.909	59%	0.59	S	S	*	*			trans	-70.3	51.3	170.8	-70.3	-49.8	0	0	0	112.1
119	R	38.2	Very low	49.4	Very low	215 Å²	215	110.6 Å²	110.6	81%	0.811	62%	0.616	S	S	*	*			trans	-145.1	92.9	173.5	-74.4	-161.3	172.2	-158	-3.4	111	S117 D121	S117-R119 PolarHBondContact O-N 3.5Å; R119-D121 PolarHBondContact O-N 3.08Å; R119-D121 VanDerWaalsContact O-N 3.09Å
120	P	44.3	Very low	49.3	Very low	133 Å²	133	111.7 Å²	111.7	86%	0.864	62%	0.624	S	S	*	*			trans	-84.4	66.2	171.9	36.2	-33.6	0	0	0	109.6
121	D	40.2	Very low	50.3	Low	136 Å²	136	107.9 Å²	107.9	73%	0.727	60%	0.598	S	S	*	*			trans	-152.7	85.1	176	-135.2	-10.5	0	0	0	112	R119	R119-D121 PolarHBondContact O-N 3.08Å; R119-D121 VanDerWaalsContact O-N 3.09Å
122	M	35.8	Very low	51.3	Low	151 Å²	151	109.9 Å²	109.9	74%	0.744	61%	0.605	S	S	*	*	S	Bend	trans	173.4	96.1	146.3	-91.6	-55.5	99.2	0	0	107.8	S124	M122-S124 PolarHBondContact O-N 3.35Å
123	L	42.7	Very low	52.5	Low	169 Å²	169	110.4 Å²	110.4	89%	0.885	61%	0.609	S	S	*	*			trans	-3.6	99.7	165.2	-58.5	170.3	0	0	0	115.4
124	S	42.8	Very low	54.6	Low	115 Å²	115	110.3 Å²	110.3	80%	0.804	61%	0.608	S	S	*	*			trans	-127.1	110	161.7	-66.8	0	0	0	0	107.6	M122	M122-S124 PolarHBondContact O-N 3.35Å
125	E	41.8	Very low	57.2	Low	177 Å²	177	109.1 Å²	109.1	83%	0.827	60%	0.598	S	S	*	*			trans	-57.3	142.1	178.4	-64.3	-86.8	117.6	0	0	110.9
126	E	43.3	Very low	59.6	Low	179 Å²	179	106.9 Å²	106.9	84%	0.836	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	19.9	99.1	165.5	-56.3	-161.5	159.1	0	0	119.7	A128	E126-A128 PolarHBondContact O-N 3.15Å
127	G	49.6	Very low	62	Low	80 Å²	80	98.5 Å²	98.5	83%	0.825	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn		64	0.4	128.5	0	0	0	0	0	120.4	K129	G127-K129 PolarHBondContact O-N 3.2Å; G127-K129 VanDerWaalsContact O-N 3.11Å
128	A	55.1	Low	64.7	Low	86 Å²	86	96.2 Å²	96.2	71%	0.711	52%	0.522	S	S	*	.			trans	-64.3	111	-177.4	0	0	0	0	0	110.9	E126 P130	E126-A128 PolarHBondContact O-N 3.15Å; A128-P130 VanDerWaalsContact O-CD 3.31Å; A128-P130 WeakPolarHBondContact O-CD 3.46Å
129	K	69.4	Low	67.3	Low	135 Å²	135	88.1 Å²	88.1	59%	0.587	48%	0.479	S	S	*	.			trans	-80.4	112.6	173.2	-60.7	176.9	-145.4	121.2	0	107.9	G127 F131 E132	G127-K129 PolarHBondContact O-N 3.2Å; G127-K129 VanDerWaalsContact O-N 3.11Å; K129-F131 PolarHBondContact O-N 2.99Å; K129-E132 HydrophobicContact CB-CB 4.46Å; K129-E132 IonicContact NZ-OE1 2.73Å; K129-E132 PolarHBondContact NZ-OE1 3.41Å
130	P	79.9	Confident	70	Confident	33 Å²	33	78.9 Å²	78.9	21%	0.214	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	141.8	177.3	27.1	-34.2	0	0	0	110.1	G90 N111 A128 E132	G90-P130 CarbonylContact O-C 3.28Å; G90-P130 VanDerWaalsContact O-CA 3.22Å; G90-P130 WeakPolarHBondContact O-CA 3.27Å; N111-P130 HydrophobicContact CB-CG 4.31Å; N111-P130 WeakPolarHBondContact O-CG 3.44Å; A128-P130 VanDerWaalsContact O-CD 3.31Å; A128-P130 WeakPolarHBondContact O-CD 3.46Å; P130-E132 PolarHBondContact O-N 3.36Å
131	F	85.1	Confident	72.3	Confident	7 Å²	7	75.8 Å²	75.8	3%	0.031	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	34.5	178.1	-58.3	-72.6	0	0	0	115	L86 L89 G90 L95 L98 F112 K129 A133 L134 L155	L86-F131 WeakPolarHBondContact O-CZ 3.31Å; L89-F131 HydrophobicContact CB-CE1 4.22Å; L89-F131 HydrophobicContact CB-CZ 4.03Å; L89-F131 WeakPolarHBondContact O-CE1 3.48Å; G90-F131 PolarHBondContact O-N 2.95Å; L95-F131 HydrophobicContact CD2-CD1 4.4Å; L95-F131 HydrophobicContact CD2-CE1 4.12Å; L98-F131 HydrophobicContact CD2-CE1 3.67Å; L98-F131 HydrophobicContact CD2-CZ 4.11Å; F112-F131 HydrophobicContact CD1-CD2 4.17Å; F112-F131 HydrophobicContact CD1-CE2 4.05Å; F112-F131 HydrophobicContact CD2-CE2 4Å; F112-F131 HydrophobicContact CE1-CD2 4.01Å; F112-F131 AromaticContact CE1-CE2 3.54Å; F112-F131 HydrophobicContact CE1-CE2 3.54Å; F112-F131 HydrophobicContact CE1-CZ 4.02Å; F112-F131 HydrophobicContact CE2-CD2 4.39Å; F112-F131 AromaticContact CE2-CE2 3.48Å; F112-F131 HydrophobicContact CE2-CE2 3.48Å; F112-F131 VanDerWaalsContact CE2-CE2 3.48Å; F112-F131 HydrophobicContact CE2-CZ 4.15Å; F112-F131 HydrophobicContact CG-CD2 4.43Å; F112-F131 HydrophobicContact CG-CE2 4.26Å; F112-F131 HydrophobicContact CZ-CD2 4.13Å; F112-F131 AromaticContact CZ-CE2 3.22Å; F112-F131 HydrophobicContact CZ-CE2 3.22Å; F112-F131 AromaticContact CZ-CZ 3.58Å; F112-F131 HydrophobicContact CZ-CZ 3.58Å; K129-F131 PolarHBondContact O-N 2.99Å; F131-A133 PolarHBondContact O-N 3.36Å; F131-L134 HydrophobicContact CB-CB 3.83Å; F131-L134 HydrophobicContact CB-CD2 4.07Å; F131-L134 HydrophobicContact CD1-CB 4.37Å; F131-L134 HydrophobicContact CD1-CD1 4.33Å; F131-L134 HydrophobicContact CD1-CD2 3.88Å; F131-L134 HydrophobicContact CD1-CG 4.44Å; F131-L134 HydrophobicContact CG-CD2 4.08Å; F131-L134 PolarHBondContact O-N 2.76Å; F131-L134 VanDerWaalsContact O-N 3.12Å; F131-L155 HydrophobicContact CB-CD2 3.46Å; F131-L155 VanDerWaalsContact CB-CD2 3.46Å; F131-L155 HydrophobicContact CD2-CD2 4.32Å; F131-L155 HydrophobicContact CG-CD2 4.19Å
132	E	84.1	Confident	74.9	Confident	120 Å²	120	69.9 Å²	69.9	56%	0.561	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-26.6	-179.5	-175.6	163	-129.3	0	0	114.1	K129 P130 R157	K129-E132 HydrophobicContact CB-CB 4.46Å; K129-E132 IonicContact NZ-OE1 2.73Å; K129-E132 PolarHBondContact NZ-OE1 3.41Å; P130-E132 PolarHBondContact O-N 3.36Å; E132-R157 VanDerWaalsContact O-CD 3.3Å; E132-R157 WeakPolarHBondContact O-CD 3.18Å
133	A	90.1	Very high	77.6	Confident	12 Å²	12	68.5 Å²	68.5	10%	0.099	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-2.9	-179.4	0	0	0	0	0	115.2	L95 F131 E135	L95-A133 CarbonylContact O-C 3.18Å; L95-A133 VanDerWaalsContact O-C 3.27Å; F131-A133 PolarHBondContact O-N 3.36Å; A133-E135 WeakPolarHBondContact O-CG 3.41Å; A133-E135 PolarHBondContact O-N 2.8Å
134	L	93.6	Very high	80	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.333	C	S	.	.			trans	-71.6	128.2	-167.4	-168	74.8	0	0	0	112.3	L95 K96 L98 F131 L137 L155 R157 L158	L95-L134 HydrophobicContact CG-CD1 4.42Å; L95-L134 WeakPolarHBondContact O-CA 3.11Å; L95-L134 PolarHBondContact O-N 2.82Å; K96-L134 WeakPolarHBondContact O-CD1 3.11Å; L98-L134 HydrophobicContact CB-CD1 3.85Å; F131-L134 HydrophobicContact CB-CB 3.83Å; F131-L134 HydrophobicContact CB-CD2 4.07Å; F131-L134 HydrophobicContact CD1-CB 4.37Å; F131-L134 HydrophobicContact CD1-CD1 4.33Å; F131-L134 HydrophobicContact CD1-CD2 3.88Å; F131-L134 HydrophobicContact CD1-CG 4.44Å; F131-L134 HydrophobicContact CG-CD2 4.08Å; F131-L134 PolarHBondContact O-N 2.76Å; F131-L134 VanDerWaalsContact O-N 3.12Å; L134-L137 HydrophobicContact CD2-CB 4.2Å; L134-L137 HydrophobicContact CD2-CD1 4.39Å; L134-L137 HydrophobicContact CD2-CD2 4.27Å; L134-L155 HydrophobicContact CD2-CD1 4.28Å; L134-L155 HydrophobicContact CD2-CD2 4.33Å; L134-R157 CarbonylContact O-C 3.46Å; L134-R157 WeakPolarHBondContact O-CB 3.45Å; L134-L158 PolarHBondContact O-N 3.47Å
135	E	94.8	Very high	82.3	Confident	37 Å²	37	58 Å²	58	17%	0.173	31%	0.313	C	S	.	.			trans	-119.9	-27.2	-177.5	-49.7	-159.2	149.7	0	0	113	K96 A133 R157 K159 H160	K96-E135 PolarHBondContact O-N 3.2Å; A133-E135 WeakPolarHBondContact O-CG 3.41Å; A133-E135 PolarHBondContact O-N 2.8Å; E135-R157 IonicContact OE1-CZ 3.94Å; E135-R157 IonicContact OE1-NE 2.91Å; E135-R157 IonicContact OE1-NH2 2.99Å; E135-R157 PolarHBondContact OE1-NH2 3.32Å; E135-K159 HydrophobicContact CB-CD 4.31Å; E135-K159 PolarHBondContact O-N 3.25Å; E135-K159 IonicContact OE1-NZ 2.7Å; E135-K159 PolarHBondContact OE1-NZ 2.92Å; E135-K159 VanDerWaalsContact OE1-NZ 3.07Å; E135-K159 WeakPolarHBondContact OE2-CE 3.42Å; E135-K159 IonicContact OE2-NZ 3.92Å; E135-K159 PolarHBondContact OE2-NZ 3.34Å; E135-H160 PolarHBondContact O-N 2.93Å
136	V	96.2	Very high	84.6	Confident	32 Å²	32	50.2 Å²	50.2	19%	0.194	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	124	-178.5	-178.3	0	0	0	0	109.7	K96 T97 L98 M138 H160	K96-V136 PolarHBondContact O-N 3.16Å; T97-V136 WeakPolarHBondContact CA-O 3.45Å; T97-V136 HydrophobicContact CG2-CB 4.01Å; T97-V136 HydrophobicContact CG2-CG1 4.01Å; L98-V136 PolarHBondContact N-O 3.46Å; V136-M138 HydrophobicContact CG1-CE 3.71Å; V136-M138 HydrophobicContact CG1-CG 4.4Å; V136-M138 HydrophobicContact CG1-SD 4.37Å; V136-H160 WeakPolarHBondContact CA-O 3.45Å; V136-H160 HydrophobicContact CG1-CB 4.34Å; V136-H160 HydrophobicContact CG2-CB 4.27Å
137	L	95.8	Very high	86.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	110.9	178.4	-178.9	56.9	0	0	0	110.7	L98 L100 L134 L139 L152 L155 L158 H160 L161 N162	L98-L137 HydrophobicContact CB-CD1 4.2Å; L98-L137 HydrophobicContact CD2-CD1 4.22Å; L98-L137 HydrophobicContact CG-CD1 4.22Å; L100-L137 HydrophobicContact CD1-CD1 4.15Å; L134-L137 HydrophobicContact CD2-CB 4.2Å; L134-L137 HydrophobicContact CD2-CD1 4.39Å; L134-L137 HydrophobicContact CD2-CD2 4.27Å; L137-L139 HydrophobicContact CD1-CD1 4.31Å; L137-L139 HydrophobicContact CD1-CG 4.14Å; L137-L139 HydrophobicContact CD2-CD1 3.74Å; L137-L139 HydrophobicContact CD2-CG 4.44Å; L137-L139 HydrophobicContact CG-CD1 3.8Å; L137-L139 HydrophobicContact CG-CG 3.98Å; L137-L152 HydrophobicContact CD2-CD2 3.61Å; L137-L155 HydrophobicContact CD2-CD1 3.95Å; L137-L158 HydrophobicContact CB-CD1 3.63Å; L137-H160 PolarHBondContact N-O 3.23Å; L137-L161 HydrophobicContact CB-CD1 4.36Å; L137-L161 HydrophobicContact CD2-CD1 4.32Å; L137-L161 HydrophobicContact CG-CD1 4.35Å; L137-N162 PolarHBondContact O-N 3.09Å
138	M	96.4	Very high	88.5	Confident	33 Å²	33	40.4 Å²	40.4	16%	0.163	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	116.6	177.5	-50.7	-71.7	86.3	0	0	109.3	L98 H99 L100 V136 D140 N162	L98-M138 PolarHBondContact O-N 3.23Å; H99-M138 HydrophobicContact CB-CB 4.41Å; H99-M138 WeakPolarHBondContact ND1-CG 2.98Å; L100-M138 WeakPolarHBondContact CA-O 3.46Å; L100-M138 WeakPolarHBondContact CB-O 3.47Å; L100-M138 PolarHBondContact N-O 3.47Å; V136-M138 HydrophobicContact CG1-CE 3.71Å; V136-M138 HydrophobicContact CG1-CG 4.4Å; V136-M138 HydrophobicContact CG1-SD 4.37Å; M138-D140 WeakPolarHBondContact CB-OD1 3.37Å; M138-N162 HydrophobicContact CB-CB 4.5Å; M138-N162 HydrophobicContact CE-CB 3.56Å; M138-N162 HydrophobicContact SD-CB 3.71Å
139	L	95.1	Very high	90	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.			trans	-126.2	19.3	-176.7	-77.6	166.1	0	0	0	111.9	L100 L105 L108 L137 N142 L144 L161 N162 L163 N166	L100-L139 HydrophobicContact CB-CD2 3.85Å; L100-L139 HydrophobicContact CD1-CD2 3.78Å; L100-L139 HydrophobicContact CG-CD2 4.47Å; L105-L139 HydrophobicContact CD1-CD2 4.01Å; L108-L139 HydrophobicContact CD1-CD1 3.93Å; L108-L139 HydrophobicContact CD2-CD2 4.06Å; L137-L139 HydrophobicContact CD1-CD1 4.31Å; L137-L139 HydrophobicContact CD1-CG 4.14Å; L137-L139 HydrophobicContact CD2-CD1 3.74Å; L137-L139 HydrophobicContact CD2-CG 4.44Å; L137-L139 HydrophobicContact CG-CD1 3.8Å; L137-L139 HydrophobicContact CG-CG 3.98Å; L139-N142 WeakPolarHBondContact O-CB 3.32Å; L139-N142 PolarHBondContact O-ND2 3.19Å; L139-L144 HydrophobicContact CB-CD1 3.86Å; L139-L144 HydrophobicContact CD1-CD1 4.2Å; L139-L144 HydrophobicContact CD2-CD1 4.13Å; L139-L144 HydrophobicContact CG-CD1 4.31Å; L139-L161 HydrophobicContact CD1-CD1 4.37Å; L139-N162 CarbonylContact C-O 3.29Å; L139-N162 WeakPolarHBondContact CA-O 3.28Å; L139-N162 WeakPolarHBondContact CB-O 3.44Å; L139-N162 PolarHBondContact N-O 3.42Å; L139-L163 HydrophobicContact CB-CD2 3.77Å; L139-L163 HydrophobicContact CD1-CD2 4.02Å; L139-N166 PolarHBondContact O-ND2 2.87Å
140	D	93.7	Very high	90.7	Very high	22 Å²	22	34.8 Å²	34.8	12%	0.118	17%	0.174	C	C	.	.			trans	-62.9	157.4	179.1	38.2	-73.6	0	0	0	113.9	T101 G102 M138 N142 N162 E164	T101-D140 CarbonylContact C-O 3.58Å; T101-D140 WeakPolarHBondContact CA-O 3.5Å; T101-D140 WeakPolarHBondContact CB-OD2 3.28Å; T101-D140 WeakPolarHBondContact CG2-OD2 3.45Å; T101-D140 PolarHBondContact OG1-OD1 2.94Å; T101-D140 PolarHBondContact OG1-OD2 3.47Å; G102-D140 PolarHBondContact N-O 3.39Å; M138-D140 WeakPolarHBondContact CB-OD1 3.37Å; D140-N142 VanDerWaalsContact C-N 3.28Å; D140-N142 PolarHBondContact O-N 3.09Å; D140-N142 PolarHBondContact O-ND2 3.45Å; D140-N162 WeakPolarHBondContact CB-ND2 3.31Å; D140-N162 VanDerWaalsContact OD1-CG 3.32Å; D140-N162 PolarHBondContact OD1-ND2 3.34Å; D140-E164 CarbonylContact C-O 3.57Å; D140-E164 WeakPolarHBondContact CA-O 3.49Å; D140-E164 HydrophobicContact CB-CB 4.16Å
141	E	93.9	Very high	90.8	Very high	68 Å²	68	34 Å²	34	32%	0.318	17%	0.169	S	C	.	.	S	Bend	trans	55.6	37	-178.7	-45.3	-158.7	172	0	0	114.7	F78 T101 G102 E164 D165 R357	F78-E141 WeakPolarHBondContact CE1-OE2 3.32Å; T101-E141 HydrophobicContact CG2-CB 4.3Å; T101-E141 HydrophobicContact CG2-CG 4.16Å; G102-E141 VanDerWaalsContact CA-O 3.3Å; G102-E141 WeakPolarHBondContact CA-O 3.41Å; E141-E164 PolarHBondContact N-O 3.01Å; E141-E164 VanDerWaalsContact N-O 3.08Å; E141-D165 WeakPolarHBondContact CA-O 3.44Å; E141-D165 HydrophobicContact CG-CB 4.23Å; E141-D165 PolarHBondContact N-O 3.33Å; E141-R357 VanDerWaalsContact CD-NH2 3.25Å; E141-R357 IonicContact OE1-CZ 3.32Å; E141-R357 VanDerWaalsContact OE1-CZ 3.26Å; E141-R357 IonicContact OE1-NH1 3.22Å; E141-R357 PolarHBondContact OE1-NH1 3.17Å; E141-R357 IonicContact OE1-NH2 3.61Å; E141-R357 PolarHBondContact OE1-NH2 3.14Å; E141-R357 IonicContact OE2-NH2 3.57Å
142	N	93.3	Very high	90.9	Very high	11 Å²	11	33.7 Å²	33.7	6%	0.059	17%	0.168	C	C	.	.	S	Bend	trans	-107.4	-160.1	175.9	-79.5	-75.5	0	0	0	110.6	L100 N103 Q104 L105 L139 D140 L144 D165 N166	L100-N142 PolarHBondContact O-ND2 3.24Å; N103-N142 WeakPolarHBondContact CA-OD1 3.44Å; N103-N142 PolarHBondContact N-OD1 2.84Å; Q104-N142 PolarHBondContact N-OD1 2.95Å; L105-N142 HydrophobicContact CB-CB 4.29Å; L105-N142 WeakPolarHBondContact CB-OD1 3.22Å; L105-N142 WeakPolarHBondContact CG-OD1 3.39Å; L105-N142 PolarHBondContact N-OD1 3.1Å; L139-N142 WeakPolarHBondContact O-CB 3.32Å; L139-N142 PolarHBondContact O-ND2 3.19Å; D140-N142 VanDerWaalsContact C-N 3.28Å; D140-N142 PolarHBondContact O-N 3.09Å; D140-N142 PolarHBondContact O-ND2 3.45Å; N142-L144 HydrophobicContact CB-CD1 4.11Å; N142-L144 HydrophobicContact CB-CG 4.03Å; N142-D165 PolarHBondContact N-O 2.93Å; N142-N166 WeakPolarHBondContact CA-OD1 3.19Å; N142-N166 WeakPolarHBondContact CB-OD1 3.35Å
143	R	93.3	Very high	90.6	Very high	123 Å²	123	29.1 Å²	29.1	46%	0.464	15%	0.148	S	C	.	.			trans	-130.3	31.6	178.7	-56.6	-173.9	-170.8	-150.7	7	110.6	L105 K106 N166	L105-R143 CarbonylContact O-C 3.07Å; L105-R143 VanDerWaalsContact O-CA 3.31Å; L105-R143 WeakPolarHBondContact O-CA 3.22Å; L105-R143 PolarHBondContact O-N 3.19Å; K106-R143 HydrophobicContact CG-CB 4.2Å; R143-N166 PolarHBondContact N-OD1 3.42Å
144	L	93	Very high	89.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.			trans	-72.1	143.2	-176.4	-58.8	164.2	0	0	0	109.4	L105 L108 L139 N142 V148 L163 N166 C167	L105-L144 HydrophobicContact CB-CD2 4.08Å; L105-L144 PolarHBondContact O-N 3.35Å; L108-L144 HydrophobicContact CG-CD2 4.34Å; L139-L144 HydrophobicContact CB-CD1 3.86Å; L139-L144 HydrophobicContact CD1-CD1 4.2Å; L139-L144 HydrophobicContact CD2-CD1 4.13Å; L139-L144 HydrophobicContact CG-CD1 4.31Å; N142-L144 HydrophobicContact CB-CD1 4.11Å; N142-L144 HydrophobicContact CB-CG 4.03Å; L144-V148 HydrophobicContact CB-CB 4.33Å; L144-V148 HydrophobicContact CB-CG2 4.46Å; L144-V148 HydrophobicContact CD1-CG2 4.12Å; L144-V148 HydrophobicContact CD2-CG2 4.33Å; L144-L163 HydrophobicContact CD1-CD2 3.86Å; L144-N166 HydrophobicContact CB-CB 4.41Å; L144-N166 VanDerWaalsContact CB-OD1 3.23Å; L144-N166 WeakPolarHBondContact CB-OD1 3.27Å; L144-N166 WeakPolarHBondContact CG-OD1 3.36Å; L144-N166 PolarHBondContact N-OD1 3.09Å; L144-C167 CarbonylContact O-C 3.59Å; L144-C167 VanDerWaalsContact O-C 3.3Å; L144-C167 WeakPolarHBondContact O-CA 3.48Å; L144-C167 PolarHBondContact O-N 2.88Å
145	T	92	Very high	89.6	Confident	64 Å²	64	32.2 Å²	32.2	39%	0.393	16%	0.163	S	C	.	.	B	Isolated β-bridge	trans	-106.2	173.7	172.2	61.8	0	0	0	0	110.3	S147 V148 C167	T145-S147 PolarHBondContact O-N 3.1Å; T145-S147 PolarHBondContact OG1-OG 3.02Å; T145-V148 WeakPolarHBondContact O-CB 3.2Å; T145-V148 VanDerWaalsContact O-CG1 3.31Å; T145-V148 WeakPolarHBondContact O-CG1 3.45Å; T145-V148 PolarHBondContact O-N 3.22Å; T145-C167 WeakPolarHBondContact CA-O 3.42Å; T145-C167 HydrophobicContact CG2-CB 4.2Å
146	S	89	Confident	89.1	Confident	12 Å²	12	37 Å²	37	8%	0.084	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-17.2	178.8	-45.4	0	0	0	0	114.8	V148 T169 E170	S146-V148 PolarHBondContact O-N 2.96Å; S146-T169 PolarHBondContact OG-N 2.88Å; S146-T169 PolarHBondContact OG-OG1 2.97Å; S146-E170 VanDerWaalsContact CB-O 3.24Å; S146-E170 WeakPolarHBondContact CB-O 3.07Å; S146-E170 PolarHBondContact OG-N 3Å; S146-E170 PolarHBondContact OG-O 2.87Å
147	S	86.3	Confident	88.8	Confident	52 Å²	52	40.9 Å²	40.9	36%	0.364	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22	172.9	64.7	0	0	0	0	113.9	T145 F149 Y150 S151	T145-S147 PolarHBondContact O-N 3.1Å; T145-S147 PolarHBondContact OG1-OG 3.02Å; S147-F149 PolarHBondContact O-N 2.78Å; S147-F149 VanDerWaalsContact O-N 3.12Å; S147-Y150 WeakPolarHBondContact O-CB 3.47Å; S147-Y150 PolarHBondContact O-N 3.15Å; S147-S151 PolarHBondContact O-N 3Å
148	V	88.8	Confident	88.6	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-52.3	-35.5	178.5	70.4	0	0	0	0	112.4	L108 L144 T145 S146 Y150 S151 L152 L163 I168	L108-V148 HydrophobicContact CD1-CG2 3.57Å; L108-V148 HydrophobicContact CG-CG2 4.02Å; L144-V148 HydrophobicContact CB-CB 4.33Å; L144-V148 HydrophobicContact CB-CG2 4.46Å; L144-V148 HydrophobicContact CD1-CG2 4.12Å; L144-V148 HydrophobicContact CD2-CG2 4.33Å; T145-V148 WeakPolarHBondContact O-CB 3.2Å; T145-V148 VanDerWaalsContact O-CG1 3.31Å; T145-V148 WeakPolarHBondContact O-CG1 3.45Å; T145-V148 PolarHBondContact O-N 3.22Å; S146-V148 PolarHBondContact O-N 2.96Å; V148-Y150 VanDerWaalsContact C-N 3.33Å; V148-Y150 PolarHBondContact O-N 3Å; V148-S151 CarbonylContact O-C 3.3Å; V148-S151 WeakPolarHBondContact O-CA 3.47Å; V148-S151 VanDerWaalsContact O-CB 3.32Å; V148-S151 WeakPolarHBondContact O-CB 3.39Å; V148-S151 PolarHBondContact O-N 3.12Å; V148-L152 HydrophobicContact CG2-CD1 4.04Å; V148-L152 HydrophobicContact CG2-CG 4.33Å; V148-L152 WeakPolarHBondContact O-CG 3.36Å; V148-L152 PolarHBondContact O-N 2.48Å; V148-L163 HydrophobicContact CG1-CD1 4.22Å; V148-L163 HydrophobicContact CG1-CD2 4.34Å; V148-L163 HydrophobicContact CG2-CD2 4.31Å; V148-I168 HydrophobicContact CG1-CD1 4.19Å
149	F	86.9	Confident	88.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.2	-33.8	-179.6	-72	-76.5	0	0	0	113	S147 S151 L152 L163 I168 I171 P172 V248 L256 L258	S147-F149 PolarHBondContact O-N 2.78Å; S147-F149 VanDerWaalsContact O-N 3.12Å; F149-S151 VanDerWaalsContact C-N 3.32Å; F149-L152 PolarHBondContact O-N 2.89Å; F149-L152 VanDerWaalsContact O-N 3.12Å; F149-L163 HydrophobicContact CE1-CD1 4.19Å; F149-L163 HydrophobicContact CZ-CD1 4.06Å; F149-I168 HydrophobicContact CE2-CD1 4.37Å; F149-I168 HydrophobicContact CE2-CG2 3.97Å; F149-I171 HydrophobicContact CE1-CG2 4.38Å; F149-I171 HydrophobicContact CE2-CB 4.44Å; F149-I171 HydrophobicContact CE2-CG1 4.14Å; F149-I171 HydrophobicContact CZ-CB 4.46Å; F149-I171 HydrophobicContact CZ-CG1 3.88Å; F149-I171 HydrophobicContact CZ-CG2 4.35Å; F149-P172 HydrophobicContact CB-CG 3.68Å; F149-P172 HydrophobicContact CD2-CG 4.24Å; F149-P172 HydrophobicContact CG-CG 4.31Å; F149-V248 HydrophobicContact CB-CB 4.37Å; F149-V248 HydrophobicContact CB-CG1 4.01Å; F149-V248 HydrophobicContact CB-CG2 3.82Å; F149-V248 HydrophobicContact CD1-CG1 4.39Å; F149-V248 VanDerWaalsContact O-CG1 3.24Å; F149-V248 WeakPolarHBondContact O-CG1 3.05Å; F149-V248 WeakPolarHBondContact O-CG2 3.35Å; F149-L256 HydrophobicContact CE1-CD1 4.43Å; F149-L256 HydrophobicContact CE1-CD2 4.4Å; F149-L258 HydrophobicContact CZ-CD1 4.39Å; F149-L258 HydrophobicContact CZ-CD2 3.98Å
150	Y	82.9	Confident	88.5	Confident	104 Å²	104	45 Å²	45	41%	0.408	21%	0.212	S	C	.	.	H	α-helix	trans	-68.3	-34.6	170.9	-60.2	-69.3	0	0	0	111.7	P114 S147 V148 L152 T153 P172 V248	P114-Y150 WeakPolarHBondContact CD-O 3.49Å; S147-Y150 WeakPolarHBondContact O-CB 3.47Å; S147-Y150 PolarHBondContact O-N 3.15Å; V148-Y150 VanDerWaalsContact C-N 3.33Å; V148-Y150 PolarHBondContact O-N 3Å; Y150-L152 VanDerWaalsContact C-N 3.26Å; Y150-L152 PolarHBondContact O-N 3.37Å; Y150-T153 WeakPolarHBondContact O-CG2 3.49Å; Y150-P172 HydrophobicContact CD2-CG 4.44Å; Y150-P172 HydrophobicContact CE1-CB 4.39Å; Y150-P172 HydrophobicContact CE1-CG 4.5Å; Y150-P172 HydrophobicContact CE2-CB 3.88Å; Y150-P172 HydrophobicContact CE2-CG 3.96Å; Y150-P172 WeakPolarHBondContact OH-CB 3.27Å; Y150-V248 HydrophobicContact CD1-CG2 4.23Å
151	S	83.6	Confident	88.6	Confident	17 Å²	17	44.1 Å²	44.1	12%	0.119	21%	0.207	C	C	.	.	H	α-helix	trans	-67	-24.5	170.1	-57.3	0	0	0	0	111.9	L108 F112 G113 S147 V148 F149	L108-S151 PolarHBondContact O-OG 2.86Å; F112-S151 CarbonylContact C-O 3.56Å; F112-S151 WeakPolarHBondContact CA-O 3.28Å; F112-S151 WeakPolarHBondContact CB-O 3.39Å; G113-S151 WeakPolarHBondContact CA-O 3.28Å; G113-S151 PolarHBondContact N-O 3.49Å; S147-S151 PolarHBondContact O-N 3Å; V148-S151 CarbonylContact O-C 3.3Å; V148-S151 WeakPolarHBondContact O-CA 3.47Å; V148-S151 VanDerWaalsContact O-CB 3.32Å; V148-S151 WeakPolarHBondContact O-CB 3.39Å; V148-S151 PolarHBondContact O-N 3.12Å; F149-S151 VanDerWaalsContact C-N 3.32Å
152	L	86.4	Confident	88.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.8	-174.2	-66	168.2	0	0	0	115	L108 F112 L137 V148 F149 Y150 N154 L155 L161 L250	L108-L152 HydrophobicContact CD1-CD2 3.65Å; L108-L152 HydrophobicContact CD1-CG 4.15Å; F112-L152 HydrophobicContact CD1-CD2 4.31Å; L137-L152 HydrophobicContact CD2-CD2 3.61Å; V148-L152 HydrophobicContact CG2-CD1 4.04Å; V148-L152 HydrophobicContact CG2-CG 4.33Å; V148-L152 WeakPolarHBondContact O-CG 3.36Å; V148-L152 PolarHBondContact O-N 2.48Å; F149-L152 PolarHBondContact O-N 2.89Å; F149-L152 VanDerWaalsContact O-N 3.12Å; Y150-L152 VanDerWaalsContact C-N 3.26Å; Y150-L152 PolarHBondContact O-N 3.37Å; L152-N154 VanDerWaalsContact C-N 3.3Å; L152-N154 PolarHBondContact O-N 2.72Å; L152-N154 VanDerWaalsContact O-N 3.1Å; L152-L155 HydrophobicContact CB-CD1 4.37Å; L152-L155 HydrophobicContact CD2-CD1 3.48Å; L152-L155 VanDerWaalsContact CD2-CD1 3.48Å; L152-L155 WeakPolarHBondContact O-CB 3.22Å; L152-L155 WeakPolarHBondContact O-CG 3.31Å; L152-L155 PolarHBondContact O-N 3.18Å; L152-L155 VanDerWaalsContact O-N 3.15Å; L152-L161 HydrophobicContact CD1-CD1 4.04Å; L152-L161 HydrophobicContact CD1-CD2 3.64Å; L152-L250 HydrophobicContact CB-CD2 4.48Å; L152-L250 VanDerWaalsContact O-CD2 3.29Å; L152-L250 WeakPolarHBondContact O-CD2 3.45Å
153	T	78.3	Confident	88.7	Confident	23 Å²	23	41.4 Å²	41.4	14%	0.141	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23	-164.8	66	0	0	0	0	116.4	P114 Y150 L155 V248	P114-T153 WeakPolarHBondContact CD-OG1 3.29Å; P114-T153 WeakPolarHBondContact CG-OG1 3.42Å; Y150-T153 WeakPolarHBondContact O-CG2 3.49Å; T153-L155 VanDerWaalsContact C-N 3.34Å; T153-V248 HydrophobicContact CG2-CB 4.4Å; T153-V248 HydrophobicContact CG2-CG1 4.2Å; T153-V248 HydrophobicContact CG2-CG2 4.19Å
154	N	75.8	Confident	88.7	Confident	76 Å²	76	38.3 Å²	38.3	41%	0.406	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.3	-178.6	-67.6	-16.5	0	0	0	113.3	F112 G113 L152 K156	F112-N154 WeakPolarHBondContact O-CB 3.4Å; F112-N154 PolarHBondContact O-N 3.35Å; G113-N154 PolarHBondContact O-ND2 2.98Å; L152-N154 VanDerWaalsContact C-N 3.3Å; L152-N154 PolarHBondContact O-N 2.72Å; L152-N154 VanDerWaalsContact O-N 3.1Å; N154-K156 PolarHBondContact O-N 3.2Å
155	L	86.1	Confident	88.6	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	19%	0.192	C	C	.	.			trans	-77.9	67.3	-177.5	-57.1	-177.9	0	0	0	112.2	F112 F131 L134 L137 L152 T153 R157 L158 L250	F112-L155 HydrophobicContact CD1-CD1 4.41Å; F131-L155 HydrophobicContact CB-CD2 3.46Å; F131-L155 VanDerWaalsContact CB-CD2 3.46Å; F131-L155 HydrophobicContact CD2-CD2 4.32Å; F131-L155 HydrophobicContact CG-CD2 4.19Å; L134-L155 HydrophobicContact CD2-CD1 4.28Å; L134-L155 HydrophobicContact CD2-CD2 4.33Å; L137-L155 HydrophobicContact CD2-CD1 3.95Å; L152-L155 HydrophobicContact CB-CD1 4.37Å; L152-L155 HydrophobicContact CD2-CD1 3.48Å; L152-L155 VanDerWaalsContact CD2-CD1 3.48Å; L152-L155 WeakPolarHBondContact O-CB 3.22Å; L152-L155 WeakPolarHBondContact O-CG 3.31Å; L152-L155 PolarHBondContact O-N 3.18Å; L152-L155 VanDerWaalsContact O-N 3.15Å; T153-L155 VanDerWaalsContact C-N 3.34Å; L155-R157 PolarHBondContact O-N 3.41Å; L155-R157 VanDerWaalsContact O-N 3.08Å; L155-L158 HydrophobicContact CB-CB 3.94Å; L155-L158 HydrophobicContact CB-CD2 4.37Å; L155-L158 HydrophobicContact CD1-CD2 4.04Å; L155-L158 WeakPolarHBondContact O-CB 3.4Å; L155-L158 PolarHBondContact O-N 2.84Å; L155-L158 VanDerWaalsContact O-N 3.15Å; L155-L250 HydrophobicContact CB-CD2 4.2Å
156	K	83.9	Confident	88.7	Confident	137 Å²	137	36.9 Å²	36.9	60%	0.596	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.8	-172.4	-64.5	-178	-174.1	-175.6	0	114.9	N154 P251 E252	N154-K156 PolarHBondContact O-N 3.2Å; K156-P251 HydrophobicContact CB-CG 4.42Å; K156-E252 VanDerWaalsContact O-CG 3.24Å; K156-E252 WeakPolarHBondContact O-CG 3.31Å
157	R	90.2	Very high	88.9	Confident	113 Å²	113	38.6 Å²	38.6	43%	0.426	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	0.1	-179.2	-71.2	-175.4	63.7	-176	-5	114.2	E132 L134 E135 L155 K159	E132-R157 VanDerWaalsContact O-CD 3.3Å; E132-R157 WeakPolarHBondContact O-CD 3.18Å; L134-R157 CarbonylContact O-C 3.46Å; L134-R157 WeakPolarHBondContact O-CB 3.45Å; E135-R157 IonicContact OE1-CZ 3.94Å; E135-R157 IonicContact OE1-NE 2.91Å; E135-R157 IonicContact OE1-NH2 2.99Å; E135-R157 PolarHBondContact OE1-NH2 3.32Å; L155-R157 PolarHBondContact O-N 3.41Å; L155-R157 VanDerWaalsContact O-N 3.08Å; R157-K159 PolarHBondContact O-N 3.2Å
158	L	92.4	Very high	89.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.17	C	C	.	.			trans	-65.2	120.9	-177.9	-171.7	69.1	0	0	0	110.5	L134 L137 L155 L161 L250 E252 L253	L134-L158 PolarHBondContact O-N 3.47Å; L137-L158 HydrophobicContact CB-CD1 3.63Å; L155-L158 HydrophobicContact CB-CB 3.94Å; L155-L158 HydrophobicContact CB-CD2 4.37Å; L155-L158 HydrophobicContact CD1-CD2 4.04Å; L155-L158 WeakPolarHBondContact O-CB 3.4Å; L155-L158 PolarHBondContact O-N 2.84Å; L155-L158 VanDerWaalsContact O-N 3.15Å; L158-L161 HydrophobicContact CD2-CB 4.1Å; L158-L161 HydrophobicContact CD2-CD1 4.34Å; L158-L161 HydrophobicContact CD2-CD2 4.2Å; L158-L161 HydrophobicContact CD2-CG 4.45Å; L158-L250 HydrophobicContact CD2-CD1 4.5Å; L158-L250 HydrophobicContact CD2-CD2 4.26Å; L158-E252 CarbonylContact O-C 3.28Å; L158-L253 HydrophobicContact CD2-CD1 4.4Å; L158-L253 HydrophobicContact CG-CD1 4.32Å; L158-L253 WeakPolarHBondContact O-CA 3.42Å; L158-L253 PolarHBondContact O-N 3.37Å
159	K	92.9	Very high	89.2	Confident	55 Å²	55	39.1 Å²	39.1	24%	0.239	19%	0.188	C	C	.	.			trans	-105	-37.8	179.5	-61.7	172	-169.1	164.1	0	111.8	E135 R157 E252 Q254 C255	E135-K159 HydrophobicContact CB-CD 4.31Å; E135-K159 PolarHBondContact O-N 3.25Å; E135-K159 IonicContact OE1-NZ 2.7Å; E135-K159 PolarHBondContact OE1-NZ 2.92Å; E135-K159 VanDerWaalsContact OE1-NZ 3.07Å; E135-K159 WeakPolarHBondContact OE2-CE 3.42Å; E135-K159 IonicContact OE2-NZ 3.92Å; E135-K159 PolarHBondContact OE2-NZ 3.34Å; R157-K159 PolarHBondContact O-N 3.2Å; K159-E252 WeakPolarHBondContact CA-O 3.48Å; K159-Q254 PolarHBondContact O-N 3.49Å; K159-C255 PolarHBondContact O-N 2.88Å
160	H	95.4	Very high	89.1	Confident	66 Å²	66	43.7 Å²	43.7	31%	0.306	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.6	-175.5	-54.3	-80.1	0	0	0	110.3	E135 V136 L137 C255	E135-H160 PolarHBondContact O-N 2.93Å; V136-H160 WeakPolarHBondContact CA-O 3.45Å; V136-H160 HydrophobicContact CG1-CB 4.34Å; V136-H160 HydrophobicContact CG2-CB 4.27Å; L137-H160 PolarHBondContact N-O 3.23Å; H160-C255 WeakPolarHBondContact ND1-CB 3.25Å; H160-C255 PolarHBondContact ND1-SG 3.24Å
161	L	95.8	Very high	89.2	Confident	3 Å²	3	39 Å²	39	2%	0.016	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.5	178.8	177.8	55	0	0	0	109.3	L137 L139 L152 L158 L163 L250 L253 C255 L256 N257	L137-L161 HydrophobicContact CB-CD1 4.36Å; L137-L161 HydrophobicContact CD2-CD1 4.32Å; L137-L161 HydrophobicContact CG-CD1 4.35Å; L139-L161 HydrophobicContact CD1-CD1 4.37Å; L152-L161 HydrophobicContact CD1-CD1 4.04Å; L152-L161 HydrophobicContact CD1-CD2 3.64Å; L158-L161 HydrophobicContact CD2-CB 4.1Å; L158-L161 HydrophobicContact CD2-CD1 4.34Å; L158-L161 HydrophobicContact CD2-CD2 4.2Å; L158-L161 HydrophobicContact CD2-CG 4.45Å; L161-L163 HydrophobicContact CD1-CD1 4.15Å; L161-L163 HydrophobicContact CD1-CD2 4.42Å; L161-L163 HydrophobicContact CD1-CG 3.95Å; L161-L163 HydrophobicContact CD2-CD1 3.82Å; L161-L163 HydrophobicContact CD2-CG 4.48Å; L161-L163 HydrophobicContact CG-CD1 3.88Å; L161-L163 HydrophobicContact CG-CG 4.01Å; L161-L250 HydrophobicContact CD2-CD1 4.25Å; L161-L253 HydrophobicContact CB-CD1 3.77Å; L161-C255 PolarHBondContact N-O 3Å; L161-L256 HydrophobicContact CB-CD1 4.24Å; L161-L256 HydrophobicContact CD2-CD1 3.92Å; L161-L256 HydrophobicContact CG-CD1 4.02Å; L161-N257 PolarHBondContact O-N 3.03Å
162	N	94.7	Very high	89.1	Confident	21 Å²	21	38.5 Å²	38.5	11%	0.112	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.8	171.1	-167.1	10.2	0	0	0	110.1	L137 M138 L139 D140 E164 N257	L137-N162 PolarHBondContact O-N 3.09Å; M138-N162 HydrophobicContact CB-CB 4.5Å; M138-N162 HydrophobicContact CE-CB 3.56Å; M138-N162 HydrophobicContact SD-CB 3.71Å; L139-N162 CarbonylContact C-O 3.29Å; L139-N162 WeakPolarHBondContact CA-O 3.28Å; L139-N162 WeakPolarHBondContact CB-O 3.44Å; L139-N162 PolarHBondContact N-O 3.42Å; D140-N162 WeakPolarHBondContact CB-ND2 3.31Å; D140-N162 VanDerWaalsContact OD1-CG 3.32Å; D140-N162 PolarHBondContact OD1-ND2 3.34Å; N162-E164 VanDerWaalsContact OD1-CB 3.27Å; N162-E164 WeakPolarHBondContact OD1-CB 3.49Å; N162-E164 PolarHBondContact OD1-N 2.94Å; N162-E164 VanDerWaalsContact OD1-N 3.08Å; N162-N257 VanDerWaalsContact OD1-CB 3.29Å; N162-N257 WeakPolarHBondContact OD1-CB 3.36Å; N162-N257 VanDerWaalsContact OD1-CG 3.24Å; N162-N257 PolarHBondContact OD1-ND2 3.08Å
163	L	95.1	Very high	88.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.211	C	C	.	.			trans	-130	21.2	177	-72.3	167.3	0	0	0	110.8	L139 L144 V148 F149 L161 N166 I168 L256 N257 L258 N261	L139-L163 HydrophobicContact CB-CD2 3.77Å; L139-L163 HydrophobicContact CD1-CD2 4.02Å; L144-L163 HydrophobicContact CD1-CD2 3.86Å; V148-L163 HydrophobicContact CG1-CD1 4.22Å; V148-L163 HydrophobicContact CG1-CD2 4.34Å; V148-L163 HydrophobicContact CG2-CD2 4.31Å; F149-L163 HydrophobicContact CE1-CD1 4.19Å; F149-L163 HydrophobicContact CZ-CD1 4.06Å; L161-L163 HydrophobicContact CD1-CD1 4.15Å; L161-L163 HydrophobicContact CD1-CD2 4.42Å; L161-L163 HydrophobicContact CD1-CG 3.95Å; L161-L163 HydrophobicContact CD2-CD1 3.82Å; L161-L163 HydrophobicContact CD2-CG 4.48Å; L161-L163 HydrophobicContact CG-CD1 3.88Å; L161-L163 HydrophobicContact CG-CG 4.01Å; L163-N166 PolarHBondContact O-ND2 2.78Å; L163-I168 HydrophobicContact CB-CD1 3.69Å; L163-I168 HydrophobicContact CD1-CD1 3.82Å; L163-I168 HydrophobicContact CD2-CD1 4.25Å; L163-I168 HydrophobicContact CG-CD1 4.14Å; L163-L256 HydrophobicContact CD1-CD1 4.37Å; L163-N257 CarbonylContact C-O 3.19Å; L163-N257 WeakPolarHBondContact CA-O 2.98Å; L163-N257 PolarHBondContact N-O 2.99Å; L163-L258 HydrophobicContact CB-CD2 3.88Å; L163-L258 HydrophobicContact CD1-CD2 4.12Å; L163-N261 PolarHBondContact O-ND2 2.98Å
164	E	92.7	Very high	87	Confident	58 Å²	58	47.6 Å²	47.6	27%	0.271	23%	0.234	S	C	.	.			trans	-54.8	148.7	173.6	177.7	165.2	-168	0	0	112	D140 E141 N162 N166 N257 A259	D140-E164 CarbonylContact C-O 3.57Å; D140-E164 WeakPolarHBondContact CA-O 3.49Å; D140-E164 HydrophobicContact CB-CB 4.16Å; E141-E164 PolarHBondContact N-O 3.01Å; E141-E164 VanDerWaalsContact N-O 3.08Å; N162-E164 VanDerWaalsContact OD1-CB 3.27Å; N162-E164 WeakPolarHBondContact OD1-CB 3.49Å; N162-E164 PolarHBondContact OD1-N 2.94Å; N162-E164 VanDerWaalsContact OD1-N 3.08Å; E164-N166 PolarHBondContact O-N 3.31Å; E164-N166 PolarHBondContact O-ND2 2.97Å; E164-N257 PolarHBondContact OE2-ND2 3.15Å; E164-A259 VanDerWaalsContact CA-O 3.24Å; E164-A259 WeakPolarHBondContact CA-O 3.36Å; E164-A259 HydrophobicContact CB-CB 4.49Å; E164-A259 HydrophobicContact CG-CB 4.04Å
165	D	92.2	Very high	85.4	Confident	26 Å²	26	48.1 Å²	48.1	14%	0.139	23%	0.234	C	C	.	.	S	Bend	trans	53.1	59.7	179	-87.7	-99.6	0	0	0	113.6	E141 N142 A259 N260 R357	E141-D165 WeakPolarHBondContact CA-O 3.44Å; E141-D165 HydrophobicContact CG-CB 4.23Å; E141-D165 PolarHBondContact N-O 3.33Å; N142-D165 PolarHBondContact N-O 2.93Å; D165-A259 PolarHBondContact N-O 2.82Å; D165-A259 VanDerWaalsContact N-O 3.13Å; D165-N260 WeakPolarHBondContact CA-O 3.47Å; D165-N260 PolarHBondContact OD1-ND2 3.31Å; D165-N260 WeakPolarHBondContact OD2-CB 3.33Å; D165-N260 PolarHBondContact OD2-ND2 3.05Å; D165-R357 IonicContact OD1-CZ 3.82Å; D165-R357 VanDerWaalsContact OD1-CZ 3.22Å; D165-R357 IonicContact OD1-NE 3.42Å; D165-R357 PolarHBondContact OD1-NE 3.14Å; D165-R357 IonicContact OD1-NH2 3.32Å; D165-R357 PolarHBondContact OD1-NH2 3.22Å; D165-R357 IonicContact OD2-CZ 3.26Å; D165-R357 IonicContact OD2-NE 2.71Å; D165-R357 IonicContact OD2-NH1 3.36Å; D165-R357 IonicContact OD2-NH2 2.63Å; D165-R357 PolarHBondContact OD2-NH2 3.01Å
166	N	93.9	Very high	82.8	Confident	9 Å²	9	53.6 Å²	53.6	5%	0.048	27%	0.267	C	S	.	.	S	Bend	trans	-134.7	-177.3	174	-82.4	-85.3	0	0	0	110.2	L139 N142 R143 L144 L163 E164 I168 N261	L139-N166 PolarHBondContact O-ND2 2.87Å; N142-N166 WeakPolarHBondContact CA-OD1 3.19Å; N142-N166 WeakPolarHBondContact CB-OD1 3.35Å; R143-N166 PolarHBondContact N-OD1 3.42Å; L144-N166 HydrophobicContact CB-CB 4.41Å; L144-N166 VanDerWaalsContact CB-OD1 3.23Å; L144-N166 WeakPolarHBondContact CB-OD1 3.27Å; L144-N166 WeakPolarHBondContact CG-OD1 3.36Å; L144-N166 PolarHBondContact N-OD1 3.09Å; L163-N166 PolarHBondContact O-ND2 2.78Å; E164-N166 PolarHBondContact O-N 3.31Å; E164-N166 PolarHBondContact O-ND2 2.97Å; N166-I168 HydrophobicContact CB-CD1 4.38Å; N166-I168 HydrophobicContact CB-CG1 4.22Å; N166-N261 WeakPolarHBondContact CA-OD1 3.31Å; N166-N261 VanDerWaalsContact CB-OD1 3.31Å; N166-N261 WeakPolarHBondContact CB-OD1 3.49Å; N166-N261 PolarHBondContact O-OD1 3.23Å
167	C	92.6	Very high	80.3	Confident	48 Å²	48	52 Å²	52	32%	0.324	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-102.1	41.4	179.1	-65.8	0	0	0	0	111.5	L144 T145 E262	L144-C167 CarbonylContact O-C 3.59Å; L144-C167 VanDerWaalsContact O-C 3.3Å; L144-C167 WeakPolarHBondContact O-CA 3.48Å; L144-C167 PolarHBondContact O-N 2.88Å; T145-C167 WeakPolarHBondContact CA-O 3.42Å; T145-C167 HydrophobicContact CG2-CB 4.2Å; C167-E262 PolarHBondContact SG-OE1 3.02Å
168	I	91.9	Very high	77.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.284	C	S	.	.			trans	-83.2	126.4	179.5	-58.6	172.1	0	0	0	109.5	V148 F149 L163 N166 E170 L258 N261 E262 I263	V148-I168 HydrophobicContact CG1-CD1 4.19Å; F149-I168 HydrophobicContact CE2-CD1 4.37Å; F149-I168 HydrophobicContact CE2-CG2 3.97Å; L163-I168 HydrophobicContact CB-CD1 3.69Å; L163-I168 HydrophobicContact CD1-CD1 3.82Å; L163-I168 HydrophobicContact CD2-CD1 4.25Å; L163-I168 HydrophobicContact CG-CD1 4.14Å; N166-I168 HydrophobicContact CB-CD1 4.38Å; N166-I168 HydrophobicContact CB-CG1 4.22Å; I168-E170 WeakPolarHBondContact CG2-O 3.43Å; I168-L258 HydrophobicContact CD1-CD2 3.64Å; I168-L258 HydrophobicContact CG2-CD2 4.35Å; I168-N261 HydrophobicContact CB-CB 4.35Å; I168-N261 WeakPolarHBondContact CB-OD1 3.42Å; I168-N261 WeakPolarHBondContact CG1-OD1 3.4Å; I168-N261 PolarHBondContact N-OD1 3.25Å; I168-E262 CarbonylContact O-C 3.51Å; I168-E262 WeakPolarHBondContact O-CA 3.18Å; I168-E262 PolarHBondContact O-N 3.07Å; I168-I263 PolarHBondContact O-N 2.91Å
169	T	88.4	Confident	74.4	Confident	63 Å²	63	60.9 Å²	60.9	39%	0.387	32%	0.322	S	S	.	.			trans	-100.4	-30.3	178.5	56.9	0	0	0	0	112.7	S146 E262 A268	S146-T169 PolarHBondContact OG-N 2.88Å; S146-T169 PolarHBondContact OG-OG1 2.97Å; T169-E262 HydrophobicContact CG2-CB 4.05Å; T169-A268 WeakPolarHBondContact O-CB 3.46Å
170	E	85.5	Confident	71.4	Confident	97 Å²	97	63.7 Å²	63.7	45%	0.453	35%	0.348	S	S	.	.			trans	-158	157.1	-174.6	64	-175.8	-156.7	0	0	111.8	S146 I168 A268	S146-E170 VanDerWaalsContact CB-O 3.24Å; S146-E170 WeakPolarHBondContact CB-O 3.07Å; S146-E170 PolarHBondContact OG-N 3Å; S146-E170 PolarHBondContact OG-O 2.87Å; I168-E170 WeakPolarHBondContact CG2-O 3.43Å; E170-A268 CarbonylContact C-O 3.52Å; E170-A268 WeakPolarHBondContact CA-O 3.49Å; E170-A268 HydrophobicContact CB-CB 3.75Å
171	I	86.3	Confident	68.1	Low	4 Å²	4	69.4 Å²	69.4	2%	0.021	38%	0.375	C	S	.	.			trans	-88.3	114.3	164.1	-56.3	174.1	0	0	0	106.3	F149 C173 L256 L258 A268 V269 A271 A272 F275	F149-I171 HydrophobicContact CE1-CG2 4.38Å; F149-I171 HydrophobicContact CE2-CB 4.44Å; F149-I171 HydrophobicContact CE2-CG1 4.14Å; F149-I171 HydrophobicContact CZ-CB 4.46Å; F149-I171 HydrophobicContact CZ-CG1 3.88Å; F149-I171 HydrophobicContact CZ-CG2 4.35Å; I171-C173 PolarHBondContact O-N 3.28Å; I171-C173 VanDerWaalsContact O-N 3.16Å; I171-L256 HydrophobicContact CD1-CD2 4.09Å; I171-L258 HydrophobicContact CD1-CD1 3.77Å; I171-L258 HydrophobicContact CG1-CD1 3.9Å; I171-A268 PolarHBondContact N-O 2.99Å; I171-V269 HydrophobicContact CD1-CG1 4.15Å; I171-A271 HydrophobicContact CB-CB 4.01Å; I171-A271 HydrophobicContact CG2-CB 3.78Å; I171-A271 WeakPolarHBondContact O-CB 3.24Å; I171-A272 HydrophobicContact CD1-CB 3.82Å; I171-F275 HydrophobicContact CG2-CE2 4.11Å; I171-F275 HydrophobicContact CG2-CZ 4.16Å
172	P	81.5	Confident	65	Low	7 Å²	7	75.1 Å²	75.1	5%	0.045	41%	0.413	C	S	.	.			trans	-70.9	114.6	-169.4	26.2	-33.7	0	0	0	112.6	F149 Y150 V248	F149-P172 HydrophobicContact CB-CG 3.68Å; F149-P172 HydrophobicContact CD2-CG 4.24Å; F149-P172 HydrophobicContact CG-CG 4.31Å; Y150-P172 HydrophobicContact CD2-CG 4.44Å; Y150-P172 HydrophobicContact CE1-CB 4.39Å; Y150-P172 HydrophobicContact CE1-CG 4.5Å; Y150-P172 HydrophobicContact CE2-CB 3.88Å; Y150-P172 HydrophobicContact CE2-CG 3.96Å; Y150-P172 WeakPolarHBondContact OH-CB 3.27Å; P172-V248 HydrophobicContact CG-CG2 4.22Å
173	C	65.3	Low	61.7	Low	72 Å²	72	78.7 Å²	78.7	49%	0.486	45%	0.445	S	S	.	.			trans	-104.9	96.7	161.6	50.9	0	0	0	0	109.1	I171 A271	I171-C173 PolarHBondContact O-N 3.28Å; I171-C173 VanDerWaalsContact O-N 3.16Å; C173-A271 HydrophobicContact CB-CB 3.74Å
174	K	53.8	Low	58.6	Low	143 Å²	143	86.9 Å²	86.9	62%	0.622	49%	0.488	S	S	*	.			trans	-138	129.9	175.9	-125.6	177.9	-173.8	177.8	0	114.4
175	E	43.4	Very low	55.5	Low	86 Å²	86	95.6 Å²	95.6	40%	0.402	52%	0.518	S	S	.	.			trans	-45.2	133.5	156.5	-55.9	167.8	126.7	0	0	110	M177 R210	E175-M177 VanDerWaalsContact C-N 3.35Å; E175-M177 HydrophobicContact CB-CG 4.18Å; E175-M177 PolarHBondContact O-N 3.45Å; E175-R210 IonicContact OE2-CZ 3.08Å; E175-R210 IonicContact OE2-NH2 2.79Å; E175-R210 PolarHBondContact OE2-NH2 3.1Å
176	V	31	Very low	52.5	Low	117 Å²	117	103 Å²	103	71%	0.709	55%	0.552	S	S	*	*			trans	-68.2	99.3	159.2	179.1	0	0	0	0	106.5	P246	V176-P246 HydrophobicContact CG2-CB 4.19Å; V176-P246 HydrophobicContact CG2-CG 4.26Å
177	M	30.5	Very low	49.3	Very low	104 Å²	104	110.4 Å²	110.4	51%	0.512	59%	0.591	S	S	.	*			trans	-110.5	148.1	170.6	-87.5	-133.8	-179.7	0	0	110.5	E175 R210	E175-M177 VanDerWaalsContact C-N 3.35Å; E175-M177 HydrophobicContact CB-CG 4.18Å; E175-M177 PolarHBondContact O-N 3.45Å; M177-R210 VanDerWaalsContact CE-NH2 3.31Å; M177-R210 PolarHBondContact SD-NH1 2.72Å; M177-R210 PolarHBondContact SD-NH2 3.48Å
178	E	32.3	Very low	46.3	Very low	185 Å²	185	116.3 Å²	116.3	86%	0.864	61%	0.614	S	S	*	*			trans	78.8	70.9	174	-61.9	172.6	-157.8	0	0	116.5
179	S	26.4	Very low	43.2	Very low	114 Å²	114	124.6 Å²	124.6	80%	0.797	65%	0.653	S	S	*	*	S	Bend	trans	-143.9	48.5	152.1	77.5	0	0	0	0	113.3
180	S	29.8	Very low	40.3	Very low	114 Å²	114	130 Å²	130	80%	0.797	67%	0.674	S	S	*	*			trans	-165.9	103.7	158.2	41.6	0	0	0	0	112
181	E	27.2	Very low	37.4	Very low	186 Å²	186	128.6 Å²	128.6	87%	0.869	69%	0.685	S	S	*	*			trans	-62.2	135.8	153.3	-67.9	-176.3	132.5	0	0	108.6	A183	E181-A183 PolarHBondContact O-N 2.9Å
182	P	29.9	Very low	34.6	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	73%	0.728	S	S	*	*			trans	-75.6	94.6	172.1	30.3	-31.9	0	0	0	109.3	L184	P182-L184 PolarHBondContact O-N 2.86Å
183	A	26.6	Very low	32	Very low	96 Å²	96	146.7 Å²	146.7	79%	0.793	77%	0.766	S	S	*	*			trans	-61.8	119.6	165.8	0	0	0	0	0	109.3	E181 R185	E181-A183 PolarHBondContact O-N 2.9Å; A183-R185 PolarHBondContact O-N 2.87Å; A183-R185 VanDerWaalsContact O-N 3.11Å
184	L	28.8	Very low	30	Very low	172 Å²	172	149 Å²	149	90%	0.901	78%	0.782	S	S	*	*			trans	-55.4	113.1	176.9	-69.2	165.2	0	0	0	111	P182	P182-L184 PolarHBondContact O-N 2.86Å
185	R	28	Very low	29.1	Very low	241 Å²	241	149 Å²	149	91%	0.909	79%	0.788	S	S	*	*			trans	-140.2	118.1	148.4	-68.9	-163.1	176.8	159.1	4	109.7	A183	A183-R185 PolarHBondContact O-N 2.87Å; A183-R185 VanDerWaalsContact O-N 3.11Å
186	E	30.2	Very low	28.5	Very low	182 Å²	182	148.3 Å²	148.3	85%	0.85	79%	0.793	S	S	*	*			trans	-62	141.2	155.2	-61.7	164.3	159	0	0	107.7
187	D	27	Very low	28.6	Very low	163 Å²	163	149.9 Å²	149.9	87%	0.872	79%	0.792	S	S	*	*			trans	-173.6	158.8	137.5	-89.4	-27.6	0	0	0	109.6
188	E	29.4	Very low	28.8	Very low	173 Å²	173	150.6 Å²	150.6	81%	0.808	81%	0.807	S	S	*	*			trans	-85.3	155	-154.3	-60.6	169.8	144.7	0	0	115.2
189	E	27.1	Very low	28.6	Very low	174 Å²	174	149.3 Å²	149.3	81%	0.813	80%	0.804	S	S	*	*			trans	50.2	153.3	143.4	-64.8	-175.8	167.5	0	0	120.2
190	E	26	Very low	28.7	Very low	177 Å²	177	152.6 Å²	152.6	83%	0.827	80%	0.798	S	S	*	*			cis	-158.3	154.5	12.6	-143.8	-175.9	-176.5	0	0	109.9
191	G	25.5	Very low	28.7	Very low	66 Å²	66	152.8 Å²	152.8	68%	0.68	79%	0.791	S	S	*	*			trans	68.3	95.4	147.8	0	0	0	0	0	121.2
192	K	26.9	Very low	29	Very low	213 Å²	213	145.6 Å²	145.6	93%	0.926	77%	0.766	S	S	*	*				176.4	130.8	102.7	-94.7	165.1	-172.9	173.5	0	112.9
193	E	27.2	Very low	29	Very low	178 Å²	178	142.4 Å²	142.4	83%	0.832	75%	0.75	S	S	*	*			trans	-64.3	136.5	169.6	-67.8	171.6	111.4	0	0	111.8
194	C	23.1	Very low	29.3	Very low	122 Å²	122	144.1 Å²	144.1	82%	0.824	74%	0.742	S	S	*	*			trans	-136.7	119.1	145.4	-88	0	0	0	0	107.5	S196	C194-S196 PolarHBondContact O-N 2.86Å
195	N	35.3	Very low	29.7	Very low	143 Å²	143	138 Å²	138	77%	0.765	71%	0.714	S	S	*	*			trans	-59.2	120.2	-176.2	-83.9	-32.9	0	0	0	111.9
196	S	30.9	Very low	30.1	Very low	70 Å²	70	131 Å²	131	49%	0.49	69%	0.69	S	S	.	*			trans	-140.9	52.2	172.9	55.2	0	0	0	0	111.4	C194 S198 M199	C194-S196 PolarHBondContact O-N 2.86Å; S196-S198 PolarHBondContact O-N 3.49Å; S196-S198 VanDerWaalsContact O-N 3.08Å; S196-M199 PolarHBondContact O-N 2.89Å; S196-M199 VanDerWaalsContact O-N 3.08Å
197	Q	32.3	Very low	30.2	Very low	151 Å²	151	129.2 Å²	129.2	71%	0.706	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-59.8	-14	171.3	-83.7	158.6	-46.1	0	0	113.5	M199	Q197-M199 VanDerWaalsContact C-N 3.31Å; Q197-M199 PolarHBondContact O-N 3.11Å
198	S	34.3	Very low	30.5	Very low	118 Å²	118	125.7 Å²	125.7	83%	0.825	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-71.2	-14.8	171.8	-165	0	0	0	0	114.9	S196	S196-S198 PolarHBondContact O-N 3.49Å; S196-S198 VanDerWaalsContact O-N 3.08Å
199	M	28.1	Very low	30.8	Very low	159 Å²	159	119.9 Å²	119.9	78%	0.783	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-107.5	-1.5	-172.8	-94.4	-164.8	167.8	0	0	116.2	S196 Q197	S196-M199 PolarHBondContact O-N 2.89Å; S196-M199 VanDerWaalsContact O-N 3.08Å; Q197-M199 VanDerWaalsContact C-N 3.31Å; Q197-M199 PolarHBondContact O-N 3.11Å
200	R	28.5	Very low	31.1	Very low	182 Å²	182	116.5 Å²	116.5	69%	0.687	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-43.4	176.3	-62.2	-171.3	-164.5	-153.4	3.9	112.2	G202 A203 E204	R200-G202 VanDerWaalsContact C-N 3.3Å; R200-G202 PolarHBondContact O-N 3.11Å; R200-A203 PolarHBondContact O-N 2.65Å; R200-E204 PolarHBondContact O-N 2.84Å
201	D	31.8	Very low	31.4	Very low	119 Å²	119	114.1 Å²	114.1	64%	0.636	60%	0.6	S	S	*	*	H	α-helix	trans	-60	-38.2	-174.4	-57.4	0	0	0	0	112.5	S205	D201-S205 WeakPolarHBondContact O-CB 3.35Å; D201-S205 PolarHBondContact O-N 2.92Å; D201-S205 VanDerWaalsContact O-N 3.13Å
202	G	32.3	Very low	31.9	Very low	35 Å²	35	113.2 Å²	113.2	36%	0.361	58%	0.58	S	S	.	*	H	α-helix	trans	-63.9	-46.3	173	0	0	0	0	0	113	R200 E204 S205 F206	R200-G202 VanDerWaalsContact C-N 3.3Å; R200-G202 PolarHBondContact O-N 3.11Å; G202-E204 VanDerWaalsContact C-N 3.33Å; G202-E204 PolarHBondContact O-N 2.87Å; G202-S205 WeakPolarHBondContact O-CB 3.21Å; G202-S205 PolarHBondContact O-N 3.32Å; G202-S205 VanDerWaalsContact O-N 3.16Å; G202-F206 WeakPolarHBondContact O-CD2 3.25Å; G202-F206 PolarHBondContact O-N 3.03Å; G202-F206 VanDerWaalsContact O-N 3.08Å
203	A	31	Very low	32.3	Very low	57 Å²	57	107.8 Å²	107.8	47%	0.471	57%	0.569	S	S	.	*	H	α-helix	trans	-69.8	-26.4	-176.5	0	0	0	0	0	113.6	R200	R200-A203 PolarHBondContact O-N 2.65Å
204	E	32.8	Very low	32.8	Very low	132 Å²	132	107.6 Å²	107.6	62%	0.617	57%	0.568	S	S	*	*	H	α-helix	trans	-74.9	-41.5	168.8	-66.8	-167.4	159.2	0	0	111.1	R200 G202 F206 K207 E208	R200-E204 PolarHBondContact O-N 2.84Å; G202-E204 VanDerWaalsContact C-N 3.33Å; G202-E204 PolarHBondContact O-N 2.87Å; E204-F206 VanDerWaalsContact C-N 3.31Å; E204-F206 PolarHBondContact O-N 3.36Å; E204-K207 WeakPolarHBondContact O-CB 3.18Å; E204-K207 PolarHBondContact O-N 3.42Å; E204-E208 PolarHBondContact O-N 2.71Å
205	S	37.3	Very low	33.3	Very low	44 Å²	44	105.8 Å²	105.8	31%	0.308	56%	0.555	S	S	.	*	H	α-helix	trans	-56.5	-41	175.8	-149.2	0	0	0	0	113	D201 G202 K207 E208 V209 Q230	D201-S205 WeakPolarHBondContact O-CB 3.35Å; D201-S205 PolarHBondContact O-N 2.92Å; D201-S205 VanDerWaalsContact O-N 3.13Å; G202-S205 WeakPolarHBondContact O-CB 3.21Å; G202-S205 PolarHBondContact O-N 3.32Å; G202-S205 VanDerWaalsContact O-N 3.16Å; S205-K207 VanDerWaalsContact C-N 3.33Å; S205-K207 PolarHBondContact O-N 2.99Å; S205-E208 PolarHBondContact O-N 3.24Å; S205-V209 WeakPolarHBondContact O-CG2 3.28Å; S205-V209 PolarHBondContact O-N 3.31Å; S205-Q230 PolarHBondContact OG-NE2 2.8Å
206	F	35.1	Very low	33.6	Very low	92 Å²	92	102.2 Å²	102.2	40%	0.404	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-27.9	176.3	-73.6	-67.8	0	0	0	114.4	G202 E204 R210 M234	G202-F206 WeakPolarHBondContact O-CD2 3.25Å; G202-F206 PolarHBondContact O-N 3.03Å; G202-F206 VanDerWaalsContact O-N 3.08Å; E204-F206 VanDerWaalsContact C-N 3.31Å; E204-F206 PolarHBondContact O-N 3.36Å; F206-R210 PolarHBondContact O-N 3.27Å; F206-M234 HydrophobicContact CE1-CG 4.37Å; F206-M234 HydrophobicContact CZ-CG 4.12Å
207	K	32	Very low	33.9	Very low	146 Å²	146	104.3 Å²	104.3	64%	0.635	55%	0.548	S	S	*	.	H	α-helix	trans	-72.5	-38.3	174	-73.3	177.2	178.9	173.4	0	111.5	E204 S205 R210 K211	E204-K207 WeakPolarHBondContact O-CB 3.18Å; E204-K207 PolarHBondContact O-N 3.42Å; S205-K207 VanDerWaalsContact C-N 3.33Å; S205-K207 PolarHBondContact O-N 2.99Å; K207-R210 PolarHBondContact O-N 3.16Å; K207-K211 PolarHBondContact O-N 3.38Å
208	E	34.8	Very low	34.2	Very low	89 Å²	89	105.9 Å²	105.9	42%	0.416	55%	0.553	S	S	.	*	H	α-helix	trans	-66.8	-43.8	174.8	-110.8	50.2	-140.2	0	0	111.3	E204 S205 R210 K211 I212	E204-E208 PolarHBondContact O-N 2.71Å; S205-E208 PolarHBondContact O-N 3.24Å; E208-R210 VanDerWaalsContact C-N 3.31Å; E208-R210 PolarHBondContact O-N 3.05Å; E208-K211 WeakPolarHBondContact O-CB 3.33Å; E208-K211 PolarHBondContact O-N 2.97Å; E208-K211 VanDerWaalsContact O-N 3.12Å; E208-K211 IonicContact OE1-NZ 2.73Å; E208-K211 PolarHBondContact OE1-NZ 2.93Å; E208-K211 IonicContact OE2-NZ 3.71Å; E208-I212 WeakPolarHBondContact O-CD1 3.29Å; E208-I212 VanDerWaalsContact O-CG1 3.27Å; E208-I212 WeakPolarHBondContact O-CG1 3.44Å; E208-I212 PolarHBondContact O-N 3.03Å
209	V	35.7	Very low	34.2	Very low	51 Å²	51	103.7 Å²	103.7	31%	0.309	53%	0.532	S	S	.	.	H	α-helix	trans	-59.6	-38.3	175.6	173.6	0	0	0	0	112.2	S205 I212 S213	S205-V209 WeakPolarHBondContact O-CG2 3.28Å; S205-V209 PolarHBondContact O-N 3.31Å; V209-I212 PolarHBondContact O-N 2.85Å; V209-S213 WeakPolarHBondContact O-CB 3.44Å; V209-S213 PolarHBondContact O-N 3.47Å
210	R	33.2	Very low	35.1	Very low	103 Å²	103	102 Å²	102	39%	0.389	53%	0.526	S	S	.	.	H	α-helix	trans	-66	-39.4	174.1	-78.4	-171	-178.7	-169.3	2.9	113.3	E175 M177 F206 K207 E208 I212 S213 Q214	E175-R210 IonicContact OE2-CZ 3.08Å; E175-R210 IonicContact OE2-NH2 2.79Å; E175-R210 PolarHBondContact OE2-NH2 3.1Å; M177-R210 VanDerWaalsContact CE-NH2 3.31Å; M177-R210 PolarHBondContact SD-NH1 2.72Å; M177-R210 PolarHBondContact SD-NH2 3.48Å; F206-R210 PolarHBondContact O-N 3.27Å; K207-R210 PolarHBondContact O-N 3.16Å; E208-R210 VanDerWaalsContact C-N 3.31Å; E208-R210 PolarHBondContact O-N 3.05Å; R210-I212 VanDerWaalsContact C-N 3.29Å; R210-I212 PolarHBondContact O-N 3.13Å; R210-S213 PolarHBondContact O-N 2.93Å; R210-Q214 WeakPolarHBondContact O-CG 3.49Å; R210-Q214 PolarHBondContact O-N 3.47Å; R210-Q214 VanDerWaalsContact O-N 3.08Å
211	K	32.1	Very low	36.1	Very low	126 Å²	126	99.7 Å²	99.7	55%	0.548	53%	0.526	S	S	.	.	H	α-helix	trans	-59.9	-41.3	171.2	-83.1	170.6	179.8	165.4	0	111.5	K207 E208 Q214 C215	K207-K211 PolarHBondContact O-N 3.38Å; E208-K211 WeakPolarHBondContact O-CB 3.33Å; E208-K211 PolarHBondContact O-N 2.97Å; E208-K211 VanDerWaalsContact O-N 3.12Å; E208-K211 IonicContact OE1-NZ 2.73Å; E208-K211 PolarHBondContact OE1-NZ 2.93Å; E208-K211 IonicContact OE2-NZ 3.71Å; K211-Q214 PolarHBondContact O-N 3.35Å; K211-C215 WeakPolarHBondContact O-CB 3.39Å; K211-C215 PolarHBondContact O-N 2.96Å
212	I	35.2	Very low	36.9	Very low	48 Å²	48	101.3 Å²	101.3	25%	0.246	53%	0.529	C	S	.	.	H	α-helix	trans	-78.3	-20.7	-176.2	-54.7	158.4	0	0	0	112.2	E208 V209 R210 C215 L216 L219 H227	E208-I212 WeakPolarHBondContact O-CD1 3.29Å; E208-I212 VanDerWaalsContact O-CG1 3.27Å; E208-I212 WeakPolarHBondContact O-CG1 3.44Å; E208-I212 PolarHBondContact O-N 3.03Å; V209-I212 PolarHBondContact O-N 2.85Å; R210-I212 VanDerWaalsContact C-N 3.29Å; R210-I212 PolarHBondContact O-N 3.13Å; I212-C215 VanDerWaalsContact O-O 3.07Å; I212-L216 HydrophobicContact CG2-CD1 3.96Å; I212-L216 VanDerWaalsContact O-CD1 3.29Å; I212-L216 WeakPolarHBondContact O-CD1 3.31Å; I212-L216 WeakPolarHBondContact O-CG 3.43Å; I212-L219 HydrophobicContact CG2-CD1 3.85Å; I212-H227 WeakPolarHBondContact CG2-NE2 3.21Å
213	S	36	Very low	37.9	Very low	99 Å²	99	100.9 Å²	100.9	69%	0.692	52%	0.521	S	S	*	.	H	α-helix	trans	-85.4	-22.4	170.5	-178	0	0	0	0	114.5	V209 R210 C215	V209-S213 WeakPolarHBondContact O-CB 3.44Å; V209-S213 PolarHBondContact O-N 3.47Å; R210-S213 PolarHBondContact O-N 2.93Å; S213-C215 CarbonylContact C-O 3.5Å; S213-C215 VanDerWaalsContact C-O 3.27Å
214	Q	38.1	Very low	39	Very low	174 Å²	174	103.3 Å²	103.3	81%	0.813	52%	0.521	S	S	*	.	H	α-helix	trans	-90.3	-30.5	177.5	-73.7	-177.1	-9.7	0	0	112.6	R210 K211	R210-Q214 WeakPolarHBondContact O-CG 3.49Å; R210-Q214 PolarHBondContact O-N 3.47Å; R210-Q214 VanDerWaalsContact O-N 3.08Å; K211-Q214 PolarHBondContact O-N 3.35Å
215	C	33.1	Very low	40.3	Very low	83 Å²	83	100.5 Å²	100.5	56%	0.561	51%	0.509	S	S	*	.	S	Bend	trans	-68	161.9	152.4	-67.6	0	0	0	0	109.7	K211 I212 S213	K211-C215 WeakPolarHBondContact O-CB 3.39Å; K211-C215 PolarHBondContact O-N 2.96Å; I212-C215 VanDerWaalsContact O-O 3.07Å; S213-C215 CarbonylContact C-O 3.5Å; S213-C215 VanDerWaalsContact C-O 3.27Å
216	L	40.3	Very low	41.4	Very low	68 Å²	68	103 Å²	103	36%	0.356	52%	0.519	S	S	.	.			trans	115.3	89.4	154.6	-55.2	-171.6	0	0	0	119.7	I212 L219	I212-L216 HydrophobicContact CG2-CD1 3.96Å; I212-L216 VanDerWaalsContact O-CD1 3.29Å; I212-L216 WeakPolarHBondContact O-CD1 3.31Å; I212-L216 WeakPolarHBondContact O-CG 3.43Å; L216-L219 HydrophobicContact CD1-CB 3.69Å; L216-L219 HydrophobicContact CD1-CD1 3.9Å; L216-L219 HydrophobicContact CD1-CG 4.26Å; L216-L219 HydrophobicContact CD2-CB 3.46Å; L216-L219 VanDerWaalsContact CD2-CB 3.46Å; L216-L219 HydrophobicContact CD2-CD1 3.74Å; L216-L219 HydrophobicContact CD2-CG 3.56Å; L216-L219 HydrophobicContact CG-CB 4.15Å; L216-L219 HydrophobicContact CG-CD1 4.31Å; L216-L219 HydrophobicContact CG-CG 4.49Å
217	P	37.9	Very low	42.7	Very low	115 Å²	115	101.2 Å²	101.2	75%	0.747	51%	0.512	S	S	*	.	S	Bend	trans	-93.4	-9.4	130.6	-1.1	20.3	0	0	0	113.1
218	F	38.6	Very low	44.2	Very low	184 Å²	184	98 Å²	98	81%	0.807	50%	0.496	S	S	*	.			trans	-141.9	73.5	-164.3	-67.4	-80.1	0	0	0	114.6
219	L	33.7	Very low	45.8	Very low	72 Å²	72	96.9 Å²	96.9	38%	0.377	49%	0.492	S	S	.	.			trans	-132.9	151.8	159.5	-109.6	178.4	0	0	0	110.2	I212 L216	I212-L219 HydrophobicContact CG2-CD1 3.85Å; L216-L219 HydrophobicContact CD1-CB 3.69Å; L216-L219 HydrophobicContact CD1-CD1 3.9Å; L216-L219 HydrophobicContact CD1-CG 4.26Å; L216-L219 HydrophobicContact CD2-CB 3.46Å; L216-L219 VanDerWaalsContact CD2-CB 3.46Å; L216-L219 HydrophobicContact CD2-CD1 3.74Å; L216-L219 HydrophobicContact CD2-CG 3.56Å; L216-L219 HydrophobicContact CG-CB 4.15Å; L216-L219 HydrophobicContact CG-CD1 4.31Å; L216-L219 HydrophobicContact CG-CG 4.49Å
220	D	46.8	Very low	47.3	Very low	124 Å²	124	97.9 Å²	97.9	66%	0.663	49%	0.493	S	S	*	.			trans	-60.3	161.2	-177	-74.3	-54.6	0	0	0	113.4	E222 S223	D220-E222 VanDerWaalsContact C-N 3.28Å; D220-E222 PolarHBondContact O-N 3.01Å; D220-S223 PolarHBondContact O-OG 2.91Å
221	I	50.2	Low	48.9	Very low	133 Å²	133	95.1 Å²	95.1	68%	0.682	49%	0.485	S	S	*	.	H	α-helix	trans	-65.6	-34.2	-176.6	-65.4	165.4	0	0	0	111	K224 I225	I221-K224 PolarHBondContact O-N 2.94Å; I221-I225 HydrophobicContact CG2-CD1 3.98Å; I221-I225 WeakPolarHBondContact O-CG1 3.46Å; I221-I225 PolarHBondContact O-N 3.5Å
222	E	47.8	Very low	50.6	Low	153 Å²	153	90.4 Å²	90.4	72%	0.715	47%	0.465	S	S	*	.	H	α-helix	trans	-62.3	-49.8	-179.9	-65.9	-178	155.2	0	0	111.8	D220 K224 I225 D226	D220-E222 VanDerWaalsContact C-N 3.28Å; D220-E222 PolarHBondContact O-N 3.01Å; E222-K224 PolarHBondContact O-N 3.35Å; E222-I225 WeakPolarHBondContact O-CA 3.18Å; E222-I225 WeakPolarHBondContact O-CB 3.37Å; E222-I225 PolarHBondContact O-N 3.06Å; E222-D226 PolarHBondContact O-N 3.46Å
223	S	55.2	Low	52.1	Low	26 Å²	26	94.1 Å²	94.1	18%	0.182	48%	0.482	C	S	.	.	H	α-helix	trans	-65	-26.6	-179.6	76.2	0	0	0	0	113.2	D220 H227	D220-S223 PolarHBondContact O-OG 2.91Å; S223-H227 PolarHBondContact O-CD2 3.22Å; S223-H227 PolarHBondContact O-N 3.16Å; S223-H227 VanDerWaalsContact O-N 3.13Å
224	K	53.2	Low	53.7	Low	108 Å²	108	92.2 Å²	92.2	47%	0.47	46%	0.463	S	S	.	.	H	α-helix	trans	-72.2	-30.7	172.7	-69.2	179.9	-179.6	175.1	0	112.6	I221 E222 R228	I221-K224 PolarHBondContact O-N 2.94Å; E222-K224 PolarHBondContact O-N 3.35Å; K224-R228 WeakPolarHBondContact O-CG 3.48Å; K224-R228 PolarHBondContact O-N 2.91Å
225	I	59.7	Low	55.1	Low	72 Å²	72	84.1 Å²	84.1	37%	0.369	43%	0.425	S	S	.	.	H	α-helix	trans	-72.7	-44.4	174	-67.2	165.4	0	0	0	109.3	I221 E222 H227 R228 I229	I221-I225 HydrophobicContact CG2-CD1 3.98Å; I221-I225 WeakPolarHBondContact O-CG1 3.46Å; I221-I225 PolarHBondContact O-N 3.5Å; E222-I225 WeakPolarHBondContact O-CA 3.18Å; E222-I225 WeakPolarHBondContact O-CB 3.37Å; E222-I225 PolarHBondContact O-N 3.06Å; I225-H227 PolarHBondContact O-N 3.4Å; I225-R228 WeakPolarHBondContact O-CB 3.39Å; I225-R228 PolarHBondContact O-N 3.06Å; I225-R228 VanDerWaalsContact O-N 3.09Å; I225-I229 HydrophobicContact CG2-CD1 3.81Å; I225-I229 HydrophobicContact CG2-CG1 4.41Å; I225-I229 WeakPolarHBondContact O-CG1 3.33Å; I225-I229 PolarHBondContact O-N 3.24Å
226	D	61.2	Low	56.7	Low	98 Å²	98	83.8 Å²	83.8	52%	0.524	42%	0.415	S	S	.	.	H	α-helix	trans	-58.8	-45.3	177.9	-66.1	-28.6	0	0	0	112.1	E222 R228 I229 Q230	E222-D226 PolarHBondContact O-N 3.46Å; D226-R228 VanDerWaalsContact C-N 3.31Å; D226-R228 PolarHBondContact O-N 3.2Å; D226-I229 PolarHBondContact O-N 3.34Å; D226-Q230 WeakPolarHBondContact O-CB 3.48Å; D226-Q230 PolarHBondContact O-N 3.32Å
227	H	62	Low	57.7	Low	54 Å²	54	82.9 Å²	82.9	25%	0.25	42%	0.418	C	S	.	.	H	α-helix	trans	-63.4	-34.1	175.1	-71.2	-42.4	0	0	0	113.8	I212 S223 I225 M231	I212-H227 WeakPolarHBondContact CG2-NE2 3.21Å; S223-H227 PolarHBondContact O-CD2 3.22Å; S223-H227 PolarHBondContact O-N 3.16Å; S223-H227 VanDerWaalsContact O-N 3.13Å; I225-H227 PolarHBondContact O-N 3.4Å; H227-M231 VanDerWaalsContact O-CB 3.31Å; H227-M231 WeakPolarHBondContact O-CB 3.5Å; H227-M231 PolarHBondContact O-N 3.46Å
228	R	63.9	Low	58.9	Low	77 Å²	77	82.5 Å²	82.5	29%	0.291	40%	0.404	S	S	.	.	H	α-helix	trans	-68.1	-41.5	174.4	-75.9	172.2	166.1	-156	-13	111.4	K224 I225 D226 M231 M232 E267 L299	K224-R228 WeakPolarHBondContact O-CG 3.48Å; K224-R228 PolarHBondContact O-N 2.91Å; I225-R228 WeakPolarHBondContact O-CB 3.39Å; I225-R228 PolarHBondContact O-N 3.06Å; I225-R228 VanDerWaalsContact O-N 3.09Å; D226-R228 VanDerWaalsContact C-N 3.31Å; D226-R228 PolarHBondContact O-N 3.2Å; R228-M231 PolarHBondContact O-N 3.4Å; R228-M232 WeakPolarHBondContact O-CE 3.42Å; R228-M232 VanDerWaalsContact O-CG 3.31Å; R228-M232 WeakPolarHBondContact O-CG 3.4Å; R228-M232 PolarHBondContact O-N 2.88Å; R228-M232 VanDerWaalsContact O-N 3.1Å; R228-E267 IonicContact CZ-OE1 3.13Å; R228-E267 IonicContact NE-OE1 2.72Å; R228-E267 PolarHBondContact NE-OE1 3.27Å; R228-E267 IonicContact NH2-OE1 2.71Å; R228-E267 PolarHBondContact NH2-OE1 3.29Å; R228-E267 IonicContact NH2-OE2 3.07Å; R228-E267 PolarHBondContact NH2-OE2 3.13Å; R228-L299 HydrophobicContact CB-CD1 4.25Å
229	I	67.9	Low	60.2	Low	67 Å²	67	79 Å²	79	34%	0.344	39%	0.386	S	S	.	.	H	α-helix	trans	-62.2	-50.7	175.2	-66.7	167.8	0	0	0	110	I225 D226 M231 M232 E233	I225-I229 HydrophobicContact CG2-CD1 3.81Å; I225-I229 HydrophobicContact CG2-CG1 4.41Å; I225-I229 WeakPolarHBondContact O-CG1 3.33Å; I225-I229 PolarHBondContact O-N 3.24Å; D226-I229 PolarHBondContact O-N 3.34Å; I229-M231 VanDerWaalsContact C-N 3.3Å; I229-M231 PolarHBondContact O-N 2.94Å; I229-M232 HydrophobicContact CG1-CE 4.24Å; I229-M232 WeakPolarHBondContact O-CB 3.46Å; I229-M232 PolarHBondContact O-N 3.03Å; I229-E233 HydrophobicContact CG2-CG 4.44Å; I229-E233 PolarHBondContact O-N 3.37Å
230	Q	66.6	Low	61.5	Low	71 Å²	71	82.1 Å²	82.1	33%	0.332	40%	0.398	S	S	.	.	H	α-helix	trans	-59.9	-38.1	179.6	-165.5	179.7	24.3	0	0	112.6	S205 D226 M234	S205-Q230 PolarHBondContact OG-NE2 2.8Å; D226-Q230 WeakPolarHBondContact O-CB 3.48Å; D226-Q230 PolarHBondContact O-N 3.32Å; Q230-M234 VanDerWaalsContact O-CB 3.28Å; Q230-M234 WeakPolarHBondContact O-CB 3.32Å; Q230-M234 PolarHBondContact O-N 3.03Å
231	M	67.5	Low	61.9	Low	46 Å²	46	82.6 Å²	82.6	23%	0.227	40%	0.401	C	S	.	.	H	α-helix	trans	-64.7	-39.9	173.5	-177.2	-176.7	66.4	0	0	112.2	H227 R228 I229 M234 L235 E267 A270	H227-M231 VanDerWaalsContact O-CB 3.31Å; H227-M231 WeakPolarHBondContact O-CB 3.5Å; H227-M231 PolarHBondContact O-N 3.46Å; R228-M231 PolarHBondContact O-N 3.4Å; I229-M231 VanDerWaalsContact C-N 3.3Å; I229-M231 PolarHBondContact O-N 2.94Å; M231-M234 HydrophobicContact CG-CE 4Å; M231-M234 PolarHBondContact O-N 2.96Å; M231-L235 HydrophobicContact CG-CD1 4.14Å; M231-L235 WeakPolarHBondContact O-CB 3.47Å; M231-L235 VanDerWaalsContact O-CG 3.25Å; M231-L235 WeakPolarHBondContact O-CG 3.3Å; M231-L235 PolarHBondContact O-N 3.19Å; M231-E267 HydrophobicContact CE-CB 4.33Å; M231-E267 HydrophobicContact CE-CG 4.07Å; M231-E267 HydrophobicContact SD-CB 4.49Å; M231-A270 HydrophobicContact CE-CB 3.6Å; M231-A270 HydrophobicContact SD-CB 4.14Å
232	M	67.3	Low	61.9	Low	26 Å²	26	79 Å²	79	13%	0.128	40%	0.397	C	S	.	.	H	α-helix	trans	-69.4	-40.7	177.9	-70.3	-178.6	-57.7	0	0	112.3	R228 I229 L235 Q236 F303	R228-M232 WeakPolarHBondContact O-CE 3.42Å; R228-M232 VanDerWaalsContact O-CG 3.31Å; R228-M232 WeakPolarHBondContact O-CG 3.4Å; R228-M232 PolarHBondContact O-N 2.88Å; R228-M232 VanDerWaalsContact O-N 3.1Å; I229-M232 HydrophobicContact CG1-CE 4.24Å; I229-M232 WeakPolarHBondContact O-CB 3.46Å; I229-M232 PolarHBondContact O-N 3.03Å; M232-L235 PolarHBondContact O-N 3.34Å; M232-Q236 WeakPolarHBondContact O-CB 3.27Å; M232-Q236 PolarHBondContact O-N 2.99Å; M232-F303 HydrophobicContact CB-CD1 4.43Å; M232-F303 HydrophobicContact CB-CD2 3.9Å; M232-F303 HydrophobicContact CB-CE1 4.3Å; M232-F303 HydrophobicContact CB-CE2 3.77Å; M232-F303 HydrophobicContact CB-CG 4.23Å; M232-F303 HydrophobicContact CB-CZ 3.98Å; M232-F303 HydrophobicContact CG-CB 4.33Å; M232-F303 HydrophobicContact CG-CD1 3.94Å; M232-F303 HydrophobicContact CG-CD2 4.03Å; M232-F303 HydrophobicContact CG-CE1 4.2Å; M232-F303 HydrophobicContact CG-CE2 4.29Å; M232-F303 HydrophobicContact CG-CG 3.85Å; M232-F303 HydrophobicContact CG-CZ 4.37Å; M232-F303 WeakPolarHBondContact O-CZ 3.4Å; M232-F303 HydrophobicContact SD-CB 3.46Å; M232-F303 WeakPolarHBondContact SD-CB 3.45Å; M232-F303 HydrophobicContact SD-CD1 4.21Å; M232-F303 HydrophobicContact SD-CD2 3.92Å; M232-F303 HydrophobicContact SD-CG 3.62Å
233	E	66.9	Low	61.9	Low	126 Å²	126	76.1 Å²	76.1	59%	0.589	39%	0.392	S	S	*	.	H	α-helix	trans	-61.7	-43.4	173.5	-69.7	179.7	160.3	0	0	111.4	I229 Q236 A237	I229-E233 HydrophobicContact CG2-CG 4.44Å; I229-E233 PolarHBondContact O-N 3.37Å; E233-Q236 PolarHBondContact O-N 3.32Å; E233-A237 WeakPolarHBondContact O-CB 3.42Å; E233-A237 PolarHBondContact O-N 2.93Å
234	M	69.3	Low	61.4	Low	59 Å²	59	85.9 Å²	85.9	29%	0.291	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-46.6	173.8	170.2	-89.3	-78.3	0	0	112.3	F206 Q230 M231 Q236 A237 F238	F206-M234 HydrophobicContact CE1-CG 4.37Å; F206-M234 HydrophobicContact CZ-CG 4.12Å; Q230-M234 VanDerWaalsContact O-CB 3.28Å; Q230-M234 WeakPolarHBondContact O-CB 3.32Å; Q230-M234 PolarHBondContact O-N 3.03Å; M231-M234 HydrophobicContact CG-CE 4Å; M231-M234 PolarHBondContact O-N 2.96Å; M234-Q236 VanDerWaalsContact C-N 3.33Å; M234-Q236 PolarHBondContact O-N 2.7Å; M234-A237 PolarHBondContact O-N 2.8Å; M234-F238 HydrophobicContact CG-CD2 3.84Å; M234-F238 HydrophobicContact CG-CE2 3.58Å; M234-F238 WeakPolarHBondContact O-CD2 3.39Å; M234-F238 PolarHBondContact O-N 2.85Å; M234-F238 HydrophobicContact SD-CD2 3.49Å; M234-F238 WeakPolarHBondContact SD-CD2 3.5Å; M234-F238 HydrophobicContact SD-CE2 3.47Å; M234-F238 WeakPolarHBondContact SD-CE2 3.34Å
235	L	68.2	Low	61.1	Low	5 Å²	5	91.6 Å²	91.6	3%	0.026	44%	0.444	C	S	.	.	H	α-helix	trans	-65.3	-35.7	177.3	-72.4	168.2	0	0	0	112.4	M231 M232 R239 A270 L274 F303	M231-L235 HydrophobicContact CG-CD1 4.14Å; M231-L235 WeakPolarHBondContact O-CB 3.47Å; M231-L235 VanDerWaalsContact O-CG 3.25Å; M231-L235 WeakPolarHBondContact O-CG 3.3Å; M231-L235 PolarHBondContact O-N 3.19Å; M232-L235 PolarHBondContact O-N 3.34Å; L235-R239 PolarHBondContact O-N 3.33Å; L235-R239 VanDerWaalsContact O-N 3.13Å; L235-A270 HydrophobicContact CD1-CB 3.74Å; L235-L274 HydrophobicContact CD2-CD1 4.18Å; L235-L274 HydrophobicContact CD2-CD2 3.78Å; L235-L274 HydrophobicContact CD2-CG 3.91Å; L235-F303 HydrophobicContact CB-CE1 4.46Å; L235-F303 HydrophobicContact CB-CZ 4.45Å
236	Q	66.3	Low	60.4	Low	76 Å²	76	91.4 Å²	91.4	36%	0.355	45%	0.447	S	S	.	.	H	α-helix	trans	-67.4	-45.5	174.8	-174.3	175.8	-22.8	0	0	111.1	M232 E233 M234 F238 R239 E240 F303	M232-Q236 WeakPolarHBondContact O-CB 3.27Å; M232-Q236 PolarHBondContact O-N 2.99Å; E233-Q236 PolarHBondContact O-N 3.32Å; M234-Q236 VanDerWaalsContact C-N 3.33Å; M234-Q236 PolarHBondContact O-N 2.7Å; Q236-F238 VanDerWaalsContact C-N 3.33Å; Q236-F238 PolarHBondContact O-N 2.95Å; Q236-R239 WeakPolarHBondContact O-CB 3.5Å; Q236-R239 PolarHBondContact O-N 2.88Å; Q236-E240 VanDerWaalsContact CG-OE1 3.31Å; Q236-E240 WeakPolarHBondContact CG-OE1 3.42Å; Q236-E240 PolarHBondContact NE2-OE1 2.77Å; Q236-E240 WeakPolarHBondContact O-CG 3.49Å; Q236-E240 PolarHBondContact O-N 3.25Å; Q236-F303 HydrophobicContact CB-CZ 4.42Å
237	A	61.9	Low	59.9	Low	49 Å²	49	88.8 Å²	88.8	41%	0.405	44%	0.443	S	S	.	.	H	α-helix	trans	-56.8	-45.3	174.3	0	0	0	0	0	111.6	E233 M234 R239 E240 D241	E233-A237 WeakPolarHBondContact O-CB 3.42Å; E233-A237 PolarHBondContact O-N 2.93Å; M234-A237 PolarHBondContact O-N 2.8Å; A237-R239 VanDerWaalsContact C-N 3.28Å; A237-R239 PolarHBondContact O-N 3.28Å; A237-E240 PolarHBondContact O-N 2.91Å; A237-E240 VanDerWaalsContact O-N 3.11Å; A237-D241 WeakPolarHBondContact O-CB 3.19Å; A237-D241 PolarHBondContact O-N 3.13Å
238	F	63.2	Low	59.7	Low	107 Å²	107	86.6 Å²	86.6	47%	0.469	43%	0.434	S	S	.	.	H	α-helix	trans	-62.6	-29.6	175.5	-80	-57.8	0	0	0	114.4	M234 Q236 L274	M234-F238 HydrophobicContact CG-CD2 3.84Å; M234-F238 HydrophobicContact CG-CE2 3.58Å; M234-F238 WeakPolarHBondContact O-CD2 3.39Å; M234-F238 PolarHBondContact O-N 2.85Å; M234-F238 HydrophobicContact SD-CD2 3.49Å; M234-F238 WeakPolarHBondContact SD-CD2 3.5Å; M234-F238 HydrophobicContact SD-CE2 3.47Å; M234-F238 WeakPolarHBondContact SD-CE2 3.34Å; Q236-F238 VanDerWaalsContact C-N 3.33Å; Q236-F238 PolarHBondContact O-N 2.95Å; F238-L274 HydrophobicContact CB-CD2 3.99Å
239	R	64.6	Low	59.8	Low	111 Å²	111	87.3 Å²	87.3	42%	0.419	44%	0.439	S	S	.	.	H	α-helix	trans	-74.1	-30.7	174.7	-166.2	175.8	-173.3	-114.9	2.7	112.1	L235 Q236 A237 P276	L235-R239 PolarHBondContact O-N 3.33Å; L235-R239 VanDerWaalsContact O-N 3.13Å; Q236-R239 WeakPolarHBondContact O-CB 3.5Å; Q236-R239 PolarHBondContact O-N 2.88Å; A237-R239 VanDerWaalsContact C-N 3.28Å; A237-R239 PolarHBondContact O-N 3.28Å; R239-P276 PolarHBondContact NH2-O 3.13Å
240	E	62.3	Low	60.5	Low	136 Å²	136	84.2 Å²	84.2	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-85.1	-35.6	-179.3	-69.2	175.4	-164.5	0	0	112.8	Q236 A237 G242	Q236-E240 VanDerWaalsContact CG-OE1 3.31Å; Q236-E240 WeakPolarHBondContact CG-OE1 3.42Å; Q236-E240 PolarHBondContact NE2-OE1 2.77Å; Q236-E240 WeakPolarHBondContact O-CG 3.49Å; Q236-E240 PolarHBondContact O-N 3.25Å; A237-E240 PolarHBondContact O-N 2.91Å; A237-E240 VanDerWaalsContact O-N 3.11Å; E240-G242 PolarHBondContact O-N 2.97Å
241	D	55	Low	61.2	Low	135 Å²	135	81.9 Å²	81.9	72%	0.722	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	5.5	-173.6	-107.2	0.2	0	0	0	116.2	A237 C243	A237-D241 WeakPolarHBondContact O-CB 3.19Å; A237-D241 PolarHBondContact O-N 3.13Å; D241-C243 PolarHBondContact O-N 3.37Å
242	G	50.9	Low	62.1	Low	57 Å²	57	82.6 Å²	82.6	59%	0.588	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	51.9	164.5	0	0	0	0	0	115.4	E240	E240-G242 PolarHBondContact O-N 2.97Å
243	C	47.7	Very low	63.2	Low	92 Å²	92	81.4 Å²	81.4	62%	0.622	41%	0.411	S	S	*	.			trans	62.2	74.8	165.8	-59.3	0	0	0	0	116.4	D241 F249	D241-C243 PolarHBondContact O-N 3.37Å; C243-F249 WeakPolarHBondContact SG-CE2 3.16Å
244	R	43.1	Very low	64.4	Low	231 Å²	231	78.5 Å²	78.5	87%	0.872	40%	0.397	S	S	*	.			trans	-128.3	81	157.9	-67.2	-166.9	-174.4	-152.9	3.4	112.8
245	R	48	Very low	65.6	Low	229 Å²	229	77.4 Å²	77.4	86%	0.864	40%	0.395	S	S	*	.	S	Bend	trans	75.6	168.1	173.5	-45.5	168.7	179.3	164.4	-3	114.6
246	P	44.1	Very low	66.8	Low	68 Å²	68	77.2 Å²	77.2	44%	0.442	39%	0.394	S	S	.	.				-117.3	135.2	-64.5	35	-23.7	0	0	0	110.8	V176	V176-P246 HydrophobicContact CG2-CB 4.19Å; V176-P246 HydrophobicContact CG2-CG 4.26Å
247	G	50.4	Low	68.1	Low	42 Å²	42	75.1 Å²	75.1	43%	0.433	39%	0.385	S	S	.	.	S	Bend	trans	-172.4	170.3	-180	0	0	0	0	0	110.9	F249	G247-F249 PolarHBondContact O-N 3.11Å; G247-F249 VanDerWaalsContact O-N 3.08Å
248	V	57.8	Low	69.5	Low	9 Å²	9	72.8 Å²	72.8	6%	0.055	37%	0.366	C	S	.	.			trans	-70.5	108.1	-177.6	172.9	0	0	0	0	109.6	F149 Y150 T153 P172 L250 F275	F149-V248 HydrophobicContact CB-CB 4.37Å; F149-V248 HydrophobicContact CB-CG1 4.01Å; F149-V248 HydrophobicContact CB-CG2 3.82Å; F149-V248 HydrophobicContact CD1-CG1 4.39Å; F149-V248 VanDerWaalsContact O-CG1 3.24Å; F149-V248 WeakPolarHBondContact O-CG1 3.05Å; F149-V248 WeakPolarHBondContact O-CG2 3.35Å; Y150-V248 HydrophobicContact CD1-CG2 4.23Å; T153-V248 HydrophobicContact CG2-CB 4.4Å; T153-V248 HydrophobicContact CG2-CG1 4.2Å; T153-V248 HydrophobicContact CG2-CG2 4.19Å; P172-V248 HydrophobicContact CG-CG2 4.22Å; V248-L250 HydrophobicContact CG1-CD1 4.41Å; V248-L250 HydrophobicContact CG1-CG 4.33Å; V248-F275 HydrophobicContact CG1-CE1 4.25Å; V248-F275 WeakPolarHBondContact O-CE1 3.42Å
249	F	67.5	Low	70.7	Confident	92 Å²	92	67.9 Å²	67.9	40%	0.404	35%	0.346	S	S	.	.			trans	-102.5	93.1	-169.7	-168.3	-104.6	0	0	0	111.7	C243 G247 P251	C243-F249 WeakPolarHBondContact SG-CE2 3.16Å; G247-F249 PolarHBondContact O-N 3.11Å; G247-F249 VanDerWaalsContact O-N 3.08Å; F249-P251 HydrophobicContact CD1-CB 4.33Å; F249-P251 HydrophobicContact CD1-CG 4.14Å; F249-P251 HydrophobicContact CE1-CB 3.64Å; F249-P251 HydrophobicContact CE1-CG 3.75Å; F249-P251 HydrophobicContact CZ-CB 3.84Å; F249-P251 HydrophobicContact CZ-CG 4.46Å; F249-P251 VanDerWaalsContact O-CD 3.3Å; F249-P251 WeakPolarHBondContact O-CD 3.39Å
250	L	82.1	Confident	71.8	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	34%	0.34	C	S	.	.			trans	-107.7	88.9	171.7	-65.1	171.7	0	0	0	109	L152 L155 L158 L161 V248 E252 L253 F275	L152-L250 HydrophobicContact CB-CD2 4.48Å; L152-L250 VanDerWaalsContact O-CD2 3.29Å; L152-L250 WeakPolarHBondContact O-CD2 3.45Å; L155-L250 HydrophobicContact CB-CD2 4.2Å; L158-L250 HydrophobicContact CD2-CD1 4.5Å; L158-L250 HydrophobicContact CD2-CD2 4.26Å; L161-L250 HydrophobicContact CD2-CD1 4.25Å; V248-L250 HydrophobicContact CG1-CD1 4.41Å; V248-L250 HydrophobicContact CG1-CG 4.33Å; L250-E252 PolarHBondContact O-N 2.77Å; L250-L253 HydrophobicContact CB-CB 3.87Å; L250-L253 HydrophobicContact CB-CD2 4.26Å; L250-L253 HydrophobicContact CD1-CD2 3.94Å; L250-F275 HydrophobicContact CB-CD1 3.92Å; L250-F275 HydrophobicContact CB-CE1 3.94Å; L250-F275 HydrophobicContact CD1-CE1 4.07Å; L250-F275 HydrophobicContact CG-CE1 4.2Å
251	P	80.4	Confident	73.2	Confident	23 Å²	23	59.2 Å²	59.2	15%	0.149	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-28.3	-167.2	26.8	-34.3	0	0	0	114.3	K156 F249 K277	K156-P251 HydrophobicContact CB-CG 4.42Å; F249-P251 HydrophobicContact CD1-CB 4.33Å; F249-P251 HydrophobicContact CD1-CG 4.14Å; F249-P251 HydrophobicContact CE1-CB 3.64Å; F249-P251 HydrophobicContact CE1-CG 3.75Å; F249-P251 HydrophobicContact CZ-CB 3.84Å; F249-P251 HydrophobicContact CZ-CG 4.46Å; F249-P251 VanDerWaalsContact O-CD 3.3Å; F249-P251 WeakPolarHBondContact O-CD 3.39Å; P251-K277 WeakPolarHBondContact O-CD 3.38Å; P251-K277 WeakPolarHBondContact O-CG 3.49Å
252	E	88	Confident	74.8	Confident	61 Å²	61	57.7 Å²	57.7	29%	0.285	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	2.6	-178.2	-65.6	-59.8	141.2	0	0	113.8	K156 L158 K159 L250 Q254 K277	K156-E252 VanDerWaalsContact O-CG 3.24Å; K156-E252 WeakPolarHBondContact O-CG 3.31Å; L158-E252 CarbonylContact O-C 3.28Å; K159-E252 WeakPolarHBondContact CA-O 3.48Å; L250-E252 PolarHBondContact O-N 2.77Å; E252-Q254 PolarHBondContact O-N 2.92Å; E252-K277 IonicContact OE1-NZ 3.79Å; E252-K277 PolarHBondContact OE1-NZ 3.05Å; E252-K277 WeakPolarHBondContact OE2-CD 3.21Å; E252-K277 IonicContact OE2-NZ 2.65Å; E252-K277 PolarHBondContact OE2-NZ 3.45Å
253	L	90.4	Very high	76.4	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.273	C	S	.	.			trans	-67.1	122.4	-174.9	-170.6	72.4	0	0	0	110.8	L158 L161 L250 L256 F275 K277 L278	L158-L253 HydrophobicContact CD2-CD1 4.4Å; L158-L253 HydrophobicContact CG-CD1 4.32Å; L158-L253 WeakPolarHBondContact O-CA 3.42Å; L158-L253 PolarHBondContact O-N 3.37Å; L161-L253 HydrophobicContact CB-CD1 3.77Å; L250-L253 HydrophobicContact CB-CB 3.87Å; L250-L253 HydrophobicContact CB-CD2 4.26Å; L250-L253 HydrophobicContact CD1-CD2 3.94Å; L253-L256 HydrophobicContact CD2-CB 4.25Å; L253-L256 HydrophobicContact CD2-CD2 4.45Å; L253-F275 HydrophobicContact CD2-CD1 4.25Å; L253-F275 HydrophobicContact CD2-CD2 4.23Å; L253-F275 HydrophobicContact CD2-CE1 4.45Å; L253-F275 HydrophobicContact CD2-CE2 4.41Å; L253-F275 HydrophobicContact CD2-CG 4.15Å; L253-K277 CarbonylContact O-C 3.49Å; L253-L278 HydrophobicContact CD2-CD1 4.22Å; L253-L278 HydrophobicContact CG-CD1 4.18Å; L253-L278 VanDerWaalsContact O-CA 3.22Å; L253-L278 WeakPolarHBondContact O-CA 3.38Å; L253-L278 PolarHBondContact O-N 3.09Å
254	Q	91.4	Very high	78	Confident	65 Å²	65	53.1 Å²	53.1	30%	0.304	26%	0.264	S	S	.	.			trans	-112.7	-34.5	-177.4	-72.8	164.3	48.9	0	0	112.1	K159 E252 C279 E280	K159-Q254 PolarHBondContact O-N 3.49Å; E252-Q254 PolarHBondContact O-N 2.92Å; Q254-C279 PolarHBondContact O-N 3.08Å; Q254-E280 PolarHBondContact O-N 2.99Å
255	C	93.7	Very high	79.6	Confident	36 Å²	36	44.3 Å²	44.3	24%	0.243	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126	179.2	-56.3	0	0	0	0	110.9	K159 H160 L161 E280	K159-C255 PolarHBondContact O-N 2.88Å; H160-C255 WeakPolarHBondContact ND1-CB 3.25Å; H160-C255 PolarHBondContact ND1-SG 3.24Å; L161-C255 PolarHBondContact N-O 3Å; C255-E280 WeakPolarHBondContact CA-O 3.35Å
256	L	94.2	Very high	81	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	114.5	173.5	177.9	54.1	0	0	0	109.3	F149 L161 L163 I171 L253 L258 F275 L278 E280 L281 D282	F149-L256 HydrophobicContact CE1-CD1 4.43Å; F149-L256 HydrophobicContact CE1-CD2 4.4Å; L161-L256 HydrophobicContact CB-CD1 4.24Å; L161-L256 HydrophobicContact CD2-CD1 3.92Å; L161-L256 HydrophobicContact CG-CD1 4.02Å; L163-L256 HydrophobicContact CD1-CD1 4.37Å; I171-L256 HydrophobicContact CD1-CD2 4.09Å; L253-L256 HydrophobicContact CD2-CB 4.25Å; L253-L256 HydrophobicContact CD2-CD2 4.45Å; L256-L258 HydrophobicContact CD1-CD1 4.45Å; L256-L258 HydrophobicContact CD1-CD2 4.29Å; L256-L258 HydrophobicContact CD1-CG 4.06Å; L256-L258 HydrophobicContact CD2-CD1 3.93Å; L256-L258 HydrophobicContact CD2-CG 4.42Å; L256-L258 HydrophobicContact CG-CD1 4.02Å; L256-L258 HydrophobicContact CG-CG 3.98Å; L256-F275 HydrophobicContact CD2-CE2 3.99Å; L256-L278 HydrophobicContact CB-CD1 3.86Å; L256-E280 PolarHBondContact N-O 3.08Å; L256-L281 HydrophobicContact CB-CD1 4.09Å; L256-L281 HydrophobicContact CD2-CD1 4.02Å; L256-L281 HydrophobicContact CG-CD1 3.98Å; L256-L281 WeakPolarHBondContact O-CA 3.42Å; L256-D282 PolarHBondContact O-N 2.79Å
257	N	92.4	Very high	82.5	Confident	31 Å²	31	34.3 Å²	34.3	17%	0.166	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.6	172	-178.2	7.1	0	0	0	109.6	L161 N162 L163 E164 A259 D282	L161-N257 PolarHBondContact O-N 3.03Å; N162-N257 VanDerWaalsContact OD1-CB 3.29Å; N162-N257 WeakPolarHBondContact OD1-CB 3.36Å; N162-N257 VanDerWaalsContact OD1-CG 3.24Å; N162-N257 PolarHBondContact OD1-ND2 3.08Å; L163-N257 CarbonylContact C-O 3.19Å; L163-N257 WeakPolarHBondContact CA-O 2.98Å; L163-N257 PolarHBondContact N-O 2.99Å; E164-N257 PolarHBondContact OE2-ND2 3.15Å; N257-A259 VanDerWaalsContact OD1-CB 3.22Å; N257-A259 WeakPolarHBondContact OD1-CB 3.48Å; N257-A259 PolarHBondContact OD1-N 3.07Å; N257-D282 HydrophobicContact CB-CB 4.35Å; N257-D282 WeakPolarHBondContact OD1-CB 3.3Å
258	L	92	Very high	83.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.178	C	C	.	.			trans	-123.8	24.8	175.4	-67.2	168.7	0	0	0	110.7	F149 L163 I168 I171 L256 N261 I263 L281 D282 N286	F149-L258 HydrophobicContact CZ-CD1 4.39Å; F149-L258 HydrophobicContact CZ-CD2 3.98Å; L163-L258 HydrophobicContact CB-CD2 3.88Å; L163-L258 HydrophobicContact CD1-CD2 4.12Å; I168-L258 HydrophobicContact CD1-CD2 3.64Å; I168-L258 HydrophobicContact CG2-CD2 4.35Å; I171-L258 HydrophobicContact CD1-CD1 3.77Å; I171-L258 HydrophobicContact CG1-CD1 3.9Å; L256-L258 HydrophobicContact CD1-CD1 4.45Å; L256-L258 HydrophobicContact CD1-CD2 4.29Å; L256-L258 HydrophobicContact CD1-CG 4.06Å; L256-L258 HydrophobicContact CD2-CD1 3.93Å; L256-L258 HydrophobicContact CD2-CG 4.42Å; L256-L258 HydrophobicContact CG-CD1 4.02Å; L256-L258 HydrophobicContact CG-CG 3.98Å; L258-N261 PolarHBondContact O-ND2 2.91Å; L258-I263 HydrophobicContact CB-CD1 4Å; L258-I263 HydrophobicContact CD1-CD1 4.16Å; L258-L281 HydrophobicContact CD1-CD1 4.29Å; L258-D282 CarbonylContact C-O 3.54Å; L258-D282 WeakPolarHBondContact CA-O 3.49Å; L258-D282 WeakPolarHBondContact CB-O 3.44Å; L258-D282 PolarHBondContact N-O 2.94Å; L258-N286 PolarHBondContact O-ND2 3.37Å
259	A	87.9	Confident	85.1	Confident	5 Å²	5	32.4 Å²	32.4	4%	0.041	18%	0.176	C	C	.	.			trans	-61.8	154	179.6	0	0	0	0	0	111.8	E164 D165 N257 N261 G284	E164-A259 VanDerWaalsContact CA-O 3.24Å; E164-A259 WeakPolarHBondContact CA-O 3.36Å; E164-A259 HydrophobicContact CB-CB 4.49Å; E164-A259 HydrophobicContact CG-CB 4.04Å; D165-A259 PolarHBondContact N-O 2.82Å; D165-A259 VanDerWaalsContact N-O 3.13Å; N257-A259 VanDerWaalsContact OD1-CB 3.22Å; N257-A259 WeakPolarHBondContact OD1-CB 3.48Å; N257-A259 PolarHBondContact OD1-N 3.07Å; A259-N261 PolarHBondContact O-N 2.96Å; A259-N261 PolarHBondContact O-ND2 2.81Å; A259-G284 CarbonylContact C-O 3.58Å; A259-G284 WeakPolarHBondContact CA-O 3.46Å
260	N	89.4	Confident	85.6	Confident	56 Å²	56	28.1 Å²	28.1	30%	0.299	16%	0.157	S	C	.	.	S	Bend	trans	49.3	50.6	177.8	-155.8	28.6	0	0	0	114.4	D165 G284 C285	D165-N260 WeakPolarHBondContact CA-O 3.47Å; D165-N260 PolarHBondContact OD1-ND2 3.31Å; D165-N260 WeakPolarHBondContact OD2-CB 3.33Å; D165-N260 PolarHBondContact OD2-ND2 3.05Å; N260-G284 PolarHBondContact N-O 3.48Å; N260-C285 HydrophobicContact CB-CB 3.97Å
261	N	90.9	Very high	85.4	Confident	9 Å²	9	28.2 Å²	28.2	5%	0.048	16%	0.158	C	C	.	.	S	Bend	trans	-119.6	-175.2	176	-87.7	-95.1	0	0	0	110.4	L163 N166 I168 L258 A259 I263 N286 P287	L163-N261 PolarHBondContact O-ND2 2.98Å; N166-N261 WeakPolarHBondContact CA-OD1 3.31Å; N166-N261 VanDerWaalsContact CB-OD1 3.31Å; N166-N261 WeakPolarHBondContact CB-OD1 3.49Å; N166-N261 PolarHBondContact O-OD1 3.23Å; I168-N261 HydrophobicContact CB-CB 4.35Å; I168-N261 WeakPolarHBondContact CB-OD1 3.42Å; I168-N261 WeakPolarHBondContact CG1-OD1 3.4Å; I168-N261 PolarHBondContact N-OD1 3.25Å; L258-N261 PolarHBondContact O-ND2 2.91Å; A259-N261 PolarHBondContact O-N 2.96Å; A259-N261 PolarHBondContact O-ND2 2.81Å; N261-I263 HydrophobicContact CB-CG1 4.42Å; N261-I263 PolarHBondContact O-N 3.06Å; N261-N286 WeakPolarHBondContact CA-OD1 3.28Å; N261-N286 VanDerWaalsContact CB-OD1 3.25Å; N261-N286 WeakPolarHBondContact CB-OD1 3.45Å; N261-N286 PolarHBondContact N-OD1 2.88Å; N261-N286 PolarHBondContact O-OD1 3.12Å; N261-P287 VanDerWaalsContact O-CD 3.28Å; N261-P287 WeakPolarHBondContact O-CD 3.14Å
262	E	87.8	Confident	85.5	Confident	103 Å²	103	27.1 Å²	27.1	48%	0.481	15%	0.151	S	C	.	.			trans	-93.9	23	-174.3	-64.3	-178.8	-147.9	0	0	113.5	C167 I168 T169 A264	C167-E262 PolarHBondContact SG-OE1 3.02Å; I168-E262 CarbonylContact O-C 3.51Å; I168-E262 WeakPolarHBondContact O-CA 3.18Å; I168-E262 PolarHBondContact O-N 3.07Å; T169-E262 HydrophobicContact CG2-CB 4.05Å; E262-A264 PolarHBondContact O-N 3.4Å; E262-A264 VanDerWaalsContact O-N 3.09Å
263	I	85.2	Confident	85	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.138	C	C	.	.			trans	-69.8	109.4	-175	-57	171.8	0	0	0	110.8	I168 L258 N261 A268 V269 N286 P287 V288	I168-I263 PolarHBondContact O-N 2.91Å; L258-I263 HydrophobicContact CB-CD1 4Å; L258-I263 HydrophobicContact CD1-CD1 4.16Å; N261-I263 HydrophobicContact CB-CG1 4.42Å; N261-I263 PolarHBondContact O-N 3.06Å; I263-A268 HydrophobicContact CG2-CB 4.09Å; I263-V269 HydrophobicContact CD1-CG2 4.25Å; I263-V269 HydrophobicContact CG2-CG2 3.45Å; I263-V269 VanDerWaalsContact CG2-CG2 3.45Å; I263-N286 HydrophobicContact CB-CB 4.08Å; I263-N286 WeakPolarHBondContact CB-OD1 3.18Å; I263-N286 WeakPolarHBondContact CG1-OD1 3.27Å; I263-N286 PolarHBondContact N-OD1 3.38Å; I263-N286 VanDerWaalsContact N-OD1 3.11Å; I263-P287 WeakPolarHBondContact O-CD 3.3Å; I263-V288 HydrophobicContact CB-CG1 4.4Å; I263-V288 HydrophobicContact CG2-CB 4.48Å; I263-V288 HydrophobicContact CG2-CG1 3.97Å; I263-V288 WeakPolarHBondContact O-CB 3.33Å; I263-V288 PolarHBondContact O-N 2.93Å
264	A	80.6	Confident	84.4	Confident	53 Å²	53	26.5 Å²	26.5	44%	0.438	15%	0.15	S	C	.	.			trans	-95.4	-19.6	-170.6	0	0	0	0	0	115.5	E262	E262-A264 PolarHBondContact O-N 3.4Å; E262-A264 VanDerWaalsContact O-N 3.09Å
265	S	78.1	Confident	84.1	Confident	45 Å²	45	23.6 Å²	23.6	32%	0.315	14%	0.136	S	C	.	.			trans	-137.3	171.2	-174.5	76.2	0	0	0	0	111.9	E267 A268	S265-E267 VanDerWaalsContact CB-OE2 3.31Å; S265-E267 WeakPolarHBondContact CB-OE2 3.49Å; S265-A268 WeakPolarHBondContact OG-CB 3.39Å; S265-A268 PolarHBondContact OG-N 3.25Å
266	E	75.9	Confident	83.4	Confident	20 Å²	20	24.2 Å²	24.2	9%	0.093	14%	0.14	C	C	.	.	S	Bend	trans	-86.6	-31.7	178.4	-60.4	-152.3	127.4	0	0	111.7	A268 V269 A270 V288 S298 L300 R314	E266-A268 PolarHBondContact O-N 2.98Å; E266-V269 PolarHBondContact O-N 3.46Å; E266-A270 PolarHBondContact O-N 3.07Å; E266-V288 HydrophobicContact CG-CG2 3.74Å; E266-S298 VanDerWaalsContact CD-CB 3.48Å; E266-S298 VanDerWaalsContact CD-OG 3.29Å; E266-S298 WeakPolarHBondContact OE1-CB 3.35Å; E266-S298 PolarHBondContact OE1-OG 2.69Å; E266-S298 VanDerWaalsContact OE2-CB 3.25Å; E266-S298 WeakPolarHBondContact OE2-CB 3.38Å; E266-S298 PolarHBondContact OE2-OG 2.97Å; E266-L300 HydrophobicContact CB-CB 3.98Å; E266-L300 HydrophobicContact CB-CD2 3.99Å; E266-L300 HydrophobicContact CB-CG 4.47Å; E266-L300 HydrophobicContact CG-CB 4.43Å; E266-L300 HydrophobicContact CG-CD2 4.46Å; E266-R314 IonicContact OE1-NH1 3.89Å; E266-R314 IonicContact OE1-NH2 3.62Å
267	E	75.6	Confident	83	Confident	68 Å²	68	28.8 Å²	28.8	32%	0.318	16%	0.159	S	C	.	.	H	α-helix	trans	-56.8	-38.7	173.4	-61.7	81.6	175.3	0	0	111	R228 M231 S265 V269 A270	R228-E267 IonicContact CZ-OE1 3.13Å; R228-E267 IonicContact NE-OE1 2.72Å; R228-E267 PolarHBondContact NE-OE1 3.27Å; R228-E267 IonicContact NH2-OE1 2.71Å; R228-E267 PolarHBondContact NH2-OE1 3.29Å; R228-E267 IonicContact NH2-OE2 3.07Å; R228-E267 PolarHBondContact NH2-OE2 3.13Å; M231-E267 HydrophobicContact CE-CB 4.33Å; M231-E267 HydrophobicContact CE-CG 4.07Å; M231-E267 HydrophobicContact SD-CB 4.49Å; S265-E267 VanDerWaalsContact CB-OE2 3.31Å; S265-E267 WeakPolarHBondContact CB-OE2 3.49Å; E267-V269 PolarHBondContact O-N 3.39Å; E267-A270 WeakPolarHBondContact O-CB 3.3Å; E267-A270 PolarHBondContact O-N 2.66Å; E267-A270 VanDerWaalsContact O-N 3.08Å
268	A	81.3	Confident	82.7	Confident	11 Å²	11	27.8 Å²	27.8	9%	0.091	15%	0.154	C	C	.	.	H	α-helix	trans	-59.8	-16	175.3	0	0	0	0	0	114.4	T169 E170 I171 I263 S265 E266	T169-A268 WeakPolarHBondContact O-CB 3.46Å; E170-A268 CarbonylContact C-O 3.52Å; E170-A268 WeakPolarHBondContact CA-O 3.49Å; E170-A268 HydrophobicContact CB-CB 3.75Å; I171-A268 PolarHBondContact N-O 2.99Å; I263-A268 HydrophobicContact CG2-CB 4.09Å; S265-A268 WeakPolarHBondContact OG-CB 3.39Å; S265-A268 PolarHBondContact OG-N 3.25Å; E266-A268 PolarHBondContact O-N 2.98Å
269	V	83.1	Confident	82.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-112.9	-8.4	179.1	-168.8	0	0	0	0	111.8	I171 I263 E266 E267 A271 A272 L281 I283 L300	I171-V269 HydrophobicContact CD1-CG1 4.15Å; I263-V269 HydrophobicContact CD1-CG2 4.25Å; I263-V269 HydrophobicContact CG2-CG2 3.45Å; I263-V269 VanDerWaalsContact CG2-CG2 3.45Å; E266-V269 PolarHBondContact O-N 3.46Å; E267-V269 PolarHBondContact O-N 3.39Å; V269-A271 PolarHBondContact O-N 3.27Å; V269-A271 VanDerWaalsContact O-N 3.15Å; V269-A272 HydrophobicContact CG1-CB 4.34Å; V269-A272 WeakPolarHBondContact O-CB 3.4Å; V269-A272 PolarHBondContact O-N 2.79Å; V269-L281 HydrophobicContact CG1-CD2 3.73Å; V269-I283 HydrophobicContact CG1-CG2 4.21Å; V269-L300 HydrophobicContact CB-CD2 3.95Å; V269-L300 HydrophobicContact CG1-CD2 4.31Å
270	A	76.7	Confident	82.6	Confident	2 Å²	2	33.4 Å²	33.4	2%	0.017	19%	0.187	C	C	.	.	H	α-helix	trans	-58.6	-33.2	-176.1	0	0	0	0	0	112.7	M231 L235 E266 E267 A272 A273 L300	M231-A270 HydrophobicContact CE-CB 3.6Å; M231-A270 HydrophobicContact SD-CB 4.14Å; L235-A270 HydrophobicContact CD1-CB 3.74Å; E266-A270 PolarHBondContact O-N 3.07Å; E267-A270 WeakPolarHBondContact O-CB 3.3Å; E267-A270 PolarHBondContact O-N 2.66Å; E267-A270 VanDerWaalsContact O-N 3.08Å; A270-A272 PolarHBondContact O-N 3.3Å; A270-A273 VanDerWaalsContact O-CB 3.3Å; A270-A273 WeakPolarHBondContact O-CB 3.49Å; A270-A273 PolarHBondContact O-N 3.08Å; A270-L300 HydrophobicContact CB-CD1 4.33Å
271	A	79.1	Confident	82.7	Confident	3 Å²	3	30.8 Å²	30.8	3%	0.025	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-58.6	-17.2	174.2	0	0	0	0	0	114.3	I171 C173 V269 A273 L274	I171-A271 HydrophobicContact CB-CB 4.01Å; I171-A271 HydrophobicContact CG2-CB 3.78Å; I171-A271 WeakPolarHBondContact O-CB 3.24Å; C173-A271 HydrophobicContact CB-CB 3.74Å; V269-A271 PolarHBondContact O-N 3.27Å; V269-A271 VanDerWaalsContact O-N 3.15Å; A271-A273 PolarHBondContact O-N 3.28Å; A271-A273 VanDerWaalsContact O-N 3.16Å; A271-L274 HydrophobicContact CB-CD1 4.47Å; A271-L274 VanDerWaalsContact O-CB 3.32Å; A271-L274 WeakPolarHBondContact O-CB 3.38Å; A271-L274 WeakPolarHBondContact O-CG 3.49Å; A271-L274 PolarHBondContact O-N 3.11Å
272	A	82.9	Confident	82.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-57.9	-25.3	171.4	0	0	0	0	0	113	I171 V269 A270 L274 F275 L278 L281 L304	I171-A272 HydrophobicContact CD1-CB 3.82Å; V269-A272 HydrophobicContact CG1-CB 4.34Å; V269-A272 WeakPolarHBondContact O-CB 3.4Å; V269-A272 PolarHBondContact O-N 2.79Å; A270-A272 PolarHBondContact O-N 3.3Å; A272-L274 PolarHBondContact O-N 2.99Å; A272-F275 HydrophobicContact CB-CD2 4.4Å; A272-F275 WeakPolarHBondContact O-CD2 3.34Å; A272-F275 PolarHBondContact O-N 2.9Å; A272-L278 HydrophobicContact CB-CD2 4.15Å; A272-L281 HydrophobicContact CB-CD2 3.97Å; A272-L304 HydrophobicContact CB-CD1 4.42Å
273	A	76.9	Confident	82.5	Confident	2 Å²	2	26.8 Å²	26.8	2%	0.017	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-62.2	-21.6	174.4	0	0	0	0	0	113.9	A270 A271 F275 F303 L304 L308	A270-A273 VanDerWaalsContact O-CB 3.3Å; A270-A273 WeakPolarHBondContact O-CB 3.49Å; A270-A273 PolarHBondContact O-N 3.08Å; A271-A273 PolarHBondContact O-N 3.28Å; A271-A273 VanDerWaalsContact O-N 3.16Å; A273-F275 VanDerWaalsContact C-N 3.28Å; A273-F275 PolarHBondContact O-N 3.16Å; A273-F303 HydrophobicContact CB-CE1 3.71Å; A273-L304 HydrophobicContact CB-CD2 3.92Å; A273-L308 HydrophobicContact CB-CD1 3.61Å
274	L	77.7	Confident	82.5	Confident	45 Å²	45	26.9 Å²	26.9	24%	0.236	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-75.4	-15.8	179.1	-60	174.9	0	0	0	112.8	L235 F238 A271 A272 P276	L235-L274 HydrophobicContact CD2-CD1 4.18Å; L235-L274 HydrophobicContact CD2-CD2 3.78Å; L235-L274 HydrophobicContact CD2-CG 3.91Å; F238-L274 HydrophobicContact CB-CD2 3.99Å; A271-L274 HydrophobicContact CB-CD1 4.47Å; A271-L274 VanDerWaalsContact O-CB 3.32Å; A271-L274 WeakPolarHBondContact O-CB 3.38Å; A271-L274 WeakPolarHBondContact O-CG 3.49Å; A271-L274 PolarHBondContact O-N 3.11Å; A272-L274 PolarHBondContact O-N 2.99Å; L274-P276 WeakPolarHBondContact O-CD 3.49Å
275	F	84.5	Confident	82.5	Confident	4 Å²	4	26.1 Å²	26.1	2%	0.018	15%	0.147	C	C	.	.			trans	-79.7	110.4	175.7	-58.8	-54.5	0	0	0	109.7	I171 V248 L250 L253 L256 A272 A273 K277 L278	I171-F275 HydrophobicContact CG2-CE2 4.11Å; I171-F275 HydrophobicContact CG2-CZ 4.16Å; V248-F275 HydrophobicContact CG1-CE1 4.25Å; V248-F275 WeakPolarHBondContact O-CE1 3.42Å; L250-F275 HydrophobicContact CB-CD1 3.92Å; L250-F275 HydrophobicContact CB-CE1 3.94Å; L250-F275 HydrophobicContact CD1-CE1 4.07Å; L250-F275 HydrophobicContact CG-CE1 4.2Å; L253-F275 HydrophobicContact CD2-CD1 4.25Å; L253-F275 HydrophobicContact CD2-CD2 4.23Å; L253-F275 HydrophobicContact CD2-CE1 4.45Å; L253-F275 HydrophobicContact CD2-CE2 4.41Å; L253-F275 HydrophobicContact CD2-CG 4.15Å; L256-F275 HydrophobicContact CD2-CE2 3.99Å; A272-F275 HydrophobicContact CB-CD2 4.4Å; A272-F275 WeakPolarHBondContact O-CD2 3.34Å; A272-F275 PolarHBondContact O-N 2.9Å; A273-F275 VanDerWaalsContact C-N 3.28Å; A273-F275 PolarHBondContact O-N 3.16Å; F275-K277 VanDerWaalsContact C-N 3.33Å; F275-K277 PolarHBondContact O-N 3.41Å; F275-L278 HydrophobicContact CB-CB 3.84Å; F275-L278 HydrophobicContact CB-CD2 4.47Å; F275-L278 HydrophobicContact CD2-CD2 4.14Å; F275-L278 PolarHBondContact O-N 3.27Å
276	P	80.1	Confident	82.8	Confident	50 Å²	50	24 Å²	24	33%	0.325	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-29.5	-164.4	26.9	-34.7	0	0	0	113.3	R239 L274	R239-P276 PolarHBondContact NH2-O 3.13Å; L274-P276 WeakPolarHBondContact O-CD 3.49Å
277	K	85.1	Confident	83	Confident	97 Å²	97	25.4 Å²	25.4	42%	0.422	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	9.4	-176.4	-71.7	-176.4	171.8	173.2	0	114.5	P251 E252 L253 F275 C279	P251-K277 WeakPolarHBondContact O-CD 3.38Å; P251-K277 WeakPolarHBondContact O-CG 3.49Å; E252-K277 IonicContact OE1-NZ 3.79Å; E252-K277 PolarHBondContact OE1-NZ 3.05Å; E252-K277 WeakPolarHBondContact OE2-CD 3.21Å; E252-K277 IonicContact OE2-NZ 2.65Å; E252-K277 PolarHBondContact OE2-NZ 3.45Å; L253-K277 CarbonylContact O-C 3.49Å; F275-K277 VanDerWaalsContact C-N 3.33Å; F275-K277 PolarHBondContact O-N 3.41Å; K277-C279 PolarHBondContact O-N 3.42Å; K277-C279 PolarHBondContact O-SG 2.93Å
278	L	86.8	Confident	83.1	Confident	11 Å²	11	22.6 Å²	22.6	6%	0.058	13%	0.131	C	C	.	.			trans	-65.1	125.3	-176.7	-170	68.5	0	0	0	110.2	L253 L256 A272 F275 E280 L281 I310	L253-L278 HydrophobicContact CD2-CD1 4.22Å; L253-L278 HydrophobicContact CG-CD1 4.18Å; L253-L278 VanDerWaalsContact O-CA 3.22Å; L253-L278 WeakPolarHBondContact O-CA 3.38Å; L253-L278 PolarHBondContact O-N 3.09Å; L256-L278 HydrophobicContact CB-CD1 3.86Å; A272-L278 HydrophobicContact CB-CD2 4.15Å; F275-L278 HydrophobicContact CB-CB 3.84Å; F275-L278 HydrophobicContact CB-CD2 4.47Å; F275-L278 HydrophobicContact CD2-CD2 4.14Å; F275-L278 PolarHBondContact O-N 3.27Å; L278-E280 WeakPolarHBondContact CD1-O 3.29Å; L278-L281 HydrophobicContact CD2-CB 4.36Å; L278-I310 HydrophobicContact CB-CD1 4.43Å; L278-I310 HydrophobicContact CD2-CD1 4.3Å; L278-I310 HydrophobicContact CD2-CG2 4.28Å; L278-I310 HydrophobicContact CG-CG2 4.22Å
279	C	88.1	Confident	82.7	Confident	78 Å²	78	22.4 Å²	22.4	53%	0.527	13%	0.128	S	C	.	.			trans	-113.8	-31.8	-179	-64.5	0	0	0	0	112.2	Q254 K277 K311	Q254-C279 PolarHBondContact O-N 3.08Å; K277-C279 PolarHBondContact O-N 3.42Å; K277-C279 PolarHBondContact O-SG 2.93Å; C279-K311 WeakPolarHBondContact O-CB 3.5Å; C279-K311 PolarHBondContact O-N 2.63Å
280	E	89.8	Confident	81.7	Confident	45 Å²	45	25.3 Å²	25.3	21%	0.21	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.4	-180	-167.9	167.7	104.3	0	0	111.3	Q254 C255 L256 L278 K311 K313	Q254-E280 PolarHBondContact O-N 2.99Å; C255-E280 WeakPolarHBondContact CA-O 3.35Å; L256-E280 PolarHBondContact N-O 3.08Å; L278-E280 WeakPolarHBondContact CD1-O 3.29Å; E280-K311 WeakPolarHBondContact CA-O 3.31Å; E280-K311 WeakPolarHBondContact OE2-CD 3.39Å; E280-K311 WeakPolarHBondContact OE2-CE 3.24Å; E280-K311 IonicContact OE2-NZ 2.78Å; E280-K311 PolarHBondContact OE2-NZ 2.8Å; E280-K313 VanDerWaalsContact CD-CE 3.46Å; E280-K313 WeakPolarHBondContact OE1-CE 3.32Å; E280-K313 IonicContact OE1-NZ 2.65Å; E280-K313 PolarHBondContact OE1-NZ 3.24Å; E280-K313 IonicContact OE2-NZ 3.88Å
281	L	90.3	Very high	80.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	116.2	178.5	175.6	61	0	0	0	108.9	L256 L258 V269 A272 L278 I283 L304 I310 K311 I312 K313	L256-L281 HydrophobicContact CB-CD1 4.09Å; L256-L281 HydrophobicContact CD2-CD1 4.02Å; L256-L281 HydrophobicContact CG-CD1 3.98Å; L256-L281 WeakPolarHBondContact O-CA 3.42Å; L258-L281 HydrophobicContact CD1-CD1 4.29Å; V269-L281 HydrophobicContact CG1-CD2 3.73Å; A272-L281 HydrophobicContact CB-CD2 3.97Å; L278-L281 HydrophobicContact CD2-CB 4.36Å; L281-I283 HydrophobicContact CD1-CG2 4.25Å; L281-I283 HydrophobicContact CG-CG2 4.14Å; L281-L304 HydrophobicContact CD2-CD1 3.87Å; L281-I310 HydrophobicContact CB-CG2 3.94Å; L281-K311 PolarHBondContact N-O 3.27Å; L281-I312 CarbonylContact O-C 3.6Å; L281-I312 VanDerWaalsContact O-CA 3.28Å; L281-I312 WeakPolarHBondContact O-CA 3.24Å; L281-K313 PolarHBondContact O-N 3.15Å
282	D	88.8	Confident	79.8	Confident	27 Å²	27	35.8 Å²	35.8	14%	0.144	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.4	172	-151.2	-31.7	0	0	0	110.5	L256 N257 L258 G284 K313	L256-D282 PolarHBondContact O-N 2.79Å; N257-D282 HydrophobicContact CB-CB 4.35Å; N257-D282 WeakPolarHBondContact OD1-CB 3.3Å; L258-D282 CarbonylContact C-O 3.54Å; L258-D282 WeakPolarHBondContact CA-O 3.49Å; L258-D282 WeakPolarHBondContact CB-O 3.44Å; L258-D282 PolarHBondContact N-O 2.94Å; D282-G284 PolarHBondContact OD1-N 3.36Å; D282-K313 HydrophobicContact CB-CB 4.07Å; D282-K313 HydrophobicContact CB-CD 4.22Å; D282-K313 WeakPolarHBondContact OD1-CB 3.46Å; D282-K313 WeakPolarHBondContact OD2-CB 3.45Å; D282-K313 WeakPolarHBondContact OD2-CD 3.33Å
283	I	87.1	Confident	78.4	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.221	C	C	.	.			trans	-126.3	19.6	173.5	58.6	172	0	0	0	110.9	V269 L281 N286 T289 I312 K313 R314	V269-I283 HydrophobicContact CG1-CG2 4.21Å; L281-I283 HydrophobicContact CD1-CG2 4.25Å; L281-I283 HydrophobicContact CG-CG2 4.14Å; I283-N286 WeakPolarHBondContact O-CB 3.23Å; I283-N286 PolarHBondContact O-ND2 3.41Å; I283-N286 VanDerWaalsContact O-ND2 3.11Å; I283-T289 HydrophobicContact CD1-CG2 4.4Å; I283-T289 HydrophobicContact CG1-CG2 4.15Å; I283-T289 WeakPolarHBondContact O-CG2 3.44Å; I283-I312 HydrophobicContact CD1-CG2 3.89Å; I283-I312 HydrophobicContact CG1-CG2 3.83Å; I283-K313 WeakPolarHBondContact CG1-O 3.49Å; I283-K313 PolarHBondContact N-O 3.48Å; I283-R314 HydrophobicContact CD1-CG 4.16Å; I283-R314 HydrophobicContact CG1-CG 4.04Å
284	G	83.8	Confident	76.9	Confident	2 Å²	2	47 Å²	47	2%	0.021	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50	154.3	177.3	0	0	0	0	0	113.2	A259 N260 D282 N286 K315	A259-G284 CarbonylContact C-O 3.58Å; A259-G284 WeakPolarHBondContact CA-O 3.46Å; N260-G284 PolarHBondContact N-O 3.48Å; D282-G284 PolarHBondContact OD1-N 3.36Å; G284-N286 PolarHBondContact O-N 2.92Å; G284-N286 PolarHBondContact O-ND2 3.09Å; G284-K315 CarbonylContact C-O 3.53Å; G284-K315 WeakPolarHBondContact CA-O 3.38Å
285	C	81.9	Confident	75.2	Confident	37 Å²	37	48.5 Å²	48.5	25%	0.25	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	3.8	176.3	-46.9	0	0	0	0	116.9	N260 K315 H317	N260-C285 HydrophobicContact CB-CB 3.97Å; C285-K315 PolarHBondContact N-O 2.73Å; C285-K315 VanDerWaalsContact N-O 3.14Å; C285-H317 VanDerWaalsContact SG-CB 3.6Å; C285-H317 PolarHBondContact SG-N 3.07Å
286	N	83.9	Confident	73.6	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	32%	0.317	C	S	.	.	S	Bend	trans	-81.8	153.2	177.8	-78.4	-99.5	0	0	0	112.2	L258 N261 I263 I283 G284 V288 T289 A290	L258-N286 PolarHBondContact O-ND2 3.37Å; N261-N286 WeakPolarHBondContact CA-OD1 3.28Å; N261-N286 VanDerWaalsContact CB-OD1 3.25Å; N261-N286 WeakPolarHBondContact CB-OD1 3.45Å; N261-N286 PolarHBondContact N-OD1 2.88Å; N261-N286 PolarHBondContact O-OD1 3.12Å; I263-N286 HydrophobicContact CB-CB 4.08Å; I263-N286 WeakPolarHBondContact CB-OD1 3.18Å; I263-N286 WeakPolarHBondContact CG1-OD1 3.27Å; I263-N286 PolarHBondContact N-OD1 3.38Å; I263-N286 VanDerWaalsContact N-OD1 3.11Å; I283-N286 WeakPolarHBondContact O-CB 3.23Å; I283-N286 PolarHBondContact O-ND2 3.41Å; I283-N286 VanDerWaalsContact O-ND2 3.11Å; G284-N286 PolarHBondContact O-N 2.92Å; G284-N286 PolarHBondContact O-ND2 3.09Å; N286-V288 HydrophobicContact CB-CG1 3.93Å; N286-V288 PolarHBondContact O-N 3.42Å; N286-V288 VanDerWaalsContact O-N 3.11Å; N286-T289 PolarHBondContact N-OG1 2.71Å; N286-T289 PolarHBondContact O-N 3.26Å; N286-T289 PolarHBondContact O-OG1 3.47Å; N286-A290 PolarHBondContact O-N 2.65Å
287	P	80.6	Confident	72.3	Confident	50 Å²	50	57.6 Å²	57.6	33%	0.325	34%	0.336	S	S	.	.	H	α-helix	trans	-53.7	-31.8	176.6	-25.8	31.9	0	0	0	114.8	N261 I263 T289 A290 R291	N261-P287 VanDerWaalsContact O-CD 3.28Å; N261-P287 WeakPolarHBondContact O-CD 3.14Å; I263-P287 WeakPolarHBondContact O-CD 3.3Å; P287-T289 VanDerWaalsContact C-N 3.35Å; P287-T289 PolarHBondContact O-N 3.1Å; P287-A290 WeakPolarHBondContact O-CB 3.32Å; P287-A290 PolarHBondContact O-N 3.34Å; P287-R291 WeakPolarHBondContact O-CG 3.31Å; P287-R291 PolarHBondContact O-N 3.4Å
288	V	77.2	Confident	71.4	Confident	8 Å²	8	53.8 Å²	53.8	5%	0.048	32%	0.321	C	S	.	.	H	α-helix	trans	-59.3	-42.8	172.6	66.4	0	0	0	0	111.9	I263 E266 N286 A290 R291 S292	I263-V288 HydrophobicContact CB-CG1 4.4Å; I263-V288 HydrophobicContact CG2-CB 4.48Å; I263-V288 HydrophobicContact CG2-CG1 3.97Å; I263-V288 WeakPolarHBondContact O-CB 3.33Å; I263-V288 PolarHBondContact O-N 2.93Å; E266-V288 HydrophobicContact CG-CG2 3.74Å; N286-V288 HydrophobicContact CB-CG1 3.93Å; N286-V288 PolarHBondContact O-N 3.42Å; N286-V288 VanDerWaalsContact O-N 3.11Å; V288-A290 VanDerWaalsContact C-N 3.35Å; V288-R291 PolarHBondContact O-N 2.99Å; V288-S292 PolarHBondContact O-N 3.28Å; V288-S292 PolarHBondContact O-OG 3.26Å; V288-S292 VanDerWaalsContact O-OG 3.1Å
289	T	72.4	Confident	70.3	Confident	7 Å²	7	56 Å²	56	4%	0.043	33%	0.333	C	S	.	.	H	α-helix	trans	-71	-30.4	176.6	69.9	0	0	0	0	112.4	I283 N286 P287 R291 R314 K316	I283-T289 HydrophobicContact CD1-CG2 4.4Å; I283-T289 HydrophobicContact CG1-CG2 4.15Å; I283-T289 WeakPolarHBondContact O-CG2 3.44Å; N286-T289 PolarHBondContact N-OG1 2.71Å; N286-T289 PolarHBondContact O-N 3.26Å; N286-T289 PolarHBondContact O-OG1 3.47Å; P287-T289 VanDerWaalsContact C-N 3.35Å; P287-T289 PolarHBondContact O-N 3.1Å; T289-R291 VanDerWaalsContact C-N 3.3Å; T289-R291 PolarHBondContact O-N 3.07Å; T289-R314 HydrophobicContact CG2-CB 4.2Å; T289-R314 HydrophobicContact CG2-CG 4.42Å; T289-K316 WeakPolarHBondContact O-CE 3.42Å; T289-K316 PolarHBondContact O-NZ 3.03Å
290	A	62.9	Low	69.3	Low	62 Å²	62	52.7 Å²	52.7	51%	0.512	31%	0.31	S	S	.	.	H	α-helix	trans	-60.6	-41.6	174.4	0	0	0	0	0	111.5	N286 P287 V288 K316	N286-A290 PolarHBondContact O-N 2.65Å; P287-A290 WeakPolarHBondContact O-CB 3.32Å; P287-A290 PolarHBondContact O-N 3.34Å; V288-A290 VanDerWaalsContact C-N 3.35Å; A290-K316 PolarHBondContact O-NZ 3.21Å
291	R	58.6	Low	68.3	Low	192 Å²	192	51.5 Å²	51.5	73%	0.725	31%	0.306	S	S	*	.	H	α-helix	trans	-84.1	-20.6	-175.8	-65.5	177.4	-175.4	-168.9	2.3	115.2	P287 V288 T289 N293	P287-R291 WeakPolarHBondContact O-CG 3.31Å; P287-R291 PolarHBondContact O-N 3.4Å; V288-R291 PolarHBondContact O-N 2.99Å; T289-R291 VanDerWaalsContact C-N 3.3Å; T289-R291 PolarHBondContact O-N 3.07Å; R291-N293 PolarHBondContact O-N 3.08Å
292	S	55.9	Low	67.3	Low	33 Å²	33	57.1 Å²	57.1	23%	0.231	33%	0.328	C	S	.	.	S	Bend	trans	-64.8	120.1	174.6	-52.4	0	0	0	0	110.8	V288	V288-S292 PolarHBondContact O-N 3.28Å; V288-S292 PolarHBondContact O-OG 3.26Å; V288-S292 VanDerWaalsContact O-OG 3.1Å
293	N	53.6	Low	66.4	Low	99 Å²	99	56.4 Å²	56.4	53%	0.529	32%	0.323	S	S	.	.			trans	-65	134.7	169.3	-72.5	-48.2	0	0	0	109.7	R291 G295 E296	R291-N293 PolarHBondContact O-N 3.08Å; N293-G295 VanDerWaalsContact C-N 3.29Å; N293-G295 PolarHBondContact O-N 2.98Å; N293-E296 HydrophobicContact CB-CG 4.39Å; N293-E296 PolarHBondContact ND2-OE2 3.21Å; N293-E296 PolarHBondContact O-N 2.99Å
294	P	44.7	Very low	65.9	Low	139 Å²	139	56.3 Å²	56.3	90%	0.903	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	86.4	175.2	29.5	-34	0	0	0	110.1
295	G	43.8	Very low	65.7	Low	75 Å²	75	60.9 Å²	60.9	77%	0.773	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	152.5	-21.9	-176.7	0	0	0	0	0	114.1	N293 T297	N293-G295 VanDerWaalsContact C-N 3.29Å; N293-G295 PolarHBondContact O-N 2.98Å; G295-T297 PolarHBondContact O-N 3.5Å
296	E	50.8	Low	65.3	Low	129 Å²	129	64.8 Å²	64.8	60%	0.603	36%	0.362	S	S	*	.			trans	-86	106.1	171.6	-74.1	175.4	146.4	0	0	109.4	N293 S298	N293-E296 HydrophobicContact CB-CG 4.39Å; N293-E296 PolarHBondContact ND2-OE2 3.21Å; N293-E296 PolarHBondContact O-N 2.99Å; E296-S298 VanDerWaalsContact C-N 3.27Å; E296-S298 PolarHBondContact O-N 3.23Å
297	T	52	Low	64.7	Low	116 Å²	116	70.4 Å²	70.4	71%	0.712	39%	0.386	S	S	*	.			trans	-64.8	92.7	168	-22.3	0	0	0	0	107.7	G295 T301	G295-T297 PolarHBondContact O-N 3.5Å; T297-T301 HydrophobicContact CG2-CG2 4.25Å
298	S	65.6	Low	64.5	Low	18 Å²	18	69.7 Å²	69.7	13%	0.126	38%	0.38	C	S	.	.			trans	-64.7	149.5	-174	75.7	0	0	0	0	110.7	E266 E296 L300 T301 Y302 R314	E266-S298 VanDerWaalsContact CD-CB 3.48Å; E266-S298 VanDerWaalsContact CD-OG 3.29Å; E266-S298 WeakPolarHBondContact OE1-CB 3.35Å; E266-S298 PolarHBondContact OE1-OG 2.69Å; E266-S298 VanDerWaalsContact OE2-CB 3.25Å; E266-S298 WeakPolarHBondContact OE2-CB 3.38Å; E266-S298 PolarHBondContact OE2-OG 2.97Å; E296-S298 VanDerWaalsContact C-N 3.27Å; E296-S298 PolarHBondContact O-N 3.23Å; S298-L300 PolarHBondContact O-N 3.08Å; S298-L300 VanDerWaalsContact O-N 3.12Å; S298-T301 WeakPolarHBondContact O-CA 3.32Å; S298-T301 WeakPolarHBondContact O-CB 3.46Å; S298-T301 PolarHBondContact O-N 2.85Å; S298-T301 PolarHBondContact O-OG1 3.04Å; S298-T301 PolarHBondContact OG-OG1 3.23Å; S298-Y302 PolarHBondContact O-N 2.97Å; S298-Y302 VanDerWaalsContact O-N 3.13Å; S298-R314 PolarHBondContact OG-NH1 3.46Å; S298-R314 PolarHBondContact OG-NH2 3.2Å; S298-R314 VanDerWaalsContact OG-NH2 3.1Å
299	L	64.1	Low	64.6	Low	56 Å²	56	72 Å²	72	29%	0.293	41%	0.406	S	S	.	.	H	α-helix	trans	-58.6	-32.8	-172	-70.5	168.9	0	0	0	111.8	R228 Y302 F303	R228-L299 HydrophobicContact CB-CD1 4.25Å; L299-Y302 PolarHBondContact O-N 2.9Å; L299-F303 WeakPolarHBondContact O-CB 3.4Å; L299-F303 PolarHBondContact O-N 3.27Å
300	L	67.4	Low	65.2	Low	10 Å²	10	71.9 Å²	71.9	5%	0.052	41%	0.405	C	S	.	.	H	α-helix	trans	-64.6	-36.7	171.2	-171.1	77	0	0	0	113.2	E266 V269 A270 S298 L304	E266-L300 HydrophobicContact CB-CB 3.98Å; E266-L300 HydrophobicContact CB-CD2 3.99Å; E266-L300 HydrophobicContact CB-CG 4.47Å; E266-L300 HydrophobicContact CG-CB 4.43Å; E266-L300 HydrophobicContact CG-CD2 4.46Å; V269-L300 HydrophobicContact CB-CD2 3.95Å; V269-L300 HydrophobicContact CG1-CD2 4.31Å; A270-L300 HydrophobicContact CB-CD1 4.33Å; S298-L300 PolarHBondContact O-N 3.08Å; S298-L300 VanDerWaalsContact O-N 3.12Å; L300-L304 HydrophobicContact CD1-CD1 3.69Å; L300-L304 HydrophobicContact CD1-CG 3.88Å; L300-L304 HydrophobicContact CD2-CD1 4.31Å; L300-L304 HydrophobicContact CG-CD1 3.79Å; L300-L304 HydrophobicContact CG-CG 4.11Å; L300-L304 WeakPolarHBondContact O-CB 3.23Å; L300-L304 WeakPolarHBondContact O-CG 3.2Å; L300-L304 PolarHBondContact O-N 2.86Å
301	T	68.1	Low	66.2	Low	20 Å²	20	74.4 Å²	74.4	12%	0.123	40%	0.404	C	S	.	.	H	α-helix	trans	-61.1	-49.9	172.9	-43.7	0	0	0	0	109.9	T297 S298 F303 Q305 R314	T297-T301 HydrophobicContact CG2-CG2 4.25Å; S298-T301 WeakPolarHBondContact O-CA 3.32Å; S298-T301 WeakPolarHBondContact O-CB 3.46Å; S298-T301 PolarHBondContact O-N 2.85Å; S298-T301 PolarHBondContact O-OG1 3.04Å; S298-T301 PolarHBondContact OG-OG1 3.23Å; T301-F303 PolarHBondContact O-N 3Å; T301-Q305 HydrophobicContact CG2-CB 4.42Å; T301-Q305 WeakPolarHBondContact O-CA 3.5Å; T301-Q305 WeakPolarHBondContact O-CB 3.31Å; T301-Q305 PolarHBondContact O-N 2.87Å; T301-R314 PolarHBondContact OG1-NH1 3.32Å; T301-R314 VanDerWaalsContact OG1-NH1 3.12Å; T301-R314 PolarHBondContact OG1-NH2 3.12Å
302	Y	68.9	Low	67.4	Low	117 Å²	117	66.3 Å²	66.3	46%	0.459	38%	0.375	S	S	.	.	I	π-helix	trans	-61.1	-47.8	179.2	176.1	-108.9	0	0	0	111.5	S298 L299 D306 K307	S298-Y302 PolarHBondContact O-N 2.97Å; S298-Y302 VanDerWaalsContact O-N 3.13Å; L299-Y302 PolarHBondContact O-N 2.9Å; Y302-D306 HydrophobicContact CD2-CB 3.76Å; Y302-D306 HydrophobicContact CE2-CB 4.09Å; Y302-D306 VanDerWaalsContact CE2-OD2 3.25Å; Y302-D306 WeakPolarHBondContact CE2-OD2 3.47Å; Y302-D306 WeakPolarHBondContact O-CA 3.46Å; Y302-D306 WeakPolarHBondContact O-CB 3.46Å; Y302-D306 PolarHBondContact O-N 3.08Å; Y302-K307 HydrophobicContact CE1-CG 4.4Å; Y302-K307 PolarHBondContact O-N 3.01Å; Y302-K307 VanDerWaalsContact O-N 3.08Å
303	F	71.1	Confident	68.7	Low	12 Å²	12	68.4 Å²	68.4	5%	0.053	38%	0.38	C	S	.	.	I	π-helix	trans	-69.1	-45.7	-177.9	-172.8	-112.1	0	0	0	113.9	M232 L235 Q236 A273 L299 T301 K307 L308	M232-F303 HydrophobicContact CB-CD1 4.43Å; M232-F303 HydrophobicContact CB-CD2 3.9Å; M232-F303 HydrophobicContact CB-CE1 4.3Å; M232-F303 HydrophobicContact CB-CE2 3.77Å; M232-F303 HydrophobicContact CB-CG 4.23Å; M232-F303 HydrophobicContact CB-CZ 3.98Å; M232-F303 HydrophobicContact CG-CB 4.33Å; M232-F303 HydrophobicContact CG-CD1 3.94Å; M232-F303 HydrophobicContact CG-CD2 4.03Å; M232-F303 HydrophobicContact CG-CE1 4.2Å; M232-F303 HydrophobicContact CG-CE2 4.29Å; M232-F303 HydrophobicContact CG-CG 3.85Å; M232-F303 HydrophobicContact CG-CZ 4.37Å; M232-F303 WeakPolarHBondContact O-CZ 3.4Å; M232-F303 HydrophobicContact SD-CB 3.46Å; M232-F303 WeakPolarHBondContact SD-CB 3.45Å; M232-F303 HydrophobicContact SD-CD1 4.21Å; M232-F303 HydrophobicContact SD-CD2 3.92Å; M232-F303 HydrophobicContact SD-CG 3.62Å; L235-F303 HydrophobicContact CB-CE1 4.46Å; L235-F303 HydrophobicContact CB-CZ 4.45Å; Q236-F303 HydrophobicContact CB-CZ 4.42Å; A273-F303 HydrophobicContact CB-CE1 3.71Å; L299-F303 WeakPolarHBondContact O-CB 3.4Å; L299-F303 PolarHBondContact O-N 3.27Å; T301-F303 PolarHBondContact O-N 3Å; F303-K307 HydrophobicContact CD2-CB 4.37Å; F303-K307 VanDerWaalsContact O-CB 3.27Å; F303-K307 WeakPolarHBondContact O-CB 3.49Å; F303-L308 HydrophobicContact CD1-CD1 4.49Å; F303-L308 HydrophobicContact CE1-CD1 4.21Å; F303-L308 WeakPolarHBondContact O-CG 3.2Å; F303-L308 PolarHBondContact O-N 2.95Å
304	L	76.9	Confident	69.8	Low	0 Å²	0	66.8 Å²	66.8	0%	0	37%	0.366	C	S	.	.	I	π-helix	trans	-78.6	-39.3	-179.6	-59.4	-173.7	0	0	0	112	A272 A273 L281 L300 L308 G309 I310 I312	A272-L304 HydrophobicContact CB-CD1 4.42Å; A273-L304 HydrophobicContact CB-CD2 3.92Å; L281-L304 HydrophobicContact CD2-CD1 3.87Å; L300-L304 HydrophobicContact CD1-CD1 3.69Å; L300-L304 HydrophobicContact CD1-CG 3.88Å; L300-L304 HydrophobicContact CD2-CD1 4.31Å; L300-L304 HydrophobicContact CG-CD1 3.79Å; L300-L304 HydrophobicContact CG-CG 4.11Å; L300-L304 WeakPolarHBondContact O-CB 3.23Å; L300-L304 WeakPolarHBondContact O-CG 3.2Å; L300-L304 PolarHBondContact O-N 2.86Å; L304-L308 HydrophobicContact CD2-CD1 3.9Å; L304-L308 CarbonylContact O-C 3.59Å; L304-L308 WeakPolarHBondContact O-CB 3.37Å; L304-G309 PolarHBondContact O-N 2.9Å; L304-I310 HydrophobicContact CB-CB 4.4Å; L304-I310 HydrophobicContact CB-CD1 4.34Å; L304-I310 HydrophobicContact CD2-CD1 4.26Å; L304-I310 VanDerWaalsContact O-CB 3.28Å; L304-I310 WeakPolarHBondContact O-CB 3.38Å; L304-I310 WeakPolarHBondContact O-CG1 3.23Å; L304-I310 PolarHBondContact O-N 3.44Å; L304-I312 HydrophobicContact CB-CD1 3.94Å; L304-I312 HydrophobicContact CB-CG1 4.45Å; L304-I312 HydrophobicContact CD1-CD1 4.27Å
305	Q	78.6	Confident	70.9	Confident	97 Å²	97	68.5 Å²	68.5	45%	0.453	36%	0.36	S	S	.	.	I	π-helix	trans	-90.3	-45.1	-173.6	-166.3	177.8	-20	0	0	113.8	T301 G309 I310	T301-Q305 HydrophobicContact CG2-CB 4.42Å; T301-Q305 WeakPolarHBondContact O-CA 3.5Å; T301-Q305 WeakPolarHBondContact O-CB 3.31Å; T301-Q305 PolarHBondContact O-N 2.87Å; Q305-G309 VanDerWaalsContact O-CA 3.25Å; Q305-G309 WeakPolarHBondContact O-CA 3.34Å; Q305-G309 PolarHBondContact O-N 3.16Å; Q305-I310 WeakPolarHBondContact CA-O 3.47Å; Q305-I310 WeakPolarHBondContact CB-O 3.5Å; Q305-I310 WeakPolarHBondContact CG-O 3.32Å
306	D	73.2	Confident	71.7	Confident	119 Å²	119	70.3 Å²	70.3	64%	0.636	35%	0.346	S	S	*	.	I	π-helix	trans	-85.4	-43.5	-176.3	-165.5	74.2	0	0	0	111.8	Y302	Y302-D306 HydrophobicContact CD2-CB 3.76Å; Y302-D306 HydrophobicContact CE2-CB 4.09Å; Y302-D306 VanDerWaalsContact CE2-OD2 3.25Å; Y302-D306 WeakPolarHBondContact CE2-OD2 3.47Å; Y302-D306 WeakPolarHBondContact O-CA 3.46Å; Y302-D306 WeakPolarHBondContact O-CB 3.46Å; Y302-D306 PolarHBondContact O-N 3.08Å
307	K	72.9	Confident	71.7	Confident	119 Å²	119	69 Å²	69	52%	0.517	34%	0.34	S	S	.	.	I	π-helix	trans	-81.7	-39.7	179.5	-78.3	-83.4	-172.6	163.7	0	114.3	Y302 F303	Y302-K307 HydrophobicContact CE1-CG 4.4Å; Y302-K307 PolarHBondContact O-N 3.01Å; Y302-K307 VanDerWaalsContact O-N 3.08Å; F303-K307 HydrophobicContact CD2-CB 4.37Å; F303-K307 VanDerWaalsContact O-CB 3.27Å; F303-K307 WeakPolarHBondContact O-CB 3.49Å
308	L	76.4	Confident	71.1	Confident	36 Å²	36	71.5 Å²	71.5	19%	0.188	34%	0.343	C	S	.	.	S	Bend	trans	-103.9	-10.1	-177.8	-59.9	176.8	0	0	0	114.4	A273 F303 L304 I310	A273-L308 HydrophobicContact CB-CD1 3.61Å; F303-L308 HydrophobicContact CD1-CD1 4.49Å; F303-L308 HydrophobicContact CE1-CD1 4.21Å; F303-L308 WeakPolarHBondContact O-CG 3.2Å; F303-L308 PolarHBondContact O-N 2.95Å; L304-L308 HydrophobicContact CD2-CD1 3.9Å; L304-L308 CarbonylContact O-C 3.59Å; L304-L308 WeakPolarHBondContact O-CB 3.37Å; L308-I310 VanDerWaalsContact C-N 3.31Å; L308-I310 HydrophobicContact CB-CD1 3.98Å; L308-I310 HydrophobicContact CB-CG1 3.88Å; L308-I310 HydrophobicContact CD1-CD1 4.14Å; L308-I310 PolarHBondContact O-N 3.04Å
309	G	78.1	Confident	69.5	Low	57 Å²	57	78.2 Å²	78.2	59%	0.588	38%	0.378	S	S	*	.			trans	76.1	11.4	179.1	0	0	0	0	0	115.3	L304 Q305 K311	L304-G309 PolarHBondContact O-N 2.9Å; Q305-G309 VanDerWaalsContact O-CA 3.25Å; Q305-G309 WeakPolarHBondContact O-CA 3.34Å; Q305-G309 PolarHBondContact O-N 3.16Å; G309-K311 PolarHBondContact O-N 2.65Å
310	I	84.8	Confident	68	Low	4 Å²	4	83.5 Å²	83.5	2%	0.021	40%	0.399	C	S	.	.			trans	-78.6	121.6	-175.3	-49.3	177.8	0	0	0	109.7	L278 L281 L304 Q305 L308 I312	L278-I310 HydrophobicContact CB-CD1 4.43Å; L278-I310 HydrophobicContact CD2-CD1 4.3Å; L278-I310 HydrophobicContact CD2-CG2 4.28Å; L278-I310 HydrophobicContact CG-CG2 4.22Å; L281-I310 HydrophobicContact CB-CG2 3.94Å; L304-I310 HydrophobicContact CB-CB 4.4Å; L304-I310 HydrophobicContact CB-CD1 4.34Å; L304-I310 HydrophobicContact CD2-CD1 4.26Å; L304-I310 VanDerWaalsContact O-CB 3.28Å; L304-I310 WeakPolarHBondContact O-CB 3.38Å; L304-I310 WeakPolarHBondContact O-CG1 3.23Å; L304-I310 PolarHBondContact O-N 3.44Å; Q305-I310 WeakPolarHBondContact CA-O 3.47Å; Q305-I310 WeakPolarHBondContact CB-O 3.5Å; Q305-I310 WeakPolarHBondContact CG-O 3.32Å; L308-I310 VanDerWaalsContact C-N 3.31Å; L308-I310 HydrophobicContact CB-CD1 3.98Å; L308-I310 HydrophobicContact CB-CG1 3.88Å; L308-I310 HydrophobicContact CD1-CD1 4.14Å; L308-I310 PolarHBondContact O-N 3.04Å; I310-I312 PolarHBondContact O-N 3.24Å; I310-I312 VanDerWaalsContact O-N 3.15Å
311	K	84.3	Confident	66	Low	115 Å²	115	89 Å²	89	50%	0.5	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	104.6	176.7	-178.5	-176.9	168.1	-152.7	0	110	C279 E280 L281 G309	C279-K311 WeakPolarHBondContact O-CB 3.5Å; C279-K311 PolarHBondContact O-N 2.63Å; E280-K311 WeakPolarHBondContact CA-O 3.31Å; E280-K311 WeakPolarHBondContact OE2-CD 3.39Å; E280-K311 WeakPolarHBondContact OE2-CE 3.24Å; E280-K311 IonicContact OE2-NZ 2.78Å; E280-K311 PolarHBondContact OE2-NZ 2.8Å; L281-K311 PolarHBondContact N-O 3.27Å; G309-K311 PolarHBondContact O-N 2.65Å
312	I	84.6	Confident	63.9	Low	21 Å²	21	94 Å²	94	11%	0.108	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	124.7	175.9	-46.6	178.2	0	0	0	110.3	L281 I283 L304 I310 R314	L281-I312 CarbonylContact O-C 3.6Å; L281-I312 VanDerWaalsContact O-CA 3.28Å; L281-I312 WeakPolarHBondContact O-CA 3.24Å; I283-I312 HydrophobicContact CD1-CG2 3.89Å; I283-I312 HydrophobicContact CG1-CG2 3.83Å; L304-I312 HydrophobicContact CB-CD1 3.94Å; L304-I312 HydrophobicContact CB-CG1 4.45Å; L304-I312 HydrophobicContact CD1-CD1 4.27Å; I310-I312 PolarHBondContact O-N 3.24Å; I310-I312 VanDerWaalsContact O-N 3.15Å; I312-R314 HydrophobicContact CG2-CG 3.75Å
313	K	83.3	Confident	61.7	Low	78 Å²	78	93.1 Å²	93.1	34%	0.339	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.4	165	-68.9	171.4	176.2	167.5	0	109.1	E280 L281 D282 I283	E280-K313 VanDerWaalsContact CD-CE 3.46Å; E280-K313 WeakPolarHBondContact OE1-CE 3.32Å; E280-K313 IonicContact OE1-NZ 2.65Å; E280-K313 PolarHBondContact OE1-NZ 3.24Å; E280-K313 IonicContact OE2-NZ 3.88Å; L281-K313 PolarHBondContact O-N 3.15Å; D282-K313 HydrophobicContact CB-CB 4.07Å; D282-K313 HydrophobicContact CB-CD 4.22Å; D282-K313 WeakPolarHBondContact OD1-CB 3.46Å; D282-K313 WeakPolarHBondContact OD2-CB 3.45Å; D282-K313 WeakPolarHBondContact OD2-CD 3.33Å; I283-K313 WeakPolarHBondContact CG1-O 3.49Å; I283-K313 PolarHBondContact N-O 3.48Å
314	R	76.8	Confident	59.5	Low	64 Å²	64	98 Å²	98	24%	0.242	50%	0.495	C	S	.	.			trans	-130.9	27	-179.4	-60.6	-169.8	174.6	-171.5	-3.7	112.4	E266 I283 T289 S298 T301 I312 K316	E266-R314 IonicContact OE1-NH1 3.89Å; E266-R314 IonicContact OE1-NH2 3.62Å; I283-R314 HydrophobicContact CD1-CG 4.16Å; I283-R314 HydrophobicContact CG1-CG 4.04Å; T289-R314 HydrophobicContact CG2-CB 4.2Å; T289-R314 HydrophobicContact CG2-CG 4.42Å; S298-R314 PolarHBondContact OG-NH1 3.46Å; S298-R314 PolarHBondContact OG-NH2 3.2Å; S298-R314 VanDerWaalsContact OG-NH2 3.1Å; T301-R314 PolarHBondContact OG1-NH1 3.32Å; T301-R314 VanDerWaalsContact OG1-NH1 3.12Å; T301-R314 PolarHBondContact OG1-NH2 3.12Å; I312-R314 HydrophobicContact CG2-CG 3.75Å; R314-K316 PolarHBondContact O-N 3.48Å; R314-K316 VanDerWaalsContact O-N 3.09Å
315	K	68.1	Low	56.9	Low	176 Å²	176	108.2 Å²	108.2	77%	0.765	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-60	120.9	178.1	-75	-168.9	175.6	-171.8	0	107.8	G284 C285	G284-K315 CarbonylContact C-O 3.53Å; G284-K315 WeakPolarHBondContact CA-O 3.38Å; C285-K315 PolarHBondContact N-O 2.73Å; C285-K315 VanDerWaalsContact N-O 3.14Å
316	K	60.4	Low	54.4	Low	113 Å²	113	109.7 Å²	109.7	49%	0.491	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-65.1	144.8	158.3	-65.2	-176.4	-179.6	-173.8	0	106.2	T289 A290 R314 E318	T289-K316 WeakPolarHBondContact O-CE 3.42Å; T289-K316 PolarHBondContact O-NZ 3.03Å; A290-K316 PolarHBondContact O-NZ 3.21Å; R314-K316 PolarHBondContact O-N 3.48Å; R314-K316 VanDerWaalsContact O-N 3.09Å; K316-E318 PolarHBondContact O-N 3.45Å; K316-E318 VanDerWaalsContact O-N 3.16Å
317	H	49.4	Very low	52	Low	101 Å²	101	107.4 Å²	107.4	47%	0.468	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-53	125.1	160.7	-131.5	-70.9	0	0	0	106	C285 D319 F320	C285-H317 VanDerWaalsContact SG-CB 3.6Å; C285-H317 PolarHBondContact SG-N 3.07Å; H317-D319 PolarHBondContact O-N 3.03Å; H317-F320 AromaticContact CE1-CD2 3.32Å; H317-F320 WeakPolarHBondContact CE1-CD2 3.46Å; H317-F320 AromaticContact CE1-CE2 3.41Å; H317-F320 VanDerWaalsContact CE1-CE2 3.41Å; H317-F320 WeakPolarHBondContact CE1-CE2 3.48Å; H317-F320 AromaticContact ND1-CD2 3.22Å; H317-F320 WeakPolarHBondContact ND1-CD2 3.36Å; H317-F320 AromaticContact ND1-CE2 3.51Å
318	E	40.9	Very low	49.9	Very low	168 Å²	168	112.6 Å²	112.6	79%	0.785	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-57.5	132.8	160.3	-68.7	-176.6	175	0	0	105.8	K316 F320	K316-E318 PolarHBondContact O-N 3.45Å; K316-E318 VanDerWaalsContact O-N 3.16Å; E318-F320 VanDerWaalsContact O-CD2 3.23Å; E318-F320 WeakPolarHBondContact O-CD2 3.37Å; E318-F320 PolarHBondContact O-N 3.08Å
319	D	32	Very low	47.5	Very low	160 Å²	160	119.3 Å²	119.3	86%	0.856	60%	0.604	S	S	*	*			trans	-58.7	100	-172.6	-68.8	-53.6	0	0	0	109.4	H317 Q321	H317-D319 PolarHBondContact O-N 3.03Å; D319-Q321 PolarHBondContact O-N 3.24Å
320	F	31	Very low	45.1	Very low	166 Å²	166	121.6 Å²	121.6	73%	0.728	62%	0.617	S	S	*	*			trans	-70.3	86.3	171.4	-85.5	-99.4	0	0	0	107.5	H317 E318 V322	H317-F320 AromaticContact CE1-CD2 3.32Å; H317-F320 WeakPolarHBondContact CE1-CD2 3.46Å; H317-F320 AromaticContact CE1-CE2 3.41Å; H317-F320 VanDerWaalsContact CE1-CE2 3.41Å; H317-F320 WeakPolarHBondContact CE1-CE2 3.48Å; H317-F320 AromaticContact ND1-CD2 3.22Å; H317-F320 WeakPolarHBondContact ND1-CD2 3.36Å; H317-F320 AromaticContact ND1-CE2 3.51Å; E318-F320 VanDerWaalsContact O-CD2 3.23Å; E318-F320 WeakPolarHBondContact O-CD2 3.37Å; E318-F320 PolarHBondContact O-N 3.08Å; F320-V322 PolarHBondContact O-N 3.5Å
321	Q	26	Very low	42.2	Very low	126 Å²	126	125.1 Å²	125.1	59%	0.589	66%	0.655	S	S	*	*			trans	-58.8	106.9	179.4	-163.1	174.7	42.6	0	0	108.2	D319 C323	D319-Q321 PolarHBondContact O-N 3.24Å; Q321-C323 PolarHBondContact O-N 2.81Å; Q321-C323 PolarHBondContact O-SG 2.64Å; Q321-C323 VanDerWaalsContact O-SG 3.41Å
322	V	25.1	Very low	39.4	Very low	124 Å²	124	126.2 Å²	126.2	75%	0.752	67%	0.671	S	S	*	*			trans	-55	106.4	179.8	178.5	0	0	0	0	108.8	F320 V324	F320-V322 PolarHBondContact O-N 3.5Å; V322-V324 HydrophobicContact CG1-CG2 3.96Å; V322-V324 PolarHBondContact O-N 2.92Å
323	C	22.1	Very low	36.5	Very low	99 Å²	99	131.6 Å²	131.6	67%	0.669	71%	0.709	S	S	*	*			trans	-76.3	78.9	178.1	-72.9	0	0	0	0	109.8	Q321 Y325	Q321-C323 PolarHBondContact O-N 2.81Å; Q321-C323 PolarHBondContact O-SG 2.64Å; Q321-C323 VanDerWaalsContact O-SG 3.41Å; C323-Y325 WeakPolarHBondContact O-CD2 3.45Å; C323-Y325 PolarHBondContact O-N 3.33Å; C323-Y325 VanDerWaalsContact O-N 3.09Å
324	V	24.8	Very low	33.8	Very low	114 Å²	114	132.8 Å²	132.8	69%	0.691	73%	0.727	S	S	*	*			trans	-65.9	105	167.1	-178.5	0	0	0	0	108.2	V322 P326	V322-V324 HydrophobicContact CG1-CG2 3.96Å; V322-V324 PolarHBondContact O-N 2.92Å; V324-P326 VanDerWaalsContact O-CD 3.28Å; V324-P326 WeakPolarHBondContact O-CD 3.48Å
325	Y	22.8	Very low	31.4	Very low	215 Å²	215	134.3 Å²	134.3	84%	0.843	75%	0.753	S	S	*	*			trans	-68.7	119.8	170.2	-71.9	-89.4	0	0	0	110.2	C323	C323-Y325 WeakPolarHBondContact O-CD2 3.45Å; C323-Y325 PolarHBondContact O-N 3.33Å; C323-Y325 VanDerWaalsContact O-N 3.09Å
326	P	24.6	Very low	29.4	Very low	129 Å²	129	134.1 Å²	134.1	84%	0.838	76%	0.76	S	S	*	*			trans	-100.6	111.2	-179.2	33.5	-24.4	0	0	0	112.6	V324	V324-P326 VanDerWaalsContact O-CD 3.28Å; V324-P326 WeakPolarHBondContact O-CD 3.48Å
327	G	24.1	Very low	28.1	Very low	70 Å²	70	135.4 Å²	135.4	72%	0.722	78%	0.777	S	S	*	*			trans	142.5	131	163.9	0	0	0	0	0	113
328	R	27.9	Very low	27	Very low	229 Å²	229	134.3 Å²	134.3	86%	0.864	79%	0.793	S	S	*	*	S	Bend	cis	-144.9	159.2	-0.2	-73.2	-180	-179.4	170.8	1.4	107.1
329	E	26.6	Very low	26.3	Very low	176 Å²	176	132.7 Å²	132.7	82%	0.822	80%	0.795	S	S	*	*			cis	-149.3	163.4	23.7	-139	150.8	-118.4	0	0	110.4
330	A	27.6	Very low	25.8	Very low	105 Å²	105	131.8 Å²	131.8	87%	0.868	79%	0.789	S	S	*	*			trans	-94.6	142.2	-160.4	0	0	0	0	0	116.1
331	G	23.7	Very low	25.4	Very low	79 Å²	79	129.7 Å²	129.7	81%	0.814	79%	0.785	S	S	*	*			trans	-122	103.1	161.3	0	0	0	0	0	110.3
332	V	25.3	Very low	25.3	Very low	137 Å²	137	129.7 Å²	129.7	83%	0.83	79%	0.788	S	S	*	*			trans	-38.1	127.7	-170.5	-179.4	0	0	0	0	117
333	C	23.4	Very low	25.2	Very low	134 Å²	134	135.2 Å²	135.2	91%	0.905	80%	0.796	S	S	*	*			trans	-150.4	149.3	134.8	-127.8	0	0	0	0	110.6
334	S	28	Very low	25.2	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	80%	0.801	S	S	*	*			trans	-114.7	153.7	-157.4	55.5	0	0	0	0	115.6
335	A	26	Very low	25	Very low	95 Å²	95	140.8 Å²	140.8	79%	0.785	81%	0.807	S	S	*	*			trans	74.6	122.9	173.8	0	0	0	0	0	114.8
336	L	26.6	Very low	25.3	Very low	173 Å²	173	138.7 Å²	138.7	91%	0.906	81%	0.805	S	S	*	*				-149.5	171.5	57.7	-91.5	159.2	0	0	0	114
337	T	32.1	Very low	25.3	Very low	140 Å²	140	140 Å²	140	86%	0.859	81%	0.805	S	S	*	*			trans	-89.4	131.3	-170.6	48.7	0	0	0	0	114
338	G	26.1	Very low	25.3	Very low	77 Å²	77	147 Å²	147	79%	0.794	81%	0.81	S	S	*	*			trans	-154	135.8	168.6	0	0	0	0	0	111.4
339	T	26.1	Very low	25.3	Very low	135 Å²	135	142.8 Å²	142.8	83%	0.828	80%	0.804	S	S	*	*			trans	-85.4	129.1	-170.2	45.8	0	0	0	0	113.6
340	L	22.7	Very low	25.2	Very low	141 Å²	141	143.4 Å²	143.4	74%	0.738	81%	0.806	S	S	*	*			trans	-83.1	117.6	174.4	-165.9	80.7	0	0	0	111.3	I342	L340-I342 HydrophobicContact CD2-CD1 4.09Å; L340-I342 HydrophobicContact CD2-CG1 4.16Å; L340-I342 HydrophobicContact CG-CG1 4.35Å
341	N	22.5	Very low	25.2	Very low	121 Å²	121	145 Å²	145	65%	0.647	81%	0.806	S	S	*	*			trans	-107.5	135.3	165.8	-76.2	-29.2	0	0	0	109.1
342	I	23	Very low	25.2	Very low	126 Å²	126	149.2 Å²	149.2	65%	0.646	80%	0.804	S	S	*	*			trans	-117.1	129.3	180	-58.8	172	0	0	0	108.2	L340	L340-I342 HydrophobicContact CD2-CD1 4.09Å; L340-I342 HydrophobicContact CD2-CG1 4.16Å; L340-I342 HydrophobicContact CG-CG1 4.35Å
343	W	22.4	Very low	25.1	Very low	240 Å²	240	148.6 Å²	148.6	91%	0.909	80%	0.801	S	S	*	*			trans	-117.2	146.7	166.3	-73.7	86.8	0	0	0	109.3
344	I	22.3	Very low	25	Very low	151 Å²	151	148.6 Å²	148.6	77%	0.774	80%	0.797	S	S	*	*			trans	-113.8	129.7	178.5	-59.7	172.4	0	0	0	107
345	H	21.5	Very low	24.9	Very low	179 Å²	179	152 Å²	152	83%	0.829	80%	0.795	S	S	*	*			trans	-123.4	124	161.7	-135.4	-69.8	0	0	0	108.7
346	E	29.7	Very low	24.7	Very low	171 Å²	171	153.1 Å²	153.1	80%	0.799	79%	0.792	S	S	*	*			trans	-83.5	129.4	156.9	-68.4	-177.3	129.1	0	0	106.6
347	D	23	Very low	24.6	Very low	158 Å²	158	149.9 Å²	149.9	85%	0.845	77%	0.767	S	S	*	*				-165	171	127.2	-117.2	-36.1	0	0	0	112.9
348	R	25.5	Very low	24	Very low	215 Å²	215	152.4 Å²	152.4	81%	0.811	77%	0.767	S	S	*	*			trans	-101.9	151.2	-157.9	-71.5	174.3	166.2	175.7	-3.9	116.3
349	L	28	Very low	23.8	Very low	142 Å²	142	153.2 Å²	153.2	74%	0.743	76%	0.76	S	S	*	*			trans	52.1	99.5	142.7	-69.8	164.8	0	0	0	117.8
350	H	24.9	Very low	23.7	Very low	188 Å²	188	151.8 Å²	151.8	87%	0.87	76%	0.756	S	S	*	*			trans	-132.3	140.4	134.5	-82.1	73.8	0	0	0	108.4
351	T	26.6	Very low	23.7	Very low	140 Å²	140	153 Å²	153	86%	0.859	76%	0.757	S	S	*	*			trans	-95.6	92.6	-179.4	47	0	0	0	0	110.3
352	E	22.7	Very low	23.8	Very low	167 Å²	167	155.4 Å²	155.4	78%	0.78	77%	0.77	S	S	*	*			trans	-130.8	133.9	165.7	-70.5	-178	162.9	0	0	108.5	T354	E352-T354 PolarHBondContact O-N 2.85Å; E352-T354 PolarHBondContact O-OG1 2.88Å
353	T	23.7	Very low	23.9	Very low	123 Å²	123	154.7 Å²	154.7	76%	0.755	77%	0.771	S	S	*	*			trans	-62.9	103.6	-178.2	36.9	0	0	0	0	110.6	Y355	T353-Y355 PolarHBondContact O-N 2.59Å
354	T	21.4	Very low	24	Very low	134 Å²	134	151.5 Å²	151.5	82%	0.822	77%	0.771	S	S	*	*			trans	-79.3	109.4	-175.9	-37.5	0	0	0	0	110.8	E352	E352-T354 PolarHBondContact O-N 2.85Å; E352-T354 PolarHBondContact O-OG1 2.88Å
355	Y	26	Very low	24.1	Very low	175 Å²	175	151.1 Å²	151.1	69%	0.686	77%	0.771	S	S	*	*			trans	-76.8	133.3	168.5	-68.7	-82.2	0	0	0	110.3	T353 R357	T353-Y355 PolarHBondContact O-N 2.59Å; Y355-R357 PolarHBondContact O-N 2.77Å
356	V	21.4	Very low	24.4	Very low	119 Å²	119	148.1 Å²	148.1	72%	0.721	77%	0.768	S	S	*	*			trans	-84.8	105.4	-179.6	178.8	0	0	0	0	109.7	F358	V356-F358 HydrophobicContact CG1-CD2 4.31Å; V356-F358 HydrophobicContact CG1-CE2 3.87Å; V356-F358 HydrophobicContact CG1-CZ 4.41Å
357	R	24	Very low	24.2	Very low	105 Å²	105	145.3 Å²	145.3	40%	0.396	77%	0.765	S	S	.	*			trans	-75.2	127.2	178.2	-166.1	-175.4	-158.4	74.3	33.7	111.3	E141 D165 Y355	E141-R357 VanDerWaalsContact CD-NH2 3.25Å; E141-R357 IonicContact OE1-CZ 3.32Å; E141-R357 VanDerWaalsContact OE1-CZ 3.26Å; E141-R357 IonicContact OE1-NH1 3.22Å; E141-R357 PolarHBondContact OE1-NH1 3.17Å; E141-R357 IonicContact OE1-NH2 3.61Å; E141-R357 PolarHBondContact OE1-NH2 3.14Å; E141-R357 IonicContact OE2-NH2 3.57Å; D165-R357 IonicContact OD1-CZ 3.82Å; D165-R357 VanDerWaalsContact OD1-CZ 3.22Å; D165-R357 IonicContact OD1-NE 3.42Å; D165-R357 PolarHBondContact OD1-NE 3.14Å; D165-R357 IonicContact OD1-NH2 3.32Å; D165-R357 PolarHBondContact OD1-NH2 3.22Å; D165-R357 IonicContact OD2-CZ 3.26Å; D165-R357 IonicContact OD2-NE 2.71Å; D165-R357 IonicContact OD2-NH1 3.36Å; D165-R357 IonicContact OD2-NH2 2.63Å; D165-R357 PolarHBondContact OD2-NH2 3.01Å; Y355-R357 PolarHBondContact O-N 2.77Å
358	F	20.4	Very low	24.2	Very low	193 Å²	193	147.1 Å²	147.1	85%	0.846	77%	0.766	S	S	*	*			trans	-116.2	90.4	164.8	-77.6	-80.1	0	0	0	109.7	V356	V356-F358 HydrophobicContact CG1-CD2 4.31Å; V356-F358 HydrophobicContact CG1-CE2 3.87Å; V356-F358 HydrophobicContact CG1-CZ 4.41Å
359	S	22.4	Very low	24.2	Very low	94 Å²	94	144.4 Å²	144.4	66%	0.657	77%	0.768	S	S	*	*			trans	-89.9	121.6	166.7	50.7	0	0	0	0	109.7
360	S	22.6	Very low	24	Very low	105 Å²	105	146.8 Å²	146.8	73%	0.734	77%	0.772	S	S	*	*			trans	-120.5	85.9	-178.6	62.2	0	0	0	0	111
361	H	23.8	Very low	24.1	Very low	166 Å²	166	142.5 Å²	142.5	77%	0.769	76%	0.761	S	S	*	*			trans	-144.5	106.1	162.3	-83	97.7	0	0	0	110.3
362	D	24	Very low	24	Very low	172 Å²	172	142 Å²	142	92%	0.92	76%	0.761	S	S	*	*			trans	-146.4	134.3	143.5	-121.6	-22.8	0	0	0	107.9
363	V	26.2	Very low	24.1	Very low	111 Å²	111	142.6 Å²	142.6	67%	0.673	77%	0.768	S	S	*	*			trans	-100.3	124.8	-158.7	174.7	0	0	0	0	112.2
364	L	24.2	Very low	24.1	Very low	173 Å²	173	144.1 Å²	144.1	91%	0.906	77%	0.766	S	S	*	*			trans	-135.2	105.2	152.3	-74.5	178.2	0	0	0	110.4
365	N	24.5	Very low	24.3	Very low	143 Å²	143	143.8 Å²	143.8	77%	0.765	76%	0.759	S	S	*	*			trans	-66.1	138.1	160.6	-109.8	-30	0	0	0	108.4
366	P	26.5	Very low	24.3	Very low	117 Å²	117	143.2 Å²	143.2	76%	0.76	77%	0.766	S	S	*	*				-141.3	148	88.2	36.6	-22.2	0	0	0	116.2
367	C	25.7	Very low	24.3	Very low	111 Å²	111	143 Å²	143	75%	0.75	77%	0.769	S	S	*	*			trans	-10.5	113.9	160.5	-52.5	0	0	0	0	118.4
368	F	23.4	Very low	24.3	Very low	197 Å²	197	148.8 Å²	148.8	86%	0.864	79%	0.791	S	S	*	*			trans	-153.9	122.9	135	-107	-74.9	0	0	0	110.5
369	N	26.7	Very low	24.4	Very low	158 Å²	158	149.2 Å²	149.2	85%	0.845	79%	0.793	S	S	*	*			trans	-77	127.1	176.5	-88.7	-27.1	0	0	0	111.3
370	F	22.9	Very low	24.4	Very low	191 Å²	191	152.1 Å²	152.1	84%	0.838	80%	0.799	S	S	*	*			trans	-141.5	147.5	153.9	-85.5	-78.2	0	0	0	110.6
371	P	26.4	Very low	24.4	Very low	99 Å²	99	154.4 Å²	154.4	64%	0.643	80%	0.802	S	S	*	*			trans	-82.8	163.5	-168.1	34.3	-36.2	0	0	0	113.4	L373	P371-L373 PolarHBondContact O-N 3.22Å
372	P	24.4	Very low	24.4	Very low	130 Å²	130	154.8 Å²	154.8	84%	0.844	81%	0.809	S	S	*	*			trans	-73	125.4	-179.7	29.9	-34.7	0	0	0	111.9	H374	P372-H374 PolarHBondContact O-N 3.06Å
373	L	25.2	Very low	24.4	Very low	178 Å²	178	154.7 Å²	154.7	93%	0.932	80%	0.8	S	S	*	*			trans	-89.1	94.5	172.7	-75.2	170.7	0	0	0	110.9	P371	P371-L373 PolarHBondContact O-N 3.22Å
374	H	24.4	Very low	24.2	Very low	156 Å²	156	155.2 Å²	155.2	72%	0.722	80%	0.799	S	S	*	*			trans	-92.1	149.7	156.1	-165.3	-85.2	0	0	0	109.4	P372	P372-H374 PolarHBondContact O-N 3.06Å
375	N	25.2	Very low	24.1	Very low	126 Å²	126	152.2 Å²	152.2	67%	0.674	78%	0.784	S	S	*	*			trans	67.6	108.3	179.2	-62.3	-44.3	0	0	0	118
376	I	25.2	Very low	24	Very low	163 Å²	163	153.2 Å²	153.2	84%	0.836	78%	0.782	S	S	*	*			trans	-122.2	94.7	132.2	-59.6	-179.6	0	0	0	107.5
377	C	23.1	Very low	23.8	Very low	114 Å²	114	158 Å²	158	77%	0.77	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-103.3	131.7	161.4	-159.5	0	0	0	0	106.9
378	W	23.5	Very low	23.6	Very low	228 Å²	228	158 Å²	158	86%	0.864	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.6	131.1	-174.9	-106	31.9	0	0	0	111.8
379	K	21.4	Very low	23.5	Very low	202 Å²	202	154.6 Å²	154.6	88%	0.878	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-81.7	128	166.7	-102.5	177.8	173.8	173.9	0	109.5
380	I	22.8	Very low	23.2	Very low	154 Å²	154	152.4 Å²	152.4	79%	0.79	77%	0.774	S	S	*	*			trans	-113.2	136.5	149.9	-66.4	-178.3	0	0	0	107.6
381	L	23	Very low	23.1	Very low	154 Å²	154	150.6 Å²	150.6	81%	0.806	77%	0.773	S	S	*	*			trans	-76.1	145.3	-176.1	-79.7	128.5	0	0	0	112
382	L	24.3	Very low	23.5	Very low	174 Å²	174	150.6 Å²	150.6	91%	0.911	77%	0.773	S	S	*	*				-155	145.5	124.4	-105.8	160.1	0	0	0	111.9
383	K	22.7	Very low	23.3	Very low	169 Å²	169	155.2 Å²	155.2	74%	0.735	77%	0.773	S	S	*	*			trans	-65.9	165.8	172.7	-83.9	171.7	163.2	-173.7	0	111.4
384	D	22.4	Very low	23.1	Very low	122 Å²	122	152.6 Å²	152.6	65%	0.652	77%	0.765	S	S	*	*			cis	-161.8	174.5	9.2	-126.4	-40	0	0	0	111.8
385	N	22.5	Very low	23.1	Very low	110 Å²	110	152.7 Å²	152.7	59%	0.588	77%	0.769	S	S	*	*			trans	72.2	103.8	155	-78.7	-49.9	0	0	0	123.3
386	K	23	Very low	22.9	Very low	165 Å²	165	155.4 Å²	155.4	72%	0.717	78%	0.778	S	S	*	*				72.5	118.3	116.5	-73.1	175.7	-170.8	151.6	0	122.9
387	R	21.4	Very low	23.1	Very low	217 Å²	217	152.6 Å²	152.6	82%	0.819	77%	0.77	S	S	*	*				100	115.4	125.7	-80.1	-178.2	176.6	179.9	-1.9	120.7
388	T	21.7	Very low	23	Very low	112 Å²	112	156.2 Å²	156.2	69%	0.687	78%	0.776	S	S	*	*			trans	70.8	107.7	130.9	58.2	0	0	0	0	122.1
389	T	20.7	Very low	22.9	Very low	124 Å²	124	148.8 Å²	148.8	76%	0.761	77%	0.77	S	S	*	*				69.5	142.3	126.7	58.4	0	0	0	0	122.8
390	S	21.3	Very low	22.9	Very low	112 Å²	112	148.7 Å²	148.7	78%	0.783	77%	0.77	S	S	*	*			trans	73.9	113.6	152.4	55.1	0	0	0	0	121
391	D	20	Very low	22.9	Very low	153 Å²	153	146.4 Å²	146.4	82%	0.818	77%	0.767	S	S	*	*			trans	-50.7	174.7	142.5	-89.8	-41.8	0	0	0	114
392	P	34.7	Very low	23	Very low	99 Å²	99	148.2 Å²	148.2	64%	0.643	77%	0.772	S	S	*	*			cis	-135.2	172.9	-28.2	34.8	-18.5	0	0	0	112.7
393	R	20.1	Very low	23.4	Very low	227 Å²	227	148.2 Å²	148.2	86%	0.857	77%	0.767	S	S	*	*			trans	163.2	137.5	132.4	-90.6	164.7	-171.6	-173	3.4	114.2
394	T	21.8	Very low	23.5	Very low	123 Å²	123	147.4 Å²	147.4	76%	0.755	77%	0.771	S	S	*	*			trans	26.9	125.6	139.2	-22.3	0	0	0	0	120.5
395	I	24.2	Very low	23.9	Very low	159 Å²	159	148.2 Å²	148.2	82%	0.815	78%	0.78	S	S	*	*				-178.5	129.7	127	-92.2	151.3	0	0	0	110
396	Q	21.5	Very low	24.3	Very low	183 Å²	183	152.1 Å²	152.1	86%	0.855	79%	0.792	S	S	*	*			trans	-101.5	148.8	154.1	-100.9	-168.9	9.7	0	0	106.6
397	P	28.7	Very low	24.4	Very low	103 Å²	103	151.9 Å²	151.9	67%	0.669	80%	0.798	S	S	*	*				-150.8	162.3	80.5	37.9	-18.1	0	0	0	117.9
398	E	20.6	Very low	24.9	Very low	191 Å²	191	148.7 Å²	148.7	89%	0.893	79%	0.79	S	S	*	*			trans	39.4	133	141.6	-61.5	178.3	171.7	0	0	122.4
399	G	21.7	Very low	25.3	Very low	71 Å²	71	152.6 Å²	152.6	73%	0.732	80%	0.798	S	S	*	*			trans	154.6	81.7	141.7	0	0	0	0	0	120.7
400	K	21.6	Very low	25.9	Very low	201 Å²	201	151.1 Å²	151.1	87%	0.874	78%	0.784	S	S	*	*			trans	74.1	117	144.7	-60.2	-178.4	177.7	179.3	0	121.8
401	S	23.1	Very low	26.4	Very low	106 Å²	106	152.5 Å²	152.5	74%	0.741	79%	0.788	S	S	*	*			trans	57.4	119.4	133.9	65.9	0	0	0	0	121
402	Q	25.6	Very low	27	Very low	192 Å²	192	152.9 Å²	152.9	90%	0.897	79%	0.785	S	S	*	*				-161	146.7	91.5	-112.5	175.2	-39.3	0	0	112.9
403	E	31.9	Very low	26.6	Very low	173 Å²	173	153.8 Å²	153.8	81%	0.808	79%	0.794	S	S	*	*			trans	-70.4	146.2	-179.7	-60.9	157.9	142	0	0	111.5
404	N	25.9	Very low	27.1	Very low	153 Å²	153	152 Å²	152	82%	0.818	80%	0.795	S	S	*	*			trans	-152.9	75.4	158.3	-106.1	-46	0	0	0	108.9	K406	N404-K406 PolarHBondContact O-N 3.17Å
405	T	30	Very low	27.6	Very low	139 Å²	139	154 Å²	154	85%	0.853	80%	0.801	S	S	*	*			trans	-61.2	115.5	170.4	38.5	0	0	0	0	109.5
406	K	30.3	Very low	27.7	Very low	192 Å²	192	155.4 Å²	155.4	84%	0.835	80%	0.804	S	S	*	*			trans	-113.1	122.6	166.4	-81.2	-174.9	175.5	177.6	0	108.7	N404 F408	N404-K406 PolarHBondContact O-N 3.17Å; K406-F408 PolarHBondContact O-N 3.5Å
407	L	26.2	Very low	28	Very low	160 Å²	160	151.4 Å²	151.4	84%	0.838	80%	0.803	S	S	*	*			trans	-59.8	125.9	-166	-68.5	141	0	0	0	112.1
408	F	32.3	Very low	28	Very low	149 Å²	149	154.6 Å²	154.6	65%	0.654	81%	0.809	S	S	*	*			trans	-80.7	134.5	167.1	-174.1	-110.2	0	0	0	108.8	K406 I410	K406-F408 PolarHBondContact O-N 3.5Å; F408-I410 HydrophobicContact CD1-CD1 3.99Å; F408-I410 HydrophobicContact CD1-CG1 3.53Å; F408-I410 HydrophobicContact CE1-CD1 4.13Å; F408-I410 HydrophobicContact CE1-CG1 3.61Å
409	F	28.8	Very low	28.3	Very low	194 Å²	194	155 Å²	155	85%	0.851	81%	0.81	S	S	*	*			trans	-95.1	107	-179.7	-79	-87.7	0	0	0	110.4
410	I	33.4	Very low	28.6	Very low	93 Å²	93	158.5 Å²	158.5	48%	0.477	81%	0.812	S	S	.	*			trans	-101.4	120.1	168.4	-57.6	174.9	0	0	0	107.8	F24 F408 Q412	F24-I410 HydrophobicContact CZ-CD1 4.31Å; F408-I410 HydrophobicContact CD1-CD1 3.99Å; F408-I410 HydrophobicContact CD1-CG1 3.53Å; F408-I410 HydrophobicContact CE1-CD1 4.13Å; F408-I410 HydrophobicContact CE1-CG1 3.61Å; I410-Q412 HydrophobicContact CG2-CG 4.13Å; I410-Q412 PolarHBondContact O-N 2.93Å
411	T	32.9	Very low	28.7	Very low	142 Å²	142	158.3 Å²	158.3	87%	0.871	81%	0.814	S	S	*	*			trans	-89.2	96.2	169.1	48.8	0	0	0	0	109.9
412	Q	31.8	Very low	28.8	Very low	160 Å²	160	161.7 Å²	161.7	75%	0.748	82%	0.823	S	S	*	*			trans	-85.1	151.5	158.6	-70.4	179.9	-11.9	0	0	109.5	I410	I410-Q412 HydrophobicContact CG2-CG 4.13Å; I410-Q412 PolarHBondContact O-N 2.93Å
413	S	27	Very low	28.7	Very low	119 Å²	119	157 Å²	157	83%	0.832	82%	0.817	S	S	*	*			trans	-123.2	90.8	178.6	59.8	0	0	0	0	110.5
414	E	30.6	Very low	28.3	Very low	190 Å²	190	153.8 Å²	153.8	89%	0.888	81%	0.814	S	S	*	*			trans	-138.7	151.8	167	-67.8	-166.2	159.8	0	0	110
415	D	30.7	Very low	28.2	Very low	163 Å²	163	155.1 Å²	155.1	87%	0.872	82%	0.82	S	S	*	*			trans	-90.8	164.3	-170.8	-74.7	-62.5	0	0	0	114.1
416	E	26.6	Very low	27.9	Very low	189 Å²	189	153.1 Å²	153.1	88%	0.883	81%	0.812	S	S	*	*			trans	93.1	117.1	160.7	-54.4	-155.3	149.6	0	0	121.9
417	A	28.7	Very low	27.7	Very low	100 Å²	100	150.1 Å²	150.1	83%	0.826	81%	0.809	S	S	*	*			trans	68.9	106	136.4	0	0	0	0	0	122.1
418	E	27.2	Very low	27.7	Very low	170 Å²	170	151.2 Å²	151.2	79%	0.794	81%	0.81	S	S	*	*			trans	-70.7	144.4	159.9	-62	-177.6	141.3	0	0	113.3
419	Q	28.2	Very low	27.3	Very low	198 Å²	198	151 Å²	151	93%	0.925	82%	0.816	S	S	*	*			trans	-134.3	110.5	141.6	-76.8	-164.9	-1.3	0	0	110.6
420	L	26.7	Very low	27.3	Very low	146 Å²	146	150 Å²	150	76%	0.764	81%	0.814	S	S	*	*			trans	-85.7	133.6	170.7	-73.4	165.9	0	0	0	110.7
421	Q	25.6	Very low	26.9	Very low	197 Å²	197	151 Å²	151	92%	0.921	83%	0.829	S	S	*	*			trans	-117.8	123.8	155.6	-82.7	-170.6	-12.1	0	0	110.2
422	L	24.1	Very low	26.6	Very low	177 Å²	177	148.4 Å²	148.4	93%	0.927	82%	0.822	S	S	*	*			trans	-81.4	132.3	175.9	-88.4	154.4	0	0	0	110.9
423	A	23.5	Very low	26.4	Very low	93 Å²	93	150 Å²	150	77%	0.769	83%	0.83	S	S	*	*			trans	-144.4	93.9	159.8	0	0	0	0	0	111
424	S	24.4	Very low	26.3	Very low	106 Å²	106	152.6 Å²	152.6	74%	0.741	83%	0.834	S	S	*	*			trans	-0.1	138.8	149.1	53.9	0	0	0	0	119.9
425	L	23.6	Very low	26.1	Very low	180 Å²	180	146.8 Å²	146.8	94%	0.942	83%	0.825	S	S	*	*			trans	-157.3	126.5	131	-109	165.1	0	0	0	111.1
426	S	23.7	Very low	25.8	Very low	98 Å²	98	143.7 Å²	143.7	69%	0.685	82%	0.822	S	S	*	*			trans	-124.9	128	175.3	55.1	0	0	0	0	110.5
427	T	26	Very low	26.2	Very low	129 Å²	129	146.9 Å²	146.9	79%	0.791	83%	0.826	S	S	*	*			trans	10.3	138	149	53.8	0	0	0	0	121.1
428	Q	25.1	Very low	26.3	Very low	182 Å²	182	148 Å²	148	85%	0.85	83%	0.825	S	S	*	*			trans	-109.6	136.2	143.7	-72.1	-179.5	-39.3	0	0	106.7
429	D	25.6	Very low	26.4	Very low	146 Å²	146	143.5 Å²	143.5	78%	0.781	82%	0.824	S	S	*	*				69.3	133.8	63.2	-72.8	-21	0	0	0	112.3
430	E	27.1	Very low	26.6	Very low	173 Å²	173	145.4 Å²	145.4	81%	0.808	82%	0.823	S	S	*	*			cis	-142.9	162	6.7	-56.3	-178.8	132.8	0	0	111
431	S	24.8	Very low	26.8	Very low	113 Å²	113	144.8 Å²	144.8	79%	0.79	83%	0.828	S	S	*	*				127.6	151.3	100	58.8	0	0	0	0	109.9
432	A	28.5	Very low	27	Very low	88 Å²	88	143 Å²	143	73%	0.727	82%	0.823	S	S	*	*			cis	-156.8	154.7	-17.3	0	0	0	0	0	111
433	E	26.8	Very low	27.1	Very low	194 Å²	194	138.6 Å²	138.6	91%	0.907	81%	0.805	S	S	*	*			trans	28.3	124.7	151	-56.6	-174.2	156.1	0	0	122.9
434	D	25	Very low	27.3	Very low	173 Å²	173	145.3 Å²	145.3	93%	0.925	81%	0.813	S	S	*	*				-160.7	159.7	93.2	-160.6	1.5	0	0	0	110.4
435	G	25.2	Very low	27.3	Very low	68 Å²	68	146.6 Å²	146.6	70%	0.701	81%	0.811	S	S	*	*			trans	-112.2	129.6	-160.5	0	0	0	0	0	117.4
436	A	25.6	Very low	27.8	Very low	98 Å²	98	143.2 Å²	143.2	81%	0.81	80%	0.798	S	S	*	*			trans	-157.9	135.7	150.2	0	0	0	0	0	111	P438	A436-P438 WeakPolarHBondContact O-CD 3.24Å
437	R	34.9	Very low	28	Very low	256 Å²	256	146.4 Å²	146.4	97%	0.966	81%	0.805	S	S	*	*			trans	-82.9	134.7	174.1	-68.1	178.5	177.2	176	-1.5	111.2
438	P	30.6	Very low	28.2	Very low	124 Å²	124	148.8 Å²	148.8	81%	0.805	81%	0.81	S	S	*	*			trans	-128.8	167	137.6	29	-13.2	0	0	0	112.7	A436	A436-P438 WeakPolarHBondContact O-CD 3.24Å
439	G	28.6	Very low	28.4	Very low	74 Å²	74	146.4 Å²	146.4	76%	0.763	80%	0.803	S	S	*	*			trans	-77.6	168.5	-174.8	0	0	0	0	0	115.4
440	R	33.9	Very low	28.6	Very low	238 Å²	238	146.3 Å²	146.3	90%	0.898	81%	0.807	S	S	*	*			trans	-30	139.1	174.8	-57.4	174	178.3	-171.7	-2.1	116
441	P	30.7	Very low	28.8	Very low	134 Å²	134	146.8 Å²	146.8	87%	0.87	81%	0.81	S	S	*	*			trans	-95.3	145.9	159.5	23.4	-10	0	0	0	114
442	I	28.4	Very low	29.3	Very low	159 Å²	159	147.5 Å²	147.5	82%	0.815	81%	0.811	S	S	*	*			trans	-138.4	146.3	168.2	-24.5	168	0	0	0	104.5
443	C	26.3	Very low	29.2	Very low	84 Å²	84	151.5 Å²	151.5	57%	0.568	82%	0.819	S	S	*	*			cis	-142.1	-173.4	6.1	-158.6	0	0	0	0	109.6
444	Y	27.4	Very low	29.7	Very low	235 Å²	235	147.6 Å²	147.6	92%	0.922	81%	0.811	S	S	*	*			trans	-111.1	83.4	150	-85.6	-73.1	0	0	0	109.4
445	D	26.2	Very low	30.2	Very low	133 Å²	133	147.3 Å²	147.3	71%	0.711	81%	0.81	S	S	*	*			trans	-84.6	173.3	155.9	-73.8	-64.2	0	0	0	109.7
446	V	32.9	Very low	30.5	Very low	109 Å²	109	152 Å²	152	66%	0.661	82%	0.817	S	S	*	*			trans	77.8	77.5	180	-163.1	0	0	0	0	115.3
447	I	28.9	Very low	30.7	Very low	164 Å²	164	150.3 Å²	150.3	84%	0.841	81%	0.809	S	S	*	*	S	Bend		-143.4	81.2	105.4	-51	-173.3	0	0	0	108.8
448	M	29.1	Very low	30.5	Very low	180 Å²	180	144.3 Å²	144.3	89%	0.887	80%	0.8	S	S	*	*			trans	-152.5	68.4	164.1	-85.4	-55.6	-67.6	0	0	109.6
449	D	30.6	Very low	30.7	Very low	131 Å²	131	147.6 Å²	147.6	70%	0.701	81%	0.805	S	S	*	*			trans	-102.7	99.6	178.5	-68.8	-30.6	0	0	0	111.9
450	V	28.7	Very low	30.7	Very low	144 Å²	144	147.8 Å²	147.8	87%	0.873	81%	0.807	S	S	*	*			trans	-143.7	119.7	141.3	-178	0	0	0	0	108.1
451	E	31.8	Very low	30.8	Very low	184 Å²	184	148.3 Å²	148.3	86%	0.86	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-77	154.3	-176.8	-62.5	-177.9	136	0	0	113.9
452	P	34.2	Very low	30.8	Very low	127 Å²	127	148.9 Å²	148.9	83%	0.825	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-91.4	145.7	177.1	35.6	-33.8	0	0	0	113.7
453	L	27.3	Very low	31	Very low	172 Å²	172	152.8 Å²	152.8	90%	0.901	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-87.8	153.5	169.7	-81.7	169.5	0	0	0	112.6
454	P	37.6	Very low	31.2	Very low	113 Å²	113	157.4 Å²	157.4	73%	0.734	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-89.6	159.3	-159.7	34.9	-37.7	0	0	0	116.2
455	N	35.6	Very low	31.5	Very low	167 Å²	167	152 Å²	152	89%	0.893	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-64.1	125.3	176.4	-78.2	-40.5	0	0	0	113.9
456	I	31.2	Very low	31.8	Very low	167 Å²	167	152.6 Å²	152.6	86%	0.856	82%	0.815	S	S	*	*			trans	-137.3	114.8	153.5	-60.2	-177.2	0	0	0	110.8
457	G	30.1	Very low	32.1	Very low	62 Å²	62	156 Å²	156	64%	0.639	82%	0.823	S	S	*	*			trans	58.9	112.9	130.9	0	0	0	0	0	122.8
458	V	30.8	Very low	33.1	Very low	130 Å²	130	154 Å²	154	79%	0.788	82%	0.819	S	S	*	*			trans	75.7	117.8	133.7	-170.1	0	0	0	0	119.6
459	Q	33.8	Very low	34.1	Very low	192 Å²	192	147.9 Å²	147.9	90%	0.897	80%	0.802	S	S	*	*			trans	49.9	109.8	154.6	-66.9	171.7	-16.6	0	0	119.8
460	G	28.7	Very low	35.2	Very low	79 Å²	79	148 Å²	148	81%	0.814	80%	0.802	S	S	*	*			trans	154.2	110.4	156.3	0	0	0	0	0	114.4	I462	G460-I462 PolarHBondContact O-N 2.95Å
461	R	37.2	Very low	36.3	Very low	248 Å²	248	147.7 Å²	147.7	94%	0.936	79%	0.791	S	S	*	*			trans	-39.4	131.8	175.9	-66.6	168.1	169.1	176.1	-4.1	114.8
462	I	30.2	Very low	37.4	Very low	146 Å²	146	142.7 Å²	142.7	75%	0.749	77%	0.773	S	S	*	*				-143.5	134.1	124.1	-87.8	135.4	0	0	0	106.9	G460 F464	G460-I462 PolarHBondContact O-N 2.95Å; I462-F464 HydrophobicContact CG2-CD2 3.49Å; I462-F464 VanDerWaalsContact CG2-CD2 3.49Å; I462-F464 HydrophobicContact CG2-CE2 3.48Å; I462-F464 VanDerWaalsContact CG2-CE2 3.48Å; I462-F464 HydrophobicContact CG2-CZ 4.5Å
463	R	31.8	Very low	38.3	Very low	241 Å²	241	139.8 Å²	139.8	91%	0.909	76%	0.759	S	S	*	*			trans	-110.4	128.2	166.5	-82.3	-175.4	174.3	-179.8	-2.4	107.6
464	F	30.5	Very low	40	Very low	181 Å²	181	135.8 Å²	135.8	79%	0.794	74%	0.742	S	S	*	*			trans	-118.7	140.2	156	-75.7	-70.9	0	0	0	108.9	I462	I462-F464 HydrophobicContact CG2-CD2 3.49Å; I462-F464 VanDerWaalsContact CG2-CD2 3.49Å; I462-F464 HydrophobicContact CG2-CE2 3.48Å; I462-F464 VanDerWaalsContact CG2-CE2 3.48Å; I462-F464 HydrophobicContact CG2-CZ 4.5Å
465	P	34.2	Very low	41.2	Very low	123 Å²	123	139.3 Å²	139.3	80%	0.799	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-79.6	144.4	-170.3	31.6	-35	0	0	0	112.7
466	L	32.8	Very low	42	Very low	144 Å²	144	137.7 Å²	137.7	75%	0.754	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-72.7	131.2	174.2	-133.5	75.6	0	0	0	110.4
467	Q	38.6	Very low	43.4	Very low	180 Å²	180	134.8 Å²	134.8	84%	0.841	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-83.4	124.4	172.5	-81	-179.3	-26.8	0	0	111.4	G469	Q467-G469 PolarHBondContact O-N 2.88Å
468	T	51	Low	45.2	Very low	122 Å²	122	135.2 Å²	135.2	75%	0.748	70%	0.703	S	S	*	*			trans	-88.8	12.9	-166.2	-14.1	0	0	0	0	115.7	T472	T468-T472 PolarHBondContact O-OG1 2.87Å
469	G	49.8	Very low	46.7	Very low	52 Å²	52	134.3 Å²	134.3	54%	0.536	69%	0.69	S	S	.	*	S	Bend	trans	-82.8	-58.6	-175.1	0	0	0	0	0	114.1	Q467 Q471 T472	Q467-G469 PolarHBondContact O-N 2.88Å; G469-Q471 PolarHBondContact O-N 2.94Å; G469-T472 PolarHBondContact O-N 3.43Å
470	I	53.3	Low	47.9	Very low	135 Å²	135	129.2 Å²	129.2	69%	0.692	67%	0.672	S	S	*	*	H	α-helix	trans	-66.7	-40.4	-165	-61.3	169.2	0	0	0	112.2	T472 A473 V474	I470-T472 PolarHBondContact O-N 2.92Å; I470-A473 PolarHBondContact O-N 2.67Å; I470-V474 HydrophobicContact CG2-CG2 4.13Å; I470-V474 WeakPolarHBondContact O-CG2 3.47Å; I470-V474 PolarHBondContact O-N 3.03Å
471	Q	51.7	Low	49.5	Very low	136 Å²	136	130.5 Å²	130.5	64%	0.636	66%	0.659	S	S	*	*	H	α-helix	trans	-63.2	-29.8	-179.3	-67.3	-172.1	-6.7	0	0	113	G469 R475	G469-Q471 PolarHBondContact O-N 2.94Å; Q471-R475 WeakPolarHBondContact O-CB 3.3Å; Q471-R475 PolarHBondContact O-N 2.74Å
472	T	55.6	Low	50.7	Low	80 Å²	80	127.2 Å²	127.2	49%	0.491	65%	0.647	S	S	.	*	H	α-helix	trans	-71.2	-44	178.7	-47.1	0	0	0	0	110.8	T468 G469 I470 R475 M476	T468-T472 PolarHBondContact O-OG1 2.87Å; G469-T472 PolarHBondContact O-N 3.43Å; I470-T472 PolarHBondContact O-N 2.92Å; T472-R475 PolarHBondContact O-N 2.93Å; T472-M476 WeakPolarHBondContact O-CG 3.01Å; T472-M476 PolarHBondContact O-N 3Å
473	A	53.3	Low	51.9	Low	65 Å²	65	125.5 Å²	125.5	54%	0.537	64%	0.64	S	S	.	*	H	α-helix	trans	-64.8	-44	174.9	0	0	0	0	0	112	I470 R475 M476 L477	I470-A473 PolarHBondContact O-N 2.67Å; A473-R475 VanDerWaalsContact C-N 3.31Å; A473-R475 PolarHBondContact O-N 2.83Å; A473-M476 PolarHBondContact O-N 2.92Å; A473-L477 WeakPolarHBondContact O-CB 3.17Å; A473-L477 PolarHBondContact O-N 3Å
474	V	63.3	Low	52.9	Low	89 Å²	89	119.5 Å²	119.5	54%	0.539	63%	0.625	S	S	.	*	H	α-helix	trans	-62.3	-38.6	176	172.4	0	0	0	0	111.5	I470 L477 D478	I470-V474 HydrophobicContact CG2-CG2 4.13Å; I470-V474 WeakPolarHBondContact O-CG2 3.47Å; I470-V474 PolarHBondContact O-N 3.03Å; V474-L477 PolarHBondContact O-N 3.3Å; V474-D478 WeakPolarHBondContact O-CB 3.18Å; V474-D478 PolarHBondContact O-N 2.83Å
475	R	62.3	Low	54	Low	187 Å²	187	118.2 Å²	118.2	71%	0.706	63%	0.626	S	S	*	*	H	α-helix	trans	-72	-37.4	177.9	-168.2	173.9	-172.9	163	2.4	112.8	Q471 T472 A473 L477 Q479	Q471-R475 WeakPolarHBondContact O-CB 3.3Å; Q471-R475 PolarHBondContact O-N 2.74Å; T472-R475 PolarHBondContact O-N 2.93Å; A473-R475 VanDerWaalsContact C-N 3.31Å; A473-R475 PolarHBondContact O-N 2.83Å; R475-L477 VanDerWaalsContact C-N 3.33Å; R475-Q479 VanDerWaalsContact O-CB 3.27Å; R475-Q479 WeakPolarHBondContact O-CB 3.31Å; R475-Q479 PolarHBondContact O-N 2.9Å
476	M	52.3	Low	54.4	Low	132 Å²	132	118 Å²	118	65%	0.65	62%	0.617	S	S	*	*	H	α-helix	trans	-61.5	-42.9	170	-74.1	-66.6	-156.4	0	0	111.1	T472 A473 Q479 T480	T472-M476 WeakPolarHBondContact O-CG 3.01Å; T472-M476 PolarHBondContact O-N 3Å; A473-M476 PolarHBondContact O-N 2.92Å; M476-Q479 PolarHBondContact O-N 2.97Å; M476-T480 WeakPolarHBondContact O-CG2 3.33Å; M476-T480 PolarHBondContact O-N 2.78Å; M476-T480 PolarHBondContact O-OG1 3.26Å
477	L	60.6	Low	54.8	Low	106 Å²	106	122.1 Å²	122.1	56%	0.555	62%	0.624	S	S	*	*	H	α-helix	trans	-67.9	-42.7	179.2	-168.2	69.4	0	0	0	112.7	A473 V474 R475 Q479 T480 L481	A473-L477 WeakPolarHBondContact O-CB 3.17Å; A473-L477 PolarHBondContact O-N 3Å; V474-L477 PolarHBondContact O-N 3.3Å; R475-L477 VanDerWaalsContact C-N 3.33Å; L477-Q479 PolarHBondContact O-N 3.27Å; L477-T480 PolarHBondContact O-N 3.43Å; L477-T480 PolarHBondContact O-OG1 2.91Å; L477-T480 VanDerWaalsContact O-OG1 3.12Å; L477-L481 HydrophobicContact CG-CD1 4.04Å; L477-L481 HydrophobicContact CG-CG 4.46Å; L477-L481 VanDerWaalsContact O-CB 3.31Å; L477-L481 WeakPolarHBondContact O-CB 3.47Å; L477-L481 WeakPolarHBondContact O-CG 3.43Å; L477-L481 PolarHBondContact O-N 2.98Å
478	D	67.2	Low	55.1	Low	72 Å²	72	123 Å²	123	39%	0.385	62%	0.62	S	S	.	*	H	α-helix	trans	-60.8	-36.1	172.6	-174.7	40.7	0	0	0	111.1	V474 R482	V474-D478 WeakPolarHBondContact O-CB 3.18Å; V474-D478 PolarHBondContact O-N 2.83Å; D478-R482 WeakPolarHBondContact O-CB 3.49Å; D478-R482 WeakPolarHBondContact O-CD 3.4Å; D478-R482 WeakPolarHBondContact O-CG 3.43Å; D478-R482 PolarHBondContact O-N 2.97Å; D478-R482 VanDerWaalsContact O-N 3.09Å; D478-R482 IonicContact OD1-CZ 3.07Å; D478-R482 IonicContact OD1-NE 3.39Å; D478-R482 PolarHBondContact OD1-NE 3.09Å; D478-R482 IonicContact OD1-NH2 2.79Å; D478-R482 PolarHBondContact OD1-NH2 2.98Å; D478-R482 IonicContact OD2-CZ 3.25Å; D478-R482 IonicContact OD2-NE 2.66Å; D478-R482 PolarHBondContact OD2-NE 3.01Å; D478-R482 VanDerWaalsContact OD2-NE 3.08Å; D478-R482 IonicContact OD2-NH2 2.69Å; D478-R482 PolarHBondContact OD2-NH2 2.86Å
479	Q	63.5	Low	54.6	Low	111 Å²	111	124 Å²	124	52%	0.519	62%	0.621	S	S	.	*	H	α-helix	trans	-76.6	-34.4	179.4	-165.2	145.6	-15.4	0	0	113.4	R475 M476 L477 N483	R475-Q479 VanDerWaalsContact O-CB 3.27Å; R475-Q479 WeakPolarHBondContact O-CB 3.31Å; R475-Q479 PolarHBondContact O-N 2.9Å; M476-Q479 PolarHBondContact O-N 2.97Å; L477-Q479 PolarHBondContact O-N 3.27Å; Q479-N483 WeakPolarHBondContact O-CB 3.47Å; Q479-N483 PolarHBondContact O-N 2.92Å; Q479-N483 PolarHBondContact O-ND2 2.92Å
480	T	58.8	Low	54.6	Low	85 Å²	85	127.8 Å²	127.8	52%	0.521	64%	0.639	S	S	.	*	H	α-helix	trans	-73.5	-38.2	172.5	53.9	0	0	0	0	112.3	M476 L477 R482 N483 L484	M476-T480 WeakPolarHBondContact O-CG2 3.33Å; M476-T480 PolarHBondContact O-N 2.78Å; M476-T480 PolarHBondContact O-OG1 3.26Å; L477-T480 PolarHBondContact O-N 3.43Å; L477-T480 PolarHBondContact O-OG1 2.91Å; L477-T480 VanDerWaalsContact O-OG1 3.12Å; T480-R482 VanDerWaalsContact C-N 3.35Å; T480-R482 PolarHBondContact O-N 2.84Å; T480-N483 CarbonylContact O-C 3.59Å; T480-N483 VanDerWaalsContact O-C 3.28Å; T480-N483 PolarHBondContact O-N 3.16Å; T480-L484 PolarHBondContact O-N 3.02Å; T480-L484 VanDerWaalsContact O-N 3.1Å
481	L	62.5	Low	54.7	Low	105 Å²	105	129.8 Å²	129.8	55%	0.55	64%	0.643	S	S	.	*	H	α-helix	trans	-65.8	-35.1	175.6	-71	172.9	0	0	0	112.6	L477 L484	L477-L481 HydrophobicContact CG-CD1 4.04Å; L477-L481 HydrophobicContact CG-CG 4.46Å; L477-L481 VanDerWaalsContact O-CB 3.31Å; L477-L481 WeakPolarHBondContact O-CB 3.47Å; L477-L481 WeakPolarHBondContact O-CG 3.43Å; L477-L481 PolarHBondContact O-N 2.98Å; L481-L484 HydrophobicContact CD2-CD1 4.19Å
482	R	62.2	Low	54.8	Low	180 Å²	180	128.3 Å²	128.3	68%	0.679	65%	0.645	S	S	*	*	H	α-helix	trans	-71.6	-29.4	173	-73.3	169.4	-164	-107.8	6.1	113.4	D478 T480	D478-R482 WeakPolarHBondContact O-CB 3.49Å; D478-R482 WeakPolarHBondContact O-CD 3.4Å; D478-R482 WeakPolarHBondContact O-CG 3.43Å; D478-R482 PolarHBondContact O-N 2.97Å; D478-R482 VanDerWaalsContact O-N 3.09Å; D478-R482 IonicContact OD1-CZ 3.07Å; D478-R482 IonicContact OD1-NE 3.39Å; D478-R482 PolarHBondContact OD1-NE 3.09Å; D478-R482 IonicContact OD1-NH2 2.79Å; D478-R482 PolarHBondContact OD1-NH2 2.98Å; D478-R482 IonicContact OD2-CZ 3.25Å; D478-R482 IonicContact OD2-NE 2.66Å; D478-R482 PolarHBondContact OD2-NE 3.01Å; D478-R482 VanDerWaalsContact OD2-NE 3.08Å; D478-R482 IonicContact OD2-NH2 2.69Å; D478-R482 PolarHBondContact OD2-NH2 2.86Å; T480-R482 VanDerWaalsContact C-N 3.35Å; T480-R482 PolarHBondContact O-N 2.84Å
483	N	55.7	Low	54.7	Low	110 Å²	110	134.8 Å²	134.8	59%	0.588	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	33.5	-178.1	-63	-16.3	0	0	0	112.1	Q479 T480 N485	Q479-N483 WeakPolarHBondContact O-CB 3.47Å; Q479-N483 PolarHBondContact O-N 2.92Å; Q479-N483 PolarHBondContact O-ND2 2.92Å; T480-N483 CarbonylContact O-C 3.59Å; T480-N483 VanDerWaalsContact O-C 3.28Å; T480-N483 PolarHBondContact O-N 3.16Å; N483-N485 PolarHBondContact O-N 2.78Å
484	L	51.9	Low	54.8	Low	114 Å²	114	139 Å²	139	60%	0.597	67%	0.673	S	S	*	*			trans	-61.9	108.9	169.5	-84.2	164.8	0	0	0	109	T480 L481 I486	T480-L484 PolarHBondContact O-N 3.02Å; T480-L484 VanDerWaalsContact O-N 3.1Å; L481-L484 HydrophobicContact CD2-CD1 4.19Å; L484-I486 PolarHBondContact O-N 2.82Å
485	N	52.9	Low	54.6	Low	155 Å²	155	142.6 Å²	142.6	83%	0.829	69%	0.689	S	S	*	*			trans	-68.4	81.4	168.3	-83.7	-13.1	0	0	0	109.1	N483 Y487	N483-N485 PolarHBondContact O-N 2.78Å; N485-Y487 PolarHBondContact O-N 3.28Å
486	I	43.4	Very low	54.4	Low	119 Å²	119	137 Å²	137	61%	0.61	68%	0.678	S	S	*	*			trans	-60.8	105.2	169.3	-58.4	169.2	0	0	0	106.8	L484 R488	L484-I486 PolarHBondContact O-N 2.82Å; I486-R488 HydrophobicContact CG2-CG 3.89Å; I486-R488 PolarHBondContact O-N 2.99Å
487	Y	40.5	Very low	54.8	Low	230 Å²	230	138.7 Å²	138.7	90%	0.902	69%	0.688	S	S	*	*			trans	-58	106.6	165.1	-100.9	-93	0	0	0	108	N485	N485-Y487 PolarHBondContact O-N 3.28Å
488	R	45.4	Very low	54.6	Low	199 Å²	199	142.2 Å²	142.2	75%	0.751	70%	0.702	S	S	*	*			trans	-101	123.7	171.8	-73.3	-168.7	174.1	178.1	-1.4	109.5	I486	I486-R488 HydrophobicContact CG2-CG 3.89Å; I486-R488 PolarHBondContact O-N 2.99Å
489	D	40.4	Very low	54.1	Low	143 Å²	143	144.9 Å²	144.9	77%	0.765	72%	0.721	S	S	*	*			trans	68.7	118.9	163.8	-50.2	-37.2	0	0	0	117.8	K491	D489-K491 PolarHBondContact O-N 2.8Å
490	S	49.2	Very low	53.3	Low	131 Å²	131	145 Å²	145	92%	0.916	73%	0.732	S	S	*	*	S	Bend	trans	-79.3	20.4	172.3	50.9	0	0	0	0	113.9
491	K	56	Low	53	Low	177 Å²	177	150.3 Å²	150.3	77%	0.77	74%	0.743	S	S	*	*	S	Bend	trans	-105.6	122.4	179.6	-72.2	-174.2	177.8	179.3	0	110.9	D489 R493	D489-K491 PolarHBondContact O-N 2.8Å; K491-R493 PolarHBondContact O-N 3.15Å
492	P	54.3	Low	52.8	Low	105 Å²	105	150.8 Å²	150.8	68%	0.682	75%	0.751	S	S	*	*			trans	-66.1	131.2	-178.8	26.3	-33.6	0	0	0	111.3	L494	P492-L494 PolarHBondContact O-N 2.98Å
493	R	53	Low	52.4	Low	216 Å²	216	149.5 Å²	149.5	82%	0.815	75%	0.753	S	S	*	*			trans	-74.9	83.6	175.2	-78.3	-179.6	142	-168.3	-6.1	111.4	K491 D495 S496	K491-R493 PolarHBondContact O-N 3.15Å; R493-D495 PolarHBondContact O-N 3.02Å; R493-S496 PolarHBondContact O-N 3.39Å; R493-S496 PolarHBondContact O-OG 3.31Å
494	L	56.2	Low	52.1	Low	154 Å²	154	152.9 Å²	152.9	81%	0.806	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-17.8	-179.7	-69.9	167.7	0	0	0	114.4	P492 S496	P492-L494 PolarHBondContact O-N 2.98Å; L494-S496 VanDerWaalsContact C-N 3.26Å; L494-S496 PolarHBondContact O-N 3.01Å
495	D	57.7	Low	52.1	Low	164 Å²	164	156.5 Å²	156.5	88%	0.877	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	3.6	-178.6	-50.9	-48.3	0	0	0	114.1	R493	R493-D495 PolarHBondContact O-N 3.02Å
496	S	59.1	Low	51.9	Low	68 Å²	68	158.5 Å²	158.5	48%	0.476	78%	0.779	S	S	.	*	S	Bend	trans	-91.8	114.5	-179.4	-36.7	0	0	0	0	109.8	R493 L494 Q498	R493-S496 PolarHBondContact O-N 3.39Å; R493-S496 PolarHBondContact O-OG 3.31Å; L494-S496 VanDerWaalsContact C-N 3.26Å; L494-S496 PolarHBondContact O-N 3.01Å; S496-Q498 PolarHBondContact O-N 3.12Å
497	I	60.3	Low	52.3	Low	168 Å²	168	164.4 Å²	164.4	86%	0.862	79%	0.794	S	S	*	*			trans	-60.1	111.2	175.1	-60.9	173.2	0	0	0	108.8	T499	I497-T499 PolarHBondContact O-N 2.91Å
498	Q	55.7	Low	52.7	Low	180 Å²	180	160.6 Å²	160.6	84%	0.841	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.5	124.3	177.6	-64.7	-177.1	-0.1	0	0	109.6	S496	S496-Q498 PolarHBondContact O-N 3.12Å
499	T	57.5	Low	53.2	Low	128 Å²	128	160 Å²	160	79%	0.785	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-66.6	129.5	167.8	48.9	0	0	0	0	109	I497 Y501	I497-T499 PolarHBondContact O-N 2.91Å; T499-Y501 PolarHBondContact O-N 3.29Å
500	P	47.5	Very low	54	Low	115 Å²	115	162.4 Å²	162.4	75%	0.747	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-61.7	133	-176.4	24.8	-33.8	0	0	0	111.1	T502	P500-T502 PolarHBondContact O-N 3.12Å
501	Y	51.1	Low	54.2	Low	195 Å²	195	163.5 Å²	163.5	77%	0.765	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-61.7	119.6	179.1	172.5	-102.6	0	0	0	111.2	T499 E503	T499-Y501 PolarHBondContact O-N 3.29Å; Y501-E503 HydrophobicContact CD1-CG 4.46Å; Y501-E503 HydrophobicContact CE1-CB 4.42Å; Y501-E503 HydrophobicContact CE1-CG 3.6Å
502	T	58.9	Low	53.9	Low	115 Å²	115	160.1 Å²	160.1	71%	0.706	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-101.5	118.9	169.4	53.4	0	0	0	0	109.7	P500 M504	P500-T502 PolarHBondContact O-N 3.12Å; T502-M504 PolarHBondContact O-N 3.15Å
503	E	52.7	Low	53.8	Low	154 Å²	154	161 Å²	161	72%	0.72	79%	0.794	S	S	*	*			trans	-56.4	112.5	174.3	-76.1	-172.1	152.8	0	0	111.6	Y501 K505	Y501-E503 HydrophobicContact CD1-CG 4.46Å; Y501-E503 HydrophobicContact CE1-CB 4.42Å; Y501-E503 HydrophobicContact CE1-CG 3.6Å; E503-K505 PolarHBondContact O-N 3.08Å
504	M	49.9	Very low	53.6	Low	180 Å²	180	158.9 Å²	158.9	89%	0.887	80%	0.798	S	S	*	*			trans	-70.3	101.6	163.8	-88	-159.1	165.1	0	0	109.3	T502 K506	T502-M504 PolarHBondContact O-N 3.15Å; M504-K506 PolarHBondContact O-N 3.44Å
505	K	51.5	Low	53.5	Low	191 Å²	191	162.6 Å²	162.6	83%	0.83	80%	0.801	S	S	*	*			trans	-53.8	111.7	167.4	-70.1	-174	177.5	-177.4	0	108.9	E503 R507	E503-K505 PolarHBondContact O-N 3.08Å; K505-R507 PolarHBondContact O-N 3.1Å
506	K	50.1	Low	53.3	Low	197 Å²	197	159.9 Å²	159.9	86%	0.857	79%	0.792	S	S	*	*			trans	-55.2	105.8	177.3	-67.1	-178.3	-178.9	179.1	0	108.8	M504 I508	M504-K506 PolarHBondContact O-N 3.44Å; K506-I508 PolarHBondContact O-N 3.12Å
507	R	50.8	Low	53.2	Low	243 Å²	243	164.4 Å²	164.4	92%	0.917	81%	0.809	S	S	*	*			trans	-69.8	88.6	167.6	-75.2	-173.4	177.6	-178	-0.3	107.6	K505 K509	K505-R507 PolarHBondContact O-N 3.1Å; R507-K509 PolarHBondContact O-N 2.84Å
508	I	49.6	Very low	52.9	Low	149 Å²	149	159.3 Å²	159.3	76%	0.764	78%	0.783	S	S	*	*			trans	-52.7	114.7	160.9	-60.3	170.9	0	0	0	105.1	K506 E510	K506-I508 PolarHBondContact O-N 3.12Å; I508-E510 PolarHBondContact O-N 3.01Å; I508-E510 VanDerWaalsContact O-N 3.13Å
509	K	55.6	Low	53.7	Low	187 Å²	187	157.4 Å²	157.4	81%	0.813	77%	0.774	S	S	*	*			trans	-61	118.7	168.1	-74.8	179.1	177.1	172.7	0	105.6	R507 L511	R507-K509 PolarHBondContact O-N 2.84Å; K509-L511 PolarHBondContact O-N 3.08Å
510	E	56.5	Low	54.2	Low	193 Å²	193	155.6 Å²	155.6	90%	0.902	76%	0.764	S	S	*	*			trans	-56.6	105	172.4	-69.2	-177.8	170.2	0	0	107.7	I508	I508-E510 PolarHBondContact O-N 3.01Å; I508-E510 VanDerWaalsContact O-N 3.13Å
511	L	53.8	Low	55.4	Low	154 Å²	154	154.8 Å²	154.8	81%	0.806	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-65.1	139.7	170.1	-74.7	163.7	0	0	0	106.9	K509	K509-L511 PolarHBondContact O-N 3.08Å
512	P	49.6	Very low	56.3	Low	106 Å²	106	149.8 Å²	149.8	69%	0.688	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-56.1	143.4	173.9	25.8	-33.9	0	0	0	108.9	L514	P512-L514 PolarHBondContact O-N 3.19Å
513	P	52.7	Low	56.7	Low	124 Å²	124	150.8 Å²	150.8	81%	0.805	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-55.8	128.8	-175	22.1	-33.1	0	0	0	110.1	R515	P513-R515 PolarHBondContact O-N 2.69Å
514	L	48.7	Very low	57.6	Low	171 Å²	171	147.5 Å²	147.5	90%	0.895	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-53.7	128.5	172.8	-69.1	170.7	0	0	0	108.2	P512	P512-L514 PolarHBondContact O-N 3.19Å
515	R	53.9	Low	58.8	Low	233 Å²	233	144.9 Å²	144.9	88%	0.879	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-58.2	135.2	175.9	-57.5	-170.6	-152.8	178.4	9.4	107.9	P513 I517	P513-R515 PolarHBondContact O-N 2.69Å; R515-I517 PolarHBondContact O-N 3.27Å
516	P	54.6	Low	59.9	Low	107 Å²	107	140.8 Å²	140.8	70%	0.695	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-58	141.5	179.1	24.2	-33.4	0	0	0	110.1	M518	P516-M518 WeakPolarHBondContact O-CG 3.24Å; P516-M518 PolarHBondContact O-N 3.48Å
517	I	55.8	Low	60.7	Low	163 Å²	163	136.2 Å²	136.2	84%	0.836	68%	0.675	S	S	*	*			trans	-66.3	100.3	-178.6	-60.6	171.6	0	0	0	108.4	R515	R515-I517 PolarHBondContact O-N 3.27Å
518	M	54.2	Low	61.9	Low	61 Å²	61	128.3 Å²	128.3	30%	0.3	65%	0.651	S	S	.	*			trans	-74.2	137.7	-179.1	-59.1	-167.1	81.3	0	0	110.8	P516 Q522 R523	P516-M518 WeakPolarHBondContact O-CG 3.24Å; P516-M518 PolarHBondContact O-N 3.48Å; M518-Q522 HydrophobicContact CB-CB 4.37Å; M518-Q522 HydrophobicContact CE-CB 3.95Å; M518-Q522 HydrophobicContact CE-CG 4.45Å; M518-R523 PolarHBondContact O-NE 3.29Å; M518-R523 PolarHBondContact O-NH2 3.14Å; M518-R523 VanDerWaalsContact O-NH2 3.07Å
519	Q	72.5	Confident	63.2	Low	140 Å²	140	127.8 Å²	127.8	65%	0.654	64%	0.643	S	S	*	*			trans	-62.2	153.2	179	-71.1	-158.1	-3.5	0	0	110.8	V521 Q522 R523	Q519-V521 PolarHBondContact O-N 3.42Å; Q519-V521 VanDerWaalsContact O-N 3.09Å; Q519-Q522 PolarHBondContact O-N 3.27Å; Q519-R523 PolarHBondContact O-N 2.78Å
520	P	67.7	Low	63.8	Low	90 Å²	90	125.7 Å²	125.7	58%	0.584	64%	0.636	S	S	*	*	H	α-helix	trans	-52.7	-38.3	-173	-28.4	35.8	0	0	0	113.9	R523 V524	P520-R523 PolarHBondContact O-N 2.95Å; P520-V524 WeakPolarHBondContact O-CG2 3.32Å; P520-V524 PolarHBondContact O-N 3.48Å; P520-V524 VanDerWaalsContact O-N 3.11Å
521	V	72.4	Confident	64.2	Low	97 Å²	97	121.6 Å²	121.6	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-62.6	-46.3	179.7	-173.5	0	0	0	0	111.8	Q519 R523 V524 E525	Q519-V521 PolarHBondContact O-N 3.42Å; Q519-V521 VanDerWaalsContact O-N 3.09Å; V521-R523 VanDerWaalsContact C-N 3.32Å; V521-R523 PolarHBondContact O-N 2.94Å; V521-V524 PolarHBondContact O-N 2.9Å; V521-V524 VanDerWaalsContact O-N 3.15Å; V521-E525 PolarHBondContact O-N 2.91Å
522	Q	70.3	Confident	64.6	Low	90 Å²	90	122.2 Å²	122.2	42%	0.421	62%	0.615	S	S	.	*	H	α-helix	trans	-65.8	-35.8	178.6	-71.4	175.4	-33.1	0	0	112.1	M518 Q519 V524 E525 E526	M518-Q522 HydrophobicContact CB-CB 4.37Å; M518-Q522 HydrophobicContact CE-CB 3.95Å; M518-Q522 HydrophobicContact CE-CG 4.45Å; Q519-Q522 PolarHBondContact O-N 3.27Å; Q522-V524 VanDerWaalsContact C-N 3.31Å; Q522-V524 PolarHBondContact O-N 3.15Å; Q522-E525 PolarHBondContact O-N 2.88Å; Q522-E526 PolarHBondContact O-N 2.84Å
523	R	67	Low	65	Low	137 Å²	137	122.7 Å²	122.7	52%	0.517	61%	0.612	S	S	.	*	H	α-helix	trans	-62	-38.8	173.2	-109.7	-177.3	-72.1	163.3	-5	112.3	M518 Q519 P520 V521 L527	M518-R523 PolarHBondContact O-NE 3.29Å; M518-R523 PolarHBondContact O-NH2 3.14Å; M518-R523 VanDerWaalsContact O-NH2 3.07Å; Q519-R523 PolarHBondContact O-N 2.78Å; P520-R523 PolarHBondContact O-N 2.95Å; V521-R523 VanDerWaalsContact C-N 3.32Å; V521-R523 PolarHBondContact O-N 2.94Å; R523-L527 WeakPolarHBondContact O-CB 3.45Å; R523-L527 PolarHBondContact O-N 3.46Å
524	V	72.8	Confident	65.2	Low	85 Å²	85	120.7 Å²	120.7	52%	0.515	60%	0.601	S	S	.	*	H	α-helix	trans	-69.2	-39.7	175.4	172.3	0	0	0	0	111.2	P520 V521 Q522 L527 I528	P520-V524 WeakPolarHBondContact O-CG2 3.32Å; P520-V524 PolarHBondContact O-N 3.48Å; P520-V524 VanDerWaalsContact O-N 3.11Å; V521-V524 PolarHBondContact O-N 2.9Å; V521-V524 VanDerWaalsContact O-N 3.15Å; Q522-V524 VanDerWaalsContact C-N 3.31Å; Q522-V524 PolarHBondContact O-N 3.15Å; V524-L527 PolarHBondContact O-N 3.11Å; V524-I528 HydrophobicContact CG1-CD1 3.75Å; V524-I528 HydrophobicContact CG1-CG1 4.42Å; V524-I528 WeakPolarHBondContact O-CB 3.34Å; V524-I528 VanDerWaalsContact O-CG1 3.23Å; V524-I528 WeakPolarHBondContact O-CG1 3.5Å; V524-I528 PolarHBondContact O-N 3.18Å
525	E	75.8	Confident	65.5	Low	125 Å²	125	123.7 Å²	123.7	58%	0.584	60%	0.6	S	S	*	*	H	α-helix	trans	-65.2	-40.3	175.2	-71	-179.6	156.8	0	0	112.9	V521 Q522 I528 K529	V521-E525 PolarHBondContact O-N 2.91Å; Q522-E525 PolarHBondContact O-N 2.88Å; E525-I528 PolarHBondContact O-N 3.4Å; E525-K529 WeakPolarHBondContact O-CB 3.11Å; E525-K529 PolarHBondContact O-N 2.9Å
526	E	74.4	Confident	65.4	Low	105 Å²	105	117.6 Å²	117.6	49%	0.491	60%	0.6	S	S	.	*	H	α-helix	trans	-64.2	-43.8	171.8	-73.2	-168.5	153.3	0	0	111.5	Q522 I528 K529 E530	Q522-E526 PolarHBondContact O-N 2.84Å; E526-I528 VanDerWaalsContact C-N 3.34Å; E526-I528 PolarHBondContact O-N 2.82Å; E526-K529 WeakPolarHBondContact O-CB 3.37Å; E526-K529 PolarHBondContact O-N 2.95Å; E526-K529 VanDerWaalsContact O-N 3.12Å; E526-E530 PolarHBondContact O-N 3.42Å
527	L	67.1	Low	65.5	Low	100 Å²	100	116.9 Å²	116.9	52%	0.524	60%	0.603	S	S	.	*	H	α-helix	trans	-58.5	-44.5	173.8	-122.8	89.2	0	0	0	112	R523 V524 K529 E530 I531	R523-L527 WeakPolarHBondContact O-CB 3.45Å; R523-L527 PolarHBondContact O-N 3.46Å; V524-L527 PolarHBondContact O-N 3.11Å; L527-K529 VanDerWaalsContact C-N 3.25Å; L527-K529 PolarHBondContact O-N 3.14Å; L527-E530 PolarHBondContact O-N 3.33Å; L527-I531 WeakPolarHBondContact O-CB 3.49Å; L527-I531 WeakPolarHBondContact O-CD1 3.22Å; L527-I531 WeakPolarHBondContact O-CG1 3.49Å; L527-I531 PolarHBondContact O-N 3.12Å
528	I	75.8	Confident	65.5	Low	78 Å²	78	117.3 Å²	117.3	40%	0.4	60%	0.599	S	S	.	*	H	α-helix	trans	-64.5	-32.9	178.2	-72.1	165.8	0	0	0	111	V524 E525 E526 K532	V524-I528 HydrophobicContact CG1-CD1 3.75Å; V524-I528 HydrophobicContact CG1-CG1 4.42Å; V524-I528 WeakPolarHBondContact O-CB 3.34Å; V524-I528 VanDerWaalsContact O-CG1 3.23Å; V524-I528 WeakPolarHBondContact O-CG1 3.5Å; V524-I528 PolarHBondContact O-N 3.18Å; E525-I528 PolarHBondContact O-N 3.4Å; E526-I528 VanDerWaalsContact C-N 3.34Å; E526-I528 PolarHBondContact O-N 2.82Å; I528-K532 HydrophobicContact CG2-CD 4.36Å; I528-K532 WeakPolarHBondContact O-CB 3.49Å; I528-K532 VanDerWaalsContact O-CG 3.27Å; I528-K532 WeakPolarHBondContact O-CG 3.43Å; I528-K532 PolarHBondContact O-N 2.88Å; I528-K532 VanDerWaalsContact O-N 3.08Å
529	K	75.3	Confident	65.7	Low	137 Å²	137	121.1 Å²	121.1	60%	0.596	63%	0.625	S	S	*	*	H	α-helix	trans	-70.2	-44.6	173.6	-169.6	-178.2	176.7	-171.7	0	111.2	E525 E526 L527 I531 K532 D533	E525-K529 WeakPolarHBondContact O-CB 3.11Å; E525-K529 PolarHBondContact O-N 2.9Å; E526-K529 WeakPolarHBondContact O-CB 3.37Å; E526-K529 PolarHBondContact O-N 2.95Å; E526-K529 VanDerWaalsContact O-N 3.12Å; L527-K529 VanDerWaalsContact C-N 3.25Å; L527-K529 PolarHBondContact O-N 3.14Å; K529-I531 PolarHBondContact O-N 3.45Å; K529-K532 WeakPolarHBondContact O-CB 3.42Å; K529-K532 PolarHBondContact O-N 2.83Å; K529-K532 VanDerWaalsContact O-N 3.16Å; K529-D533 PolarHBondContact O-N 2.99Å
530	E	69.4	Low	65.3	Low	143 Å²	143	117.2 Å²	117.2	67%	0.668	61%	0.611	S	S	*	*	H	α-helix	trans	-61.9	-41	175.6	-124.4	173.2	-171.6	0	0	112.2	E526 L527 K532 D533 S534	E526-E530 PolarHBondContact O-N 3.42Å; L527-E530 PolarHBondContact O-N 3.33Å; E530-K532 PolarHBondContact O-N 3.41Å; E530-D533 CarbonylContact O-C 3.5Å; E530-D533 PolarHBondContact O-N 3.22Å; E530-S534 WeakPolarHBondContact O-CB 3.46Å; E530-S534 PolarHBondContact O-N 3.42Å
531	I	63.6	Low	65.2	Low	107 Å²	107	116.6 Å²	116.6	55%	0.549	61%	0.609	S	S	.	*	H	α-helix	trans	-63.4	-39.8	173.8	-69.5	163.1	0	0	0	111	L527 K529 S534	L527-I531 WeakPolarHBondContact O-CB 3.49Å; L527-I531 WeakPolarHBondContact O-CD1 3.22Å; L527-I531 WeakPolarHBondContact O-CG1 3.49Å; L527-I531 PolarHBondContact O-N 3.12Å; K529-I531 PolarHBondContact O-N 3.45Å; I531-S534 WeakPolarHBondContact O-CB 2.82Å; I531-S534 PolarHBondContact O-N 2.86Å; I531-S534 PolarHBondContact O-OG 2.91Å
532	K	64	Low	64.9	Low	168 Å²	168	116 Å²	116	73%	0.73	60%	0.602	S	S	*	*	H	α-helix	trans	-68	-32.9	174.2	-77.2	172.5	-179.5	176.9	0	113.3	I528 K529 E530	I528-K532 HydrophobicContact CG2-CD 4.36Å; I528-K532 WeakPolarHBondContact O-CB 3.49Å; I528-K532 VanDerWaalsContact O-CG 3.27Å; I528-K532 WeakPolarHBondContact O-CG 3.43Å; I528-K532 PolarHBondContact O-N 2.88Å; I528-K532 VanDerWaalsContact O-N 3.08Å; K529-K532 WeakPolarHBondContact O-CB 3.42Å; K529-K532 PolarHBondContact O-N 2.83Å; K529-K532 VanDerWaalsContact O-N 3.16Å; E530-K532 PolarHBondContact O-N 3.41Å
533	D	57.9	Low	64.8	Low	115 Å²	115	113.8 Å²	113.8	62%	0.615	60%	0.603	S	S	*	*	H	α-helix	trans	-83	-13.1	176.5	-71.5	-27.8	0	0	0	112.6	K529 E530 R535	K529-D533 PolarHBondContact O-N 2.99Å; E530-D533 CarbonylContact O-C 3.5Å; E530-D533 PolarHBondContact O-N 3.22Å; D533-R535 PolarHBondContact O-N 3.01Å
534	S	55.2	Low	64.7	Low	82 Å²	82	110.1 Å²	110.1	57%	0.573	60%	0.598	S	S	*	*			trans	-66.6	93	177.2	78.2	0	0	0	0	111.9	E530 I531 A536	E530-S534 WeakPolarHBondContact O-CB 3.46Å; E530-S534 PolarHBondContact O-N 3.42Å; I531-S534 WeakPolarHBondContact O-CB 2.82Å; I531-S534 PolarHBondContact O-N 2.86Å; I531-S534 PolarHBondContact O-OG 2.91Å; S534-A536 PolarHBondContact O-N 3.41Å
535	R	56.2	Low	64.6	Low	234 Å²	234	106.5 Å²	106.5	88%	0.883	58%	0.577	S	S	*	*			trans	-66.4	125.3	174.7	-66.3	-178.8	179	-179.9	0.2	109.8	D533 A537	D533-R535 PolarHBondContact O-N 3.01Å; R535-A537 PolarHBondContact O-N 3.18Å
536	A	52.2	Low	64.2	Low	105 Å²	105	103.7 Å²	103.7	87%	0.868	57%	0.565	S	S	*	*			trans	-51.6	107.2	177.5	0	0	0	0	0	111.6	S534 K538	S534-A536 PolarHBondContact O-N 3.41Å; A536-K538 PolarHBondContact O-N 2.92Å
537	A	55.5	Low	64	Low	93 Å²	93	106.9 Å²	106.9	77%	0.769	58%	0.579	S	S	*	*			trans	-76.8	107.6	-176.4	0	0	0	0	0	110.5	R535 V539	R535-A537 PolarHBondContact O-N 3.18Å; A537-V539 PolarHBondContact O-N 3.21Å
538	K	56.8	Low	63.9	Low	171 Å²	171	106.3 Å²	106.3	74%	0.743	58%	0.577	S	S	*	*			trans	-78.4	103.7	173.4	-173	-174	177.5	-172.9	0	109.7	A536 V540	A536-K538 PolarHBondContact O-N 2.92Å; K538-V540 HydrophobicContact CD-CG2 4.12Å; K538-V540 HydrophobicContact CG-CG2 3.96Å; K538-V540 PolarHBondContact O-N 3.04Å
539	V	57.2	Low	63.1	Low	142 Å²	142	111.3 Å²	111.3	86%	0.861	59%	0.591	S	S	*	*			trans	-71.1	124.5	173.8	-176.5	0	0	0	0	109.5	A537	A537-V539 PolarHBondContact O-N 3.21Å
540	V	64.6	Low	62.3	Low	57 Å²	57	109.1 Å²	109.1	35%	0.345	60%	0.598	S	S	.	*			trans	-133.4	134.9	178.1	-171.6	0	0	0	0	109	K538 L542 V545	K538-V540 HydrophobicContact CD-CG2 4.12Å; K538-V540 HydrophobicContact CG-CG2 3.96Å; K538-V540 PolarHBondContact O-N 3.04Å; V540-L542 PolarHBondContact O-N 2.95Å; V540-V545 HydrophobicContact CB-CG2 4.37Å; V540-V545 HydrophobicContact CG1-CG2 3.58Å
541	S	66.3	Low	61.9	Low	78 Å²	78	105.2 Å²	105.2	55%	0.545	59%	0.591	S	S	.	*			trans	-70.6	124.1	-176.7	61.8	0	0	0	0	111.9	G543 S544 V545	S541-G543 PolarHBondContact O-N 3.42Å; S541-G543 VanDerWaalsContact O-N 3.14Å; S541-S544 PolarHBondContact O-N 3.25Å; S541-S544 PolarHBondContact O-OG 3.42Å; S541-S544 WeakPolarHBondContact OG-CB 3.49Å; S541-S544 PolarHBondContact OG-OG 3.33Å; S541-V545 PolarHBondContact O-N 3.14Å
542	L	66.5	Low	61.8	Low	85 Å²	85	103.6 Å²	103.6	45%	0.445	58%	0.583	S	S	.	*	H	α-helix	trans	-55.7	-36.5	-175.7	-172.6	69.3	0	0	0	112.9	V540 S544 V545 L546 A559 L563	V540-L542 PolarHBondContact O-N 2.95Å; L542-S544 PolarHBondContact O-N 3.24Å; L542-V545 PolarHBondContact O-N 3.41Å; L542-L546 HydrophobicContact CD1-CD1 4.45Å; L542-L546 HydrophobicContact CD2-CD1 4.45Å; L542-L546 HydrophobicContact CG-CD1 3.98Å; L542-L546 HydrophobicContact CG-CG 4.41Å; L542-L546 WeakPolarHBondContact O-CG 3.34Å; L542-L546 PolarHBondContact O-N 3.07Å; L542-A559 HydrophobicContact CD1-CB 3.79Å; L542-L563 HydrophobicContact CD2-CD2 4.34Å
543	G	67.4	Low	62.1	Low	43 Å²	43	98.5 Å²	98.5	44%	0.443	57%	0.569	S	S	.	*	H	α-helix	trans	-60.4	-41.9	176.7	0	0	0	0	0	113.4	S541 H547	S541-G543 PolarHBondContact O-N 3.42Å; S541-G543 VanDerWaalsContact O-N 3.14Å; G543-H547 PolarHBondContact O-N 2.82Å; G543-H547 PolarHBondContact O-ND1 3.48Å
544	S	65.4	Low	62.9	Low	60 Å²	60	100.4 Å²	100.4	42%	0.42	57%	0.571	S	S	.	*	H	α-helix	trans	-69	-39.1	179	69	0	0	0	0	112.2	S541 L542 N548	S541-S544 PolarHBondContact O-N 3.25Å; S541-S544 PolarHBondContact O-OG 3.42Å; S541-S544 WeakPolarHBondContact OG-CB 3.49Å; S541-S544 PolarHBondContact OG-OG 3.33Å; L542-S544 PolarHBondContact O-N 3.24Å; S544-N548 PolarHBondContact O-N 3.28Å
545	V	70.5	Confident	63.8	Low	9 Å²	9	99 Å²	99	6%	0.055	56%	0.558	C	S	.	*	H	α-helix	trans	-64.6	-42.7	177.8	178.5	0	0	0	0	111.4	V540 S541 L542 D555 Y556 A559	V540-V545 HydrophobicContact CB-CG2 4.37Å; V540-V545 HydrophobicContact CG1-CG2 3.58Å; S541-V545 PolarHBondContact O-N 3.14Å; L542-V545 PolarHBondContact O-N 3.41Å; V545-D555 HydrophobicContact CG1-CB 4.19Å; V545-Y556 WeakPolarHBondContact O-CD2 3.35Å; V545-A559 HydrophobicContact CG1-CB 4.1Å
546	L	67.6	Low	64.8	Low	66 Å²	66	90.1 Å²	90.1	35%	0.346	52%	0.524	S	S	.	.	H	α-helix	trans	-71	-29.6	-177.8	-70.9	174.5	0	0	0	113.8	L542 Y556	L542-L546 HydrophobicContact CD1-CD1 4.45Å; L542-L546 HydrophobicContact CD2-CD1 4.45Å; L542-L546 HydrophobicContact CG-CD1 3.98Å; L542-L546 HydrophobicContact CG-CG 4.41Å; L542-L546 WeakPolarHBondContact O-CG 3.34Å; L542-L546 PolarHBondContact O-N 3.07Å; L546-Y556 HydrophobicContact CD2-CD2 4.31Å; L546-Y556 HydrophobicContact CD2-CE2 3.97Å
547	H	69.1	Low	66	Low	171 Å²	171	93.9 Å²	93.9	79%	0.792	52%	0.516	S	S	*	.	H	α-helix	trans	-83.1	-32	-180	-73.4	77.1	0	0	0	113.2	G543 R549	G543-H547 PolarHBondContact O-N 2.82Å; G543-H547 PolarHBondContact O-ND1 3.48Å; H547-R549 PolarHBondContact O-N 2.95Å
548	N	65.2	Low	67.1	Low	89 Å²	89	94.7 Å²	94.7	48%	0.476	50%	0.504	S	S	.	.			trans	-103.4	69.9	-176.6	-161.2	-17	0	0	0	113.1	S544 A550 A551	S544-N548 PolarHBondContact O-N 3.28Å; N548-A550 PolarHBondContact O-N 2.9Å; N548-A550 VanDerWaalsContact O-N 3.12Å; N548-A551 PolarHBondContact O-N 3.41Å; N548-A551 WeakPolarHBondContact OD1-CB 3.36Å; N548-A551 PolarHBondContact OD1-N 2.73Å
549	R	59.6	Low	68.2	Low	182 Å²	182	87 Å²	87	69%	0.687	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-21.1	-175.1	-163.2	178.4	-173.9	-165.3	1.4	114.9	H547 Y556	H547-R549 PolarHBondContact O-N 2.95Å; R549-Y556 HydrophobicContact CG-CD1 4.34Å; R549-Y556 HydrophobicContact CG-CE1 4.03Å; R549-Y556 HydrophobicContact CG-CE2 4.38Å
550	A	57.7	Low	69.3	Low	91 Å²	91	83.3 Å²	83.3	75%	0.752	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-37.1	-175.9	0	0	0	0	0	113.5	N548	N548-A550 PolarHBondContact O-N 2.9Å; N548-A550 VanDerWaalsContact O-N 3.12Å
551	A	60.4	Low	70.1	Confident	62 Å²	62	86.6 Å²	86.6	51%	0.512	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-46.8	-174.9	0	0	0	0	0	113.2	N548	N548-A551 PolarHBondContact O-N 3.41Å; N548-A551 WeakPolarHBondContact OD1-CB 3.36Å; N548-A551 PolarHBondContact OD1-N 2.73Å
552	N	62.7	Low	70.8	Confident	72 Å²	72	87.6 Å²	87.6	39%	0.385	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	59.4	-172	-64.7	-17	0	0	0	111.9	K554 D555 Y556	N552-K554 PolarHBondContact O-N 3.41Å; N552-K554 VanDerWaalsContact O-N 3.14Å; N552-D555 HydrophobicContact CB-CB 4.13Å; N552-D555 PolarHBondContact O-N 3.21Å; N552-Y556 WeakPolarHBondContact O-CB 3.19Å; N552-Y556 PolarHBondContact O-N 3.14Å
553	S	70.9	Confident	71.6	Confident	61 Å²	61	86.9 Å²	86.9	43%	0.427	45%	0.452	S	S	.	.	H	α-helix	trans	-56.2	-30.2	-175.6	-176.8	0	0	0	0	114.5	R557	S553-R557 WeakPolarHBondContact O-CG 3.34Å; S553-R557 PolarHBondContact O-N 3.2Å
554	K	74.8	Confident	72.4	Confident	155 Å²	155	93.5 Å²	93.5	67%	0.674	46%	0.464	S	S	*	.	H	α-helix	trans	-72.1	-56.8	176.6	-170.2	-178.8	176.4	-171.5	0	111	N552 Y556 R557 E558	N552-K554 PolarHBondContact O-N 3.41Å; N552-K554 VanDerWaalsContact O-N 3.14Å; K554-Y556 PolarHBondContact O-N 2.79Å; K554-R557 WeakPolarHBondContact O-CB 3.4Å; K554-R557 PolarHBondContact O-N 3.48Å; K554-E558 PolarHBondContact O-N 3.18Å
555	D	73	Confident	73.4	Confident	53 Å²	53	93.3 Å²	93.3	28%	0.283	46%	0.459	S	S	.	.	H	α-helix	trans	-57.9	-36.4	179.9	-49.6	-0.1	0	0	0	111.3	V545 N552 E558 A559	V545-D555 HydrophobicContact CG1-CB 4.19Å; N552-D555 HydrophobicContact CB-CB 4.13Å; N552-D555 PolarHBondContact O-N 3.21Å; D555-E558 PolarHBondContact O-N 3.19Å; D555-A559 VanDerWaalsContact O-CB 3.27Å; D555-A559 WeakPolarHBondContact O-CB 3.36Å; D555-A559 PolarHBondContact O-N 3.16Å
556	Y	77.4	Confident	73.9	Confident	47 Å²	47	99.1 Å²	99.1	18%	0.184	49%	0.486	C	S	.	.	H	α-helix	trans	-63.6	-40.6	174.3	-178.7	-98.2	0	0	0	113.3	V545 L546 R549 N552 K554 L560	V545-Y556 WeakPolarHBondContact O-CD2 3.35Å; L546-Y556 HydrophobicContact CD2-CD2 4.31Å; L546-Y556 HydrophobicContact CD2-CE2 3.97Å; R549-Y556 HydrophobicContact CG-CD1 4.34Å; R549-Y556 HydrophobicContact CG-CE1 4.03Å; R549-Y556 HydrophobicContact CG-CE2 4.38Å; N552-Y556 WeakPolarHBondContact O-CB 3.19Å; N552-Y556 PolarHBondContact O-N 3.14Å; K554-Y556 PolarHBondContact O-N 2.79Å; Y556-L560 HydrophobicContact CD1-CD1 3.93Å; Y556-L560 HydrophobicContact CE1-CD1 3.37Å; Y556-L560 HydrophobicContact CE1-CG 4.3Å; Y556-L560 WeakPolarHBondContact O-CB 3.44Å; Y556-L560 WeakPolarHBondContact O-CG 3.36Å; Y556-L560 PolarHBondContact O-N 3.16Å; Y556-L560 VanDerWaalsContact O-N 3.09Å
557	R	76.8	Confident	74.7	Confident	184 Å²	184	102.7 Å²	102.7	69%	0.694	50%	0.499	S	S	*	.	H	α-helix	trans	-68	-39.1	175.3	-72.3	174.8	-175.9	-160.7	0.7	111.6	S553 K554 L560 F561	S553-R557 WeakPolarHBondContact O-CG 3.34Å; S553-R557 PolarHBondContact O-N 3.2Å; K554-R557 WeakPolarHBondContact O-CB 3.4Å; K554-R557 PolarHBondContact O-N 3.48Å; R557-L560 PolarHBondContact O-N 3.43Å; R557-F561 WeakPolarHBondContact O-CB 3.47Å; R557-F561 PolarHBondContact O-N 3.38Å
558	E	79.4	Confident	75.4	Confident	110 Å²	110	101 Å²	101	51%	0.514	49%	0.489	S	S	.	.	H	α-helix	trans	-68.9	-44.3	-180	-162.9	150	-164.4	0	0	111.2	K554 D555 L560 F561 L562	K554-E558 PolarHBondContact O-N 3.18Å; D555-E558 PolarHBondContact O-N 3.19Å; E558-L560 PolarHBondContact O-N 3.19Å; E558-F561 WeakPolarHBondContact O-CB 3.41Å; E558-F561 PolarHBondContact O-N 3.19Å; E558-F561 VanDerWaalsContact O-N 3.15Å; E558-L562 WeakPolarHBondContact O-CG 3.35Å; E558-L562 PolarHBondContact O-N 3.05Å
559	A	80.6	Confident	76.1	Confident	11 Å²	11	100.6 Å²	100.6	9%	0.091	49%	0.49	C	S	.	.	H	α-helix	trans	-57.4	-44.7	170.8	0	0	0	0	0	112.8	L542 V545 D555 F561 L562 L563	L542-A559 HydrophobicContact CD1-CB 3.79Å; V545-A559 HydrophobicContact CG1-CB 4.1Å; D555-A559 VanDerWaalsContact O-CB 3.27Å; D555-A559 WeakPolarHBondContact O-CB 3.36Å; D555-A559 PolarHBondContact O-N 3.16Å; A559-F561 VanDerWaalsContact C-N 3.33Å; A559-F561 PolarHBondContact O-N 3.47Å; A559-L562 PolarHBondContact O-N 3.33Å; A559-L563 WeakPolarHBondContact O-CB 3.27Å; A559-L563 WeakPolarHBondContact O-CG 3.46Å; A559-L563 PolarHBondContact O-N 2.96Å
560	L	79.2	Confident	77.1	Confident	63 Å²	63	98.5 Å²	98.5	33%	0.33	49%	0.488	S	S	.	.	H	α-helix	trans	-66	-33	175.7	-76.5	177.8	0	0	0	113.3	Y556 R557 E558 R564	Y556-L560 HydrophobicContact CD1-CD1 3.93Å; Y556-L560 HydrophobicContact CE1-CD1 3.37Å; Y556-L560 HydrophobicContact CE1-CG 4.3Å; Y556-L560 WeakPolarHBondContact O-CB 3.44Å; Y556-L560 WeakPolarHBondContact O-CG 3.36Å; Y556-L560 PolarHBondContact O-N 3.16Å; Y556-L560 VanDerWaalsContact O-N 3.09Å; R557-L560 PolarHBondContact O-N 3.43Å; E558-L560 PolarHBondContact O-N 3.19Å; L560-R564 WeakPolarHBondContact O-CG 3.4Å; L560-R564 PolarHBondContact O-N 3.13Å; L560-R564 VanDerWaalsContact O-N 3.14Å
561	F	80.7	Confident	78.4	Confident	126 Å²	126	100.7 Å²	100.7	55%	0.553	48%	0.477	S	S	*	.	H	α-helix	trans	-68.7	-46.4	174.9	178.8	-104.4	0	0	0	111.3	R557 E558 A559 R564 N565	R557-F561 WeakPolarHBondContact O-CB 3.47Å; R557-F561 PolarHBondContact O-N 3.38Å; E558-F561 WeakPolarHBondContact O-CB 3.41Å; E558-F561 PolarHBondContact O-N 3.19Å; E558-F561 VanDerWaalsContact O-N 3.15Å; A559-F561 VanDerWaalsContact C-N 3.33Å; A559-F561 PolarHBondContact O-N 3.47Å; F561-R564 WeakPolarHBondContact O-CB 3.3Å; F561-R564 PolarHBondContact O-N 3.33Å; F561-N565 WeakPolarHBondContact CE1-ND2 3.45Å; F561-N565 VanDerWaalsContact CZ-ND2 3.33Å; F561-N565 WeakPolarHBondContact CZ-ND2 3.32Å; F561-N565 PolarHBondContact O-N 3.1Å
562	L	82.9	Confident	79.5	Confident	100 Å²	100	103.2 Å²	103.2	52%	0.524	48%	0.48	S	S	.	.	H	α-helix	trans	-60.3	-46.8	175.6	-68.9	170.6	0	0	0	111.6	E558 A559 R564 N565 M566	E558-L562 WeakPolarHBondContact O-CG 3.35Å; E558-L562 PolarHBondContact O-N 3.05Å; A559-L562 PolarHBondContact O-N 3.33Å; L562-R564 VanDerWaalsContact C-N 3.3Å; L562-R564 PolarHBondContact O-N 3.37Å; L562-N565 PolarHBondContact O-N 3.11Å; L562-M566 WeakPolarHBondContact O-CG 3.48Å; L562-M566 PolarHBondContact O-N 3.5Å
563	L	82.4	Confident	80.4	Confident	69 Å²	69	104.1 Å²	104.1	36%	0.361	49%	0.488	S	S	.	.	H	α-helix	trans	-58.6	-37.9	175.3	-76.2	168.4	0	0	0	113	L542 A559 K567	L542-L563 HydrophobicContact CD2-CD2 4.34Å; A559-L563 WeakPolarHBondContact O-CB 3.27Å; A559-L563 WeakPolarHBondContact O-CG 3.46Å; A559-L563 PolarHBondContact O-N 2.96Å; L563-K567 WeakPolarHBondContact O-CB 3.4Å; L563-K567 PolarHBondContact O-N 3.24Å
564	R	83.7	Confident	81	Confident	183 Å²	183	105.7 Å²	105.7	69%	0.691	49%	0.488	S	S	*	.	H	α-helix	trans	-67.2	-37.5	174	-78.5	176	176.8	-176.8	-0.2	112.4	L560 F561 L562 K568	L560-R564 WeakPolarHBondContact O-CG 3.4Å; L560-R564 PolarHBondContact O-N 3.13Å; L560-R564 VanDerWaalsContact O-N 3.14Å; F561-R564 WeakPolarHBondContact O-CB 3.3Å; F561-R564 PolarHBondContact O-N 3.33Å; L562-R564 VanDerWaalsContact C-N 3.3Å; L562-R564 PolarHBondContact O-N 3.37Å; R564-K568 WeakPolarHBondContact O-CG 3.41Å; R564-K568 PolarHBondContact O-N 2.98Å; R564-K568 VanDerWaalsContact O-N 3.16Å
565	N	86.8	Confident	81.4	Confident	56 Å²	56	102.6 Å²	102.6	30%	0.299	48%	0.479	S	S	.	.	H	α-helix	trans	-70.6	-44	177.1	-71.3	-14.4	0	0	0	111.4	F561 L562 K567 K568 T569	F561-N565 WeakPolarHBondContact CE1-ND2 3.45Å; F561-N565 VanDerWaalsContact CZ-ND2 3.33Å; F561-N565 WeakPolarHBondContact CZ-ND2 3.32Å; F561-N565 PolarHBondContact O-N 3.1Å; L562-N565 PolarHBondContact O-N 3.11Å; N565-K567 VanDerWaalsContact C-N 3.3Å; N565-K567 PolarHBondContact O-N 3.27Å; N565-K568 CarbonylContact O-C 3.59Å; N565-K568 WeakPolarHBondContact O-CA 3.43Å; N565-K568 WeakPolarHBondContact O-CB 3.49Å; N565-K568 PolarHBondContact O-N 3.02Å; N565-T569 PolarHBondContact O-N 3.19Å; N565-T569 PolarHBondContact O-OG1 3.03Å
566	M	81.9	Confident	81.6	Confident	130 Å²	130	108.2 Å²	108.2	64%	0.64	50%	0.496	S	S	*	.	H	α-helix	trans	-58.3	-41	172.9	-66.5	-176	83	0	0	112	L562 K568 T569 H570	L562-M566 WeakPolarHBondContact O-CG 3.48Å; L562-M566 PolarHBondContact O-N 3.5Å; M566-K568 PolarHBondContact O-N 3.04Å; M566-T569 WeakPolarHBondContact CA-OG1 3.3Å; M566-T569 PolarHBondContact O-N 3.41Å; M566-T569 PolarHBondContact O-OG1 3.32Å; M566-T569 VanDerWaalsContact O-OG1 3.1Å; M566-H570 VanDerWaalsContact O-CB 3.32Å; M566-H570 WeakPolarHBondContact O-CB 3.45Å; M566-H570 PolarHBondContact O-N 3.12Å
567	K	83.8	Confident	81.7	Confident	141 Å²	141	108.4 Å²	108.4	61%	0.613	50%	0.502	S	S	*	.	H	α-helix	trans	-71.2	-11.6	174.5	-164.8	171.5	-177.9	172.6	0	113.9	L563 N565 R571	L563-K567 WeakPolarHBondContact O-CB 3.4Å; L563-K567 PolarHBondContact O-N 3.24Å; N565-K567 VanDerWaalsContact C-N 3.3Å; N565-K567 PolarHBondContact O-N 3.27Å; K567-R571 PolarHBondContact O-NE 3.27Å; K567-R571 PolarHBondContact O-NH2 3.11Å
568	K	83.8	Confident	82	Confident	135 Å²	135	104.2 Å²	104.2	59%	0.587	49%	0.492	S	S	*	.	H	α-helix	trans	-90	-46.4	169.5	-77.5	178.4	173.8	-174.6	0	111.2	R564 N565 M566 R571 M572	R564-K568 WeakPolarHBondContact O-CG 3.41Å; R564-K568 PolarHBondContact O-N 2.98Å; R564-K568 VanDerWaalsContact O-N 3.16Å; N565-K568 CarbonylContact O-C 3.59Å; N565-K568 WeakPolarHBondContact O-CA 3.43Å; N565-K568 WeakPolarHBondContact O-CB 3.49Å; N565-K568 PolarHBondContact O-N 3.02Å; M566-K568 PolarHBondContact O-N 3.04Å; K568-R571 PolarHBondContact O-N 3.27Å; K568-M572 PolarHBondContact O-N 3.4Å
569	T	79.5	Confident	81.9	Confident	81 Å²	81	104 Å²	104	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-63.7	-45.1	179.2	54.1	0	0	0	0	111.3	N565 M566 R571 M572 V573	N565-T569 PolarHBondContact O-N 3.19Å; N565-T569 PolarHBondContact O-OG1 3.03Å; M566-T569 WeakPolarHBondContact CA-OG1 3.3Å; M566-T569 PolarHBondContact O-N 3.41Å; M566-T569 PolarHBondContact O-OG1 3.32Å; M566-T569 VanDerWaalsContact O-OG1 3.1Å; T569-R571 VanDerWaalsContact C-N 3.27Å; T569-R571 PolarHBondContact O-N 3.48Å; T569-M572 PolarHBondContact O-N 2.84Å; T569-M572 VanDerWaalsContact O-N 3.17Å; T569-V573 WeakPolarHBondContact O-CG2 3.2Å; T569-V573 PolarHBondContact O-N 3.24Å
570	H	81.8	Confident	81.5	Confident	139 Å²	139	109.2 Å²	109.2	64%	0.644	51%	0.513	S	S	*	.	H	α-helix	trans	-58.4	-37.8	174.7	-175.1	-55.3	0	0	0	112.4	M566 H574	M566-H570 VanDerWaalsContact O-CB 3.32Å; M566-H570 WeakPolarHBondContact O-CB 3.45Å; M566-H570 PolarHBondContact O-N 3.12Å; H570-H574 VanDerWaalsContact O-CB 3.29Å; H570-H574 WeakPolarHBondContact O-CB 3.49Å; H570-H574 PolarHBondContact O-N 3.11Å
571	R	84.5	Confident	81	Confident	136 Å²	136	111.2 Å²	111.2	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-67.5	-48.2	175	-88.1	-176.1	-76.1	-178.8	0.6	111.4	K567 K568 T569 V573 H574 D575	K567-R571 PolarHBondContact O-NE 3.27Å; K567-R571 PolarHBondContact O-NH2 3.11Å; K568-R571 PolarHBondContact O-N 3.27Å; T569-R571 VanDerWaalsContact C-N 3.27Å; T569-R571 PolarHBondContact O-N 3.48Å; R571-V573 VanDerWaalsContact C-N 3.29Å; R571-V573 PolarHBondContact O-N 3.32Å; R571-H574 PolarHBondContact O-N 3Å; R571-H574 VanDerWaalsContact O-N 3.12Å; R571-D575 WeakPolarHBondContact O-CB 3.22Å; R571-D575 PolarHBondContact O-N 2.97Å; R571-D575 VanDerWaalsContact O-OD2 3.12Å
572	M	83.4	Confident	80.7	Confident	115 Å²	115	107.4 Å²	107.4	57%	0.567	51%	0.513	S	S	*	.	H	α-helix	trans	-58.6	-38	177.1	-171.3	-169	-57.1	0	0	113.4	K568 T569 R576	K568-M572 PolarHBondContact O-N 3.4Å; T569-M572 PolarHBondContact O-N 2.84Å; T569-M572 VanDerWaalsContact O-N 3.17Å; M572-R576 WeakPolarHBondContact O-CB 3.39Å; M572-R576 PolarHBondContact O-N 3.3Å; M572-R576 VanDerWaalsContact O-N 3.08Å
573	V	81.6	Confident	79.8	Confident	92 Å²	92	110.2 Å²	110.2	56%	0.558	52%	0.516	S	S	*	.	H	α-helix	trans	-68	-45.6	175.2	171.8	0	0	0	0	110.6	T569 R571 R576 T577	T569-V573 WeakPolarHBondContact O-CG2 3.2Å; T569-V573 PolarHBondContact O-N 3.24Å; R571-V573 VanDerWaalsContact C-N 3.29Å; R571-V573 PolarHBondContact O-N 3.32Å; V573-R576 WeakPolarHBondContact O-CB 3.31Å; V573-R576 PolarHBondContact O-N 3.05Å; V573-T577 PolarHBondContact O-N 3.4Å; V573-T577 PolarHBondContact O-OG1 2.87Å
574	H	82.6	Confident	79	Confident	93 Å²	93	113 Å²	113	43%	0.431	53%	0.531	S	S	.	.	H	α-helix	trans	-62.5	-46.2	176.9	-176	58	0	0	0	112.1	H570 R571 R576 T577 M578	H570-H574 VanDerWaalsContact O-CB 3.29Å; H570-H574 WeakPolarHBondContact O-CB 3.49Å; H570-H574 PolarHBondContact O-N 3.11Å; R571-H574 PolarHBondContact O-N 3Å; R571-H574 VanDerWaalsContact O-N 3.12Å; H574-R576 PolarHBondContact O-N 3.38Å; H574-T577 PolarHBondContact O-N 3.46Å; H574-T577 PolarHBondContact O-OG1 3.21Å; H574-M578 WeakPolarHBondContact O-CG 3.4Å; H574-M578 PolarHBondContact O-N 2.86Å
575	D	82.8	Confident	77.8	Confident	91 Å²	91	111.9 Å²	111.9	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-60	-37.5	176.8	-58.9	-27.9	0	0	0	110.5	R571 E579	R571-D575 WeakPolarHBondContact O-CB 3.22Å; R571-D575 PolarHBondContact O-N 2.97Å; R571-D575 VanDerWaalsContact O-OD2 3.12Å; D575-E579 PolarHBondContact O-N 3.47Å
576	R	78.4	Confident	76.3	Confident	170 Å²	170	118.6 Å²	118.6	64%	0.642	56%	0.561	S	S	*	*	H	α-helix	trans	-67.2	-43.3	173.2	-89.2	-174.4	173.2	-179.6	0.2	114.1	M572 V573 H574 M578 E579 Q580	M572-R576 WeakPolarHBondContact O-CB 3.39Å; M572-R576 PolarHBondContact O-N 3.3Å; M572-R576 VanDerWaalsContact O-N 3.08Å; V573-R576 WeakPolarHBondContact O-CB 3.31Å; V573-R576 PolarHBondContact O-N 3.05Å; H574-R576 PolarHBondContact O-N 3.38Å; R576-M578 VanDerWaalsContact C-N 3.34Å; R576-E579 PolarHBondContact O-N 3.24Å; R576-Q580 WeakPolarHBondContact O-CG 3.41Å; R576-Q580 PolarHBondContact O-N 2.71Å
577	T	79.4	Confident	74.4	Confident	52 Å²	52	122.7 Å²	122.7	32%	0.319	58%	0.578	S	S	.	*	H	α-helix	trans	-67.3	-39	177.2	49.2	0	0	0	0	110.7	V573 H574 E579 Q580 E581	V573-T577 PolarHBondContact O-N 3.4Å; V573-T577 PolarHBondContact O-OG1 2.87Å; H574-T577 PolarHBondContact O-N 3.46Å; H574-T577 PolarHBondContact O-OG1 3.21Å; T577-E579 VanDerWaalsContact C-N 3.34Å; T577-E579 PolarHBondContact O-N 3.47Å; T577-Q580 PolarHBondContact O-N 3.31Å; T577-Q580 VanDerWaalsContact O-N 3.12Å; T577-E581 WeakPolarHBondContact O-CB 3.26Å; T577-E581 WeakPolarHBondContact O-CG 3.06Å; T577-E581 PolarHBondContact O-N 2.98Å
578	M	82.1	Confident	73.9	Confident	95 Å²	95	121.8 Å²	121.8	47%	0.468	58%	0.576	S	S	.	*	H	α-helix	trans	-63.5	-37.3	173.2	-61.4	-62.4	-70.3	0	0	112	H574 R576 A582	H574-M578 WeakPolarHBondContact O-CG 3.4Å; H574-M578 PolarHBondContact O-N 2.86Å; R576-M578 VanDerWaalsContact C-N 3.34Å; M578-A582 VanDerWaalsContact O-CB 3.23Å; M578-A582 WeakPolarHBondContact O-CB 3.33Å; M578-A582 PolarHBondContact O-N 2.89Å
579	E	78.8	Confident	73.4	Confident	106 Å²	106	121.1 Å²	121.1	50%	0.495	58%	0.576	S	S	.	*	H	α-helix	trans	-65.2	-36.2	170.6	-85.3	-167.3	-163.5	0	0	113.2	D575 R576 T577 R583	D575-E579 PolarHBondContact O-N 3.47Å; R576-E579 PolarHBondContact O-N 3.24Å; T577-E579 VanDerWaalsContact C-N 3.34Å; T577-E579 PolarHBondContact O-N 3.47Å; E579-R583 VanDerWaalsContact O-CG 3.26Å; E579-R583 WeakPolarHBondContact O-CG 3.43Å; E579-R583 PolarHBondContact O-N 2.77Å; E579-R583 VanDerWaalsContact O-N 3.11Å; E579-R583 IonicContact OE2-NH2 3.12Å; E579-R583 PolarHBondContact OE2-NH2 3.02Å; E579-R583 VanDerWaalsContact OE2-NH2 3.12Å
580	Q	71.8	Confident	73	Confident	121 Å²	121	123.3 Å²	123.3	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-70.6	-45.5	177.4	-74.9	175.5	-47.5	0	0	111.4	R576 T577 A582 R583 L584	R576-Q580 WeakPolarHBondContact O-CG 3.41Å; R576-Q580 PolarHBondContact O-N 2.71Å; T577-Q580 PolarHBondContact O-N 3.31Å; T577-Q580 VanDerWaalsContact O-N 3.12Å; Q580-A582 VanDerWaalsContact C-N 3.33Å; Q580-A582 PolarHBondContact O-N 3.42Å; Q580-R583 PolarHBondContact O-N 2.79Å; Q580-L584 WeakPolarHBondContact O-CG 3.31Å; Q580-L584 PolarHBondContact O-N 3.23Å
581	E	69.1	Low	72.5	Confident	104 Å²	104	122.4 Å²	122.4	49%	0.486	58%	0.576	S	S	.	*	H	α-helix	trans	-60.9	-41	174.1	-72.3	173.8	-164.7	0	0	111.6	T577 R583 L584 Q585	T577-E581 WeakPolarHBondContact O-CB 3.26Å; T577-E581 WeakPolarHBondContact O-CG 3.06Å; T577-E581 PolarHBondContact O-N 2.98Å; E581-R583 VanDerWaalsContact C-N 3.35Å; E581-R583 PolarHBondContact O-N 2.95Å; E581-L584 PolarHBondContact O-N 3.08Å; E581-Q585 WeakPolarHBondContact O-CG 3.36Å; E581-Q585 PolarHBondContact O-N 3.35Å
582	A	73.6	Confident	71.8	Confident	46 Å²	46	121.6 Å²	121.6	38%	0.38	58%	0.58	S	S	.	*	H	α-helix	trans	-63.9	-37.1	175	0	0	0	0	0	112.6	M578 Q580 Q585 F586	M578-A582 VanDerWaalsContact O-CB 3.23Å; M578-A582 WeakPolarHBondContact O-CB 3.33Å; M578-A582 PolarHBondContact O-N 2.89Å; Q580-A582 VanDerWaalsContact C-N 3.33Å; Q580-A582 PolarHBondContact O-N 3.42Å; A582-Q585 PolarHBondContact O-N 2.73Å; A582-F586 WeakPolarHBondContact O-CD2 3.49Å; A582-F586 PolarHBondContact O-N 2.86Å
583	R	64.3	Low	71	Confident	160 Å²	160	122 Å²	122	60%	0.604	58%	0.581	S	S	*	*	H	α-helix	trans	-67.1	-41.1	175.3	-72.4	170.4	-161.3	-157.4	8.7	111.9	E579 Q580 E581 Q585 F586 E587	E579-R583 VanDerWaalsContact O-CG 3.26Å; E579-R583 WeakPolarHBondContact O-CG 3.43Å; E579-R583 PolarHBondContact O-N 2.77Å; E579-R583 VanDerWaalsContact O-N 3.11Å; E579-R583 IonicContact OE2-NH2 3.12Å; E579-R583 PolarHBondContact OE2-NH2 3.02Å; E579-R583 VanDerWaalsContact OE2-NH2 3.12Å; Q580-R583 PolarHBondContact O-N 2.79Å; E581-R583 VanDerWaalsContact C-N 3.35Å; E581-R583 PolarHBondContact O-N 2.95Å; R583-Q585 PolarHBondContact O-N 3.11Å; R583-Q585 VanDerWaalsContact O-N 3.15Å; R583-F586 PolarHBondContact O-N 3.2Å; R583-E587 PolarHBondContact O-N 3.09Å
584	L	66.4	Low	70.2	Confident	126 Å²	126	124.1 Å²	124.1	66%	0.66	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-7.5	174.8	-67.3	169.2	0	0	0	114	Q580 E581	Q580-L584 WeakPolarHBondContact O-CG 3.31Å; Q580-L584 PolarHBondContact O-N 3.23Å; E581-L584 PolarHBondContact O-N 3.08Å
585	Q	57.6	Low	69.3	Low	161 Å²	161	126.5 Å²	126.5	75%	0.752	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-4.2	171.6	-70.3	179.3	8.1	0	0	113.4	E581 A582 R583	E581-Q585 WeakPolarHBondContact O-CG 3.36Å; E581-Q585 PolarHBondContact O-N 3.35Å; A582-Q585 PolarHBondContact O-N 2.73Å; R583-Q585 PolarHBondContact O-N 3.11Å; R583-Q585 VanDerWaalsContact O-N 3.15Å
586	F	54.6	Low	68.2	Low	197 Å²	197	129.5 Å²	129.5	86%	0.864	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	-10	178.5	-92.3	-77.9	0	0	0	113.6	A582 R583	A582-F586 WeakPolarHBondContact O-CD2 3.49Å; A582-F586 PolarHBondContact O-N 2.86Å; R583-F586 PolarHBondContact O-N 3.2Å
587	E	42.1	Very low	67.2	Low	216 Å²	216	125.8 Å²	125.8	100%	1.009	60%	0.6	S	S	*	*			trans	-91.6	0	164.2	-68.6	-178.7	164.8	0	0	110.7	R583	R583-E587 PolarHBondContact O-N 3.09Å

Retrieved 587 of 587 residues in 181.5 ms (Link to these results)

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