A0A061IHC6_CRIGR Loading...

CWF19-like protein 1

AlphaFold DB , UniProt , Accession A0A061IHC6, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Cwf19l1, Length 537 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	78	Confident	237 Å²	237	74.6 Å²	74.6	100%	1.167	39%	0.394	S	S	*	.				0	152.2	0	-69.3	178.5	-88.7	0	0	109.2	Q3	M1-Q3 PolarHBondContact O-N 3.27Å
2	A	39.3	Very low	79.4	Confident	103 Å²	103	68.4 Å²	68.4	85%	0.851	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-72.7	116.6	173.1	0	0	0	0	0	109.4
3	Q	58.3	Low	80.6	Confident	129 Å²	129	63.2 Å²	63.2	60%	0.603	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-74.2	140.3	-176.1	-69.6	174.2	-21.9	0	0	110.9	M1	M1-Q3 PolarHBondContact O-N 3.27Å
4	Q	70.8	Confident	81.6	Confident	179 Å²	179	58.7 Å²	58.7	84%	0.836	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-71.8	142.3	-177.9	-70.5	-173.3	-9.1	0	0	111.6
5	P	85	Confident	82.2	Confident	66 Å²	66	57.9 Å²	57.9	43%	0.429	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-74.9	134.2	174.6	31.9	-34.5	0	0	0	110.7	V244	P5-V244 HydrophobicContact CB-CG2 3.87Å
6	L	90.6	Very high	82.8	Confident	29 Å²	29	54.7 Å²	54.7	15%	0.152	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	145.9	173.7	-59.4	166.9	0	0	0	110	D36 S106 L108 S242 I243 P245	L6-D36 WeakPolarHBondContact CA-OD2 3.15Å; L6-S106 VanDerWaalsContact CD1-OG 3.27Å; L6-S106 WeakPolarHBondContact CD1-OG 3.44Å; L6-L108 HydrophobicContact CD1-CB 3.76Å; L6-L108 HydrophobicContact CD1-CD1 4.32Å; L6-L108 HydrophobicContact CD1-CD2 3.95Å; L6-L108 HydrophobicContact CD1-CG 4.23Å; L6-S242 CarbonylContact O-C 3.44Å; L6-S242 WeakPolarHBondContact O-CA 3.39Å; L6-S242 WeakPolarHBondContact O-CB 3.31Å; L6-I243 HydrophobicContact CB-CG2 4.17Å; L6-I243 PolarHBondContact N-O 2.67Å; L6-I243 PolarHBondContact O-N 2.59Å; L6-P245 HydrophobicContact CD1-CG 3.81Å
7	R	93.3	Very high	83.3	Confident	77 Å²	77	55.6 Å²	55.6	29%	0.291	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	109.7	-175.2	-55.5	-170.8	73	-148.2	10.9	109.4	S32 G33 N34 F35 D36	R7-S32 VanDerWaalsContact CZ-O 3.25Å; R7-S32 PolarHBondContact NH1-O 3.25Å; R7-S32 PolarHBondContact NH2-O 3.43Å; R7-G33 PolarHBondContact NH1-O 3.3Å; R7-N34 PolarHBondContact NH1-O 3.05Å; R7-F35 HydrophobicContact CB-CD1 3.87Å; R7-F35 HydrophobicContact CB-CE1 4.28Å; R7-F35 HydrophobicContact CB-CG 4.31Å; R7-F35 CarbonylContact O-C 3.56Å; R7-F35 WeakPolarHBondContact O-CA 3.47Å; R7-D36 PolarHBondContact N-OD2 3.26Å; R7-D36 PolarHBondContact O-N 2.93Å
8	L	94.8	Very high	83.9	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.5	-167.8	-59.3	174.5	0	0	0	111.1	L37 L108 I151 F241 I243	L8-L37 HydrophobicContact CD2-CB 3.76Å; L8-L37 HydrophobicContact CD2-CD1 3.97Å; L8-L37 HydrophobicContact CD2-CG 4.07Å; L8-L108 HydrophobicContact CD1-CD2 3.86Å; L8-L108 HydrophobicContact CD2-CD2 4.37Å; L8-I151 HydrophobicContact CD1-CD1 3.6Å; L8-F241 HydrophobicContact CB-CD1 4.01Å; L8-F241 HydrophobicContact CB-CE1 3.49Å; L8-F241 VanDerWaalsContact CB-CE1 3.49Å; L8-F241 HydrophobicContact CB-CE2 4.22Å; L8-F241 HydrophobicContact CB-CZ 3.6Å; L8-F241 HydrophobicContact CD1-CE1 4.34Å; L8-F241 HydrophobicContact CD1-CE2 3.81Å; L8-F241 HydrophobicContact CD1-CZ 3.57Å; L8-F241 HydrophobicContact CG-CZ 4.23Å; L8-F241 PolarHBondContact N-O 2.86Å; L8-F241 WeakPolarHBondContact O-CD1 3.28Å; L8-F241 PolarHBondContact O-N 3.49Å; L8-I243 HydrophobicContact CD1-CG2 3.48Å; L8-I243 VanDerWaalsContact CD1-CG2 3.48Å; L8-I243 HydrophobicContact CG-CG2 4.33Å
9	L	96.6	Very high	84.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.7	166.8	-61.9	-178.7	0	0	0	109.2	V25 I28 F35 L37 L38 L39 I65 L238 Y239 A240	L9-V25 HydrophobicContact CD1-CB 4.43Å; L9-V25 HydrophobicContact CD1-CG1 3.88Å; L9-V25 HydrophobicContact CD1-CG2 4.02Å; L9-I28 HydrophobicContact CD2-CG2 4.47Å; L9-F35 HydrophobicContact CD1-CG 4.37Å; L9-F35 HydrophobicContact CD2-CD1 3.57Å; L9-F35 HydrophobicContact CD2-CE1 3.51Å; L9-F35 HydrophobicContact CD2-CE2 4.5Å; L9-F35 HydrophobicContact CD2-CG 4.13Å; L9-F35 HydrophobicContact CD2-CZ 4Å; L9-F35 HydrophobicContact CG-CB 4.27Å; L9-F35 HydrophobicContact CG-CD1 3.67Å; L9-F35 HydrophobicContact CG-CE1 4.15Å; L9-F35 HydrophobicContact CG-CG 3.96Å; L9-L37 PolarHBondContact N-O 2.82Å; L9-L38 HydrophobicContact CB-CD1 3.54Å; L9-L38 HydrophobicContact CD1-CD1 4.49Å; L9-L38 CarbonylContact O-C 3.42Å; L9-L38 WeakPolarHBondContact O-CA 3.42Å; L9-L39 PolarHBondContact O-N 3.11Å; L9-I65 HydrophobicContact CD1-CD1 4.08Å; L9-L238 HydrophobicContact CB-CD1 4.37Å; L9-Y239 CarbonylContact C-O 3.5Å; L9-Y239 WeakPolarHBondContact CA-O 3.31Å; L9-A240 HydrophobicContact CD2-CB 3.57Å
10	A	96.8	Very high	84.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	136.7	168.4	0	0	0	0	0	109.6	L39 F194 L226 L238 Y239 F241	A10-L39 CarbonylContact C-O 3.53Å; A10-L39 WeakPolarHBondContact CA-O 3.4Å; A10-F194 HydrophobicContact CB-CD1 3.59Å; A10-F194 HydrophobicContact CB-CD2 4.22Å; A10-F194 HydrophobicContact CB-CE1 3.61Å; A10-F194 HydrophobicContact CB-CE2 4.23Å; A10-F194 HydrophobicContact CB-CG 3.92Å; A10-F194 HydrophobicContact CB-CZ 3.94Å; A10-L226 VanDerWaalsContact C-CD1 3.44Å; A10-L226 HydrophobicContact CB-CD1 3.93Å; A10-L226 VanDerWaalsContact O-CD1 3.32Å; A10-L226 WeakPolarHBondContact O-CD1 3.32Å; A10-L238 CarbonylContact O-C 3.55Å; A10-L238 WeakPolarHBondContact O-CA 3.38Å; A10-Y239 PolarHBondContact N-O 3.13Å; A10-Y239 PolarHBondContact O-N 3Å; A10-F241 HydrophobicContact CB-CE1 4.33Å
11	C	96.9	Very high	85.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	139.6	-178	-175.3	0	0	0	0	111.5	L21 L38 L39 V41 L226 Y237 L238	C11-L21 HydrophobicContact CB-CD1 4.29Å; C11-L38 HydrophobicContact CB-CD1 4.11Å; C11-L39 PolarHBondContact N-O 2.68Å; C11-V41 WeakPolarHBondContact O-CG2 3.26Å; C11-V41 PolarHBondContact O-N 3.17Å; C11-L226 VanDerWaalsContact C-CD1 3.48Å; C11-Y237 WeakPolarHBondContact CA-O 3.29Å; C11-L238 HydrophobicContact CB-CD1 3.77Å
12	G	95.2	Very high	88.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.209	C	C	.	.			trans	-75.4	-151.7	169.4	0	0	0	0	0	112.7	V14 Y237	G12-V14 PolarHBondContact O-N 3.43Å; G12-Y237 PolarHBondContact N-O 2.73Å
13	D	94.7	Very high	90.8	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.189	C	C	.	.			trans	-62.2	125	-179.4	-53.4	-69.1	0	0	0	111.8	G42 N43 L197 N228 V229	D13-G42 WeakPolarHBondContact OD1-CA 3.32Å; D13-N43 HydrophobicContact CB-CB 4.4Å; D13-N43 PolarHBondContact OD1-N 3.2Å; D13-L197 PolarHBondContact OD1-N 2.75Å; D13-L197 PolarHBondContact OD2-N 3.41Å; D13-N228 HydrophobicContact CB-CB 4.17Å; D13-N228 WeakPolarHBondContact CB-ND2 3.32Å; D13-N228 CarbonylContact O-C 3.36Å; D13-N228 VanDerWaalsContact O-CA 3.23Å; D13-N228 WeakPolarHBondContact O-CA 3.44Å; D13-V229 WeakPolarHBondContact O-CG2 3.16Å; D13-V229 PolarHBondContact O-N 3.4Å
14	V	94.2	Very high	92.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.183	C	C	.	.			trans	-90.1	-34.4	178.3	-171.7	0	0	0	0	110.8	G12 G16 K17 F18 L21 N43 F44 V229	G12-V14 PolarHBondContact O-N 3.43Å; V14-G16 VanDerWaalsContact C-N 3.26Å; V14-G16 PolarHBondContact O-N 2.84Å; V14-K17 WeakPolarHBondContact O-CB 3.38Å; V14-K17 WeakPolarHBondContact O-CG 3.49Å; V14-K17 PolarHBondContact O-N 3.42Å; V14-F18 HydrophobicContact CG1-CD1 4.06Å; V14-F18 HydrophobicContact CG1-CE1 4.27Å; V14-L21 HydrophobicContact CG1-CB 4.4Å; V14-L21 HydrophobicContact CG1-CD2 3.99Å; V14-L21 HydrophobicContact CG2-CD2 3.7Å; V14-N43 WeakPolarHBondContact CA-O 3.43Å; V14-N43 PolarHBondContact N-O 3.45Å; V14-F44 HydrophobicContact CB-CD2 4.26Å; V14-F44 HydrophobicContact CG2-CD2 3.83Å; V14-F44 HydrophobicContact CG2-CE2 4.29Å; V14-V229 HydrophobicContact CB-CG2 4.38Å; V14-V229 HydrophobicContact CG1-CG2 4.41Å; V14-V229 HydrophobicContact CG2-CG2 4.31Å
15	D	92	Very high	93.6	Very high	46 Å²	46	28.9 Å²	28.9	25%	0.246	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	46.4	179.5	-53.7	-54.6	0	0	0	112.6	K17 N43 N228	D15-K17 VanDerWaalsContact C-N 3.32Å; D15-K17 PolarHBondContact O-N 2.76Å; D15-N43 PolarHBondContact N-O 3.15Å; D15-N43 WeakPolarHBondContact OD1-CB 3.48Å; D15-N228 PolarHBondContact OD2-ND2 2.91Å
16	G	90.7	Very high	94.1	Very high	7 Å²	7	29.3 Å²	29.3	7%	0.072	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	-4.3	178.5	0	0	0	0	0	116.5	V14 F18 F44 D50	V14-G16 VanDerWaalsContact C-N 3.26Å; V14-G16 PolarHBondContact O-N 2.84Å; G16-F18 VanDerWaalsContact C-N 3.26Å; G16-F18 WeakPolarHBondContact O-CD2 3.48Å; G16-F18 VanDerWaalsContact O-CE2 3.31Å; G16-F18 WeakPolarHBondContact O-CE2 3.37Å; G16-F18 PolarHBondContact O-N 2.74Å; G16-F44 PolarHBondContact N-O 3.19Å; G16-F44 VanDerWaalsContact N-O 3.09Å; G16-D50 VanDerWaalsContact CA-OD2 3.32Å; G16-D50 WeakPolarHBondContact CA-OD2 3.48Å
17	K	92.3	Very high	94.2	Very high	70 Å²	70	31 Å²	31	30%	0.304	15%	0.147	S	C	.	.			trans	-85.9	54.1	-172.9	-54.7	169.4	-158.9	167.2	0	113	V14 D15 D19 V20 L21 V229	V14-K17 WeakPolarHBondContact O-CB 3.38Å; V14-K17 WeakPolarHBondContact O-CG 3.49Å; V14-K17 PolarHBondContact O-N 3.42Å; D15-K17 VanDerWaalsContact C-N 3.32Å; D15-K17 PolarHBondContact O-N 2.76Å; K17-D19 PolarHBondContact O-N 3.38Å; K17-V20 HydrophobicContact CB-CB 4.22Å; K17-V20 HydrophobicContact CB-CG2 4.23Å; K17-V20 PolarHBondContact O-N 2.65Å; K17-L21 PolarHBondContact O-N 3.28Å; K17-V229 HydrophobicContact CB-CG1 4.04Å; K17-V229 HydrophobicContact CD-CG1 4.45Å; K17-V229 VanDerWaalsContact CD-O 3.28Å; K17-V229 WeakPolarHBondContact CD-O 3.43Å; K17-V229 PolarHBondContact NZ-O 2.72Å
18	F	93.1	Very high	94.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-45.1	-170.7	-53.5	-63.6	0	0	0	112.8	V14 G16 V20 L21 F22 F44 F45 D50 E52 W53 Y56	V14-F18 HydrophobicContact CG1-CD1 4.06Å; V14-F18 HydrophobicContact CG1-CE1 4.27Å; G16-F18 VanDerWaalsContact C-N 3.26Å; G16-F18 WeakPolarHBondContact O-CD2 3.48Å; G16-F18 VanDerWaalsContact O-CE2 3.31Å; G16-F18 WeakPolarHBondContact O-CE2 3.37Å; G16-F18 PolarHBondContact O-N 2.74Å; F18-V20 VanDerWaalsContact C-N 3.33Å; F18-V20 PolarHBondContact O-N 3.05Å; F18-L21 PolarHBondContact O-N 3.4Å; F18-F22 HydrophobicContact CB-CD2 4.09Å; F18-F22 HydrophobicContact CB-CE2 4.01Å; F18-F22 WeakPolarHBondContact O-CB 3.35Å; F18-F22 WeakPolarHBondContact O-CD2 3.4Å; F18-F22 WeakPolarHBondContact O-CG 3.4Å; F18-F22 PolarHBondContact O-N 3.08Å; F18-F44 AromaticContact CD1-CE1 3.97Å; F18-F44 HydrophobicContact CD1-CE1 3.97Å; F18-F44 HydrophobicContact CD1-CE2 4.12Å; F18-F44 AromaticContact CD1-CZ 3.7Å; F18-F44 HydrophobicContact CD1-CZ 3.7Å; F18-F44 AromaticContact CE1-CD1 3.66Å; F18-F44 HydrophobicContact CE1-CD1 3.66Å; F18-F44 HydrophobicContact CE1-CD2 4.24Å; F18-F44 AromaticContact CE1-CE1 3.38Å; F18-F44 HydrophobicContact CE1-CE1 3.38Å; F18-F44 AromaticContact CE1-CE2 4Å; F18-F44 HydrophobicContact CE1-CE2 4Å; F18-F44 HydrophobicContact CE1-CG 4.08Å; F18-F44 AromaticContact CE1-CZ 3.56Å; F18-F44 HydrophobicContact CE1-CZ 3.56Å; F18-F44 VanDerWaalsContact CE1-O 3.31Å; F18-F44 WeakPolarHBondContact CE1-O 3.45Å; F18-F44 HydrophobicContact CZ-CD1 4.33Å; F18-F44 HydrophobicContact CZ-CE1 4.23Å; F18-F45 AromaticContact CZ-CD1 3.78Å; F18-F45 HydrophobicContact CZ-CD1 3.78Å; F18-F45 HydrophobicContact CZ-CE1 4.05Å; F18-D50 HydrophobicContact CE2-CB 4.3Å; F18-E52 HydrophobicContact CD2-CB 3.91Å; F18-E52 PolarHBondContact N-OE2 3.32Å; F18-E52 VanDerWaalsContact N-OE2 3.15Å; F18-W53 HydrophobicContact CD2-CB 4.5Å; F18-W53 HydrophobicContact CE2-CB 3.87Å; F18-W53 HydrophobicContact CE2-CE3 4.35Å; F18-W53 HydrophobicContact CZ-CE3 4.33Å; F18-Y56 HydrophobicContact CB-CD2 4.05Å; F18-Y56 HydrophobicContact CB-CE2 3.66Å
19	D	92.6	Very high	93.9	Very high	35 Å²	35	30.2 Å²	30.2	19%	0.187	15%	0.148	C	C	.	.	H	α-helix	trans	-64.1	-36.8	179.2	-84.2	-2.4	0	0	0	112.3	K17 N23 E52 Y56 K61	K17-D19 PolarHBondContact O-N 3.38Å; D19-N23 WeakPolarHBondContact O-CB 3.23Å; D19-N23 PolarHBondContact O-N 2.88Å; D19-N23 PolarHBondContact O-ND2 3.17Å; D19-E52 WeakPolarHBondContact CB-OE2 3.33Å; D19-E52 PolarHBondContact N-OE2 3.28Å; D19-Y56 WeakPolarHBondContact OD1-CE2 3.42Å; D19-Y56 PolarHBondContact OD1-OH 2.75Å; D19-K61 WeakPolarHBondContact OD1-CD 3.43Å; D19-K61 IonicContact OD1-NZ 3.46Å; D19-K61 PolarHBondContact OD1-NZ 2.86Å; D19-K61 IonicContact OD2-NZ 2.71Å; D19-K61 PolarHBondContact OD2-NZ 3.01Å
20	V	93.7	Very high	93.7	Very high	68 Å²	68	39.4 Å²	39.4	41%	0.412	19%	0.188	S	C	.	.	H	α-helix	trans	-64.6	-44.9	177.3	-177.6	0	0	0	0	110.5	K17 F18 R24 V229	K17-V20 HydrophobicContact CB-CB 4.22Å; K17-V20 HydrophobicContact CB-CG2 4.23Å; K17-V20 PolarHBondContact O-N 2.65Å; F18-V20 VanDerWaalsContact C-N 3.33Å; F18-V20 PolarHBondContact O-N 3.05Å; V20-R24 WeakPolarHBondContact O-CB 3.3Å; V20-R24 PolarHBondContact O-N 3.13Å; V20-V229 HydrophobicContact CB-CG1 3.86Å; V20-V229 HydrophobicContact CG1-CG1 3.66Å
21	L	95	Very high	93.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.3	-57.1	175.6	174.1	57.6	0	0	0	111.3	C11 V14 K17 F18 N23 R24 V25 L38 V229 L238	C11-L21 HydrophobicContact CB-CD1 4.29Å; V14-L21 HydrophobicContact CG1-CB 4.4Å; V14-L21 HydrophobicContact CG1-CD2 3.99Å; V14-L21 HydrophobicContact CG2-CD2 3.7Å; K17-L21 PolarHBondContact O-N 3.28Å; F18-L21 PolarHBondContact O-N 3.4Å; L21-N23 PolarHBondContact O-N 3.37Å; L21-R24 WeakPolarHBondContact O-CA 3.4Å; L21-R24 WeakPolarHBondContact O-CB 3.42Å; L21-R24 PolarHBondContact O-N 3.47Å; L21-V25 HydrophobicContact CD1-CG2 4.1Å; L21-V25 WeakPolarHBondContact O-CG2 3.36Å; L21-V25 PolarHBondContact O-N 3.42Å; L21-L38 HydrophobicContact CD1-CD2 4.43Å; L21-L38 HydrophobicContact CD2-CD2 4.2Å; L21-L38 HydrophobicContact CG-CD2 4.37Å; L21-V229 HydrophobicContact CB-CG1 4.38Å; L21-V229 HydrophobicContact CB-CG2 4.36Å; L21-V229 HydrophobicContact CD1-CG2 4.46Å; L21-L238 HydrophobicContact CD1-CD1 4.07Å
22	F	95.4	Very high	92.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69.9	-31.2	-171.8	-65.9	-46.7	0	0	0	113	F18 V25 R26 L38 F44 Y56 A63 P64 T67 I93	F18-F22 HydrophobicContact CB-CD2 4.09Å; F18-F22 HydrophobicContact CB-CE2 4.01Å; F18-F22 WeakPolarHBondContact O-CB 3.35Å; F18-F22 WeakPolarHBondContact O-CD2 3.4Å; F18-F22 WeakPolarHBondContact O-CG 3.4Å; F18-F22 PolarHBondContact O-N 3.08Å; F22-V25 PolarHBondContact O-N 2.99Å; F22-R26 WeakPolarHBondContact O-CB 3.46Å; F22-R26 WeakPolarHBondContact O-CG 3.22Å; F22-R26 PolarHBondContact O-N 3.28Å; F22-R26 PolarHBondContact O-NE 2.96Å; F22-L38 HydrophobicContact CD1-CD2 4.46Å; F22-L38 HydrophobicContact CE1-CD2 4.05Å; F22-F44 HydrophobicContact CZ-CZ 4.45Å; F22-Y56 HydrophobicContact CD2-CD1 4.42Å; F22-Y56 AromaticContact CD2-CE1 3.56Å; F22-Y56 HydrophobicContact CD2-CE1 3.56Å; F22-Y56 HydrophobicContact CD2-CE2 4.37Å; F22-Y56 AromaticContact CD2-CZ 3.56Å; F22-Y56 HydrophobicContact CE2-CD1 4.16Å; F22-Y56 AromaticContact CE2-CE1 3.74Å; F22-Y56 HydrophobicContact CE2-CE1 3.74Å; F22-A63 HydrophobicContact CD1-CB 4.26Å; F22-A63 HydrophobicContact CE1-CB 3.67Å; F22-A63 HydrophobicContact CE2-CB 4.21Å; F22-A63 HydrophobicContact CZ-CB 3.64Å; F22-P64 HydrophobicContact CB-CG 4.3Å; F22-P64 HydrophobicContact CD1-CG 4.1Å; F22-T67 HydrophobicContact CE1-CG2 4.33Å; F22-I93 HydrophobicContact CE2-CD1 4.06Å; F22-I93 HydrophobicContact CZ-CD1 3.84Å; F22-I93 HydrophobicContact CZ-CG1 4.35Å
23	N	94.6	Very high	92.4	Very high	78 Å²	78	52.4 Å²	52.4	42%	0.417	26%	0.263	S	S	.	.	H	α-helix	trans	-70.1	-32.1	170.7	-67.2	-32.6	0	0	0	112.3	D19 L21 R26 T27	D19-N23 WeakPolarHBondContact O-CB 3.23Å; D19-N23 PolarHBondContact O-N 2.88Å; D19-N23 PolarHBondContact O-ND2 3.17Å; L21-N23 PolarHBondContact O-N 3.37Å; N23-R26 PolarHBondContact OD1-NE 2.87Å; N23-R26 VanDerWaalsContact OD1-NE 3.08Å; N23-R26 PolarHBondContact OD1-NH2 2.89Å; N23-T27 WeakPolarHBondContact O-CB 3.34Å; N23-T27 PolarHBondContact O-N 2.7Å; N23-T27 PolarHBondContact O-OG1 2.7Å
24	R	93.9	Very high	92.1	Very high	128 Å²	128	58.5 Å²	58.5	48%	0.483	30%	0.295	S	S	.	.	H	α-helix	trans	-66.5	-43.4	170.7	-174.4	62.9	174.9	-173.3	-0.8	111.8	V20 L21 T27 I28 Y237 L238	V20-R24 WeakPolarHBondContact O-CB 3.3Å; V20-R24 PolarHBondContact O-N 3.13Å; L21-R24 WeakPolarHBondContact O-CA 3.4Å; L21-R24 WeakPolarHBondContact O-CB 3.42Å; L21-R24 PolarHBondContact O-N 3.47Å; R24-T27 WeakPolarHBondContact O-CB 3.42Å; R24-T27 PolarHBondContact O-N 3.49Å; R24-I28 HydrophobicContact CG-CD1 4.01Å; R24-I28 WeakPolarHBondContact O-CG1 3.38Å; R24-I28 PolarHBondContact O-N 2.76Å; R24-Y237 HydrophobicContact CG-CE2 4.45Å; R24-Y237 WeakPolarHBondContact CG-OH 3.41Å; R24-L238 HydrophobicContact CG-CD2 4.06Å
25	V	94.4	Very high	92.1	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-49.9	175.8	173.4	0	0	0	0	111	L9 L21 F22 T27 I28 Q29 L38 P64 I65 L238	L9-V25 HydrophobicContact CD1-CB 4.43Å; L9-V25 HydrophobicContact CD1-CG1 3.88Å; L9-V25 HydrophobicContact CD1-CG2 4.02Å; L21-V25 HydrophobicContact CD1-CG2 4.1Å; L21-V25 WeakPolarHBondContact O-CG2 3.36Å; L21-V25 PolarHBondContact O-N 3.42Å; F22-V25 PolarHBondContact O-N 2.99Å; V25-T27 PolarHBondContact O-N 2.96Å; V25-I28 PolarHBondContact O-N 2.96Å; V25-Q29 PolarHBondContact O-N 2.9Å; V25-L38 HydrophobicContact CG2-CD2 4.11Å; V25-P64 HydrophobicContact CB-CG 4.1Å; V25-P64 HydrophobicContact CG1-CG 3.7Å; V25-I65 HydrophobicContact CG1-CD1 3.69Å; V25-I65 HydrophobicContact CG1-CG1 4.01Å; V25-L238 HydrophobicContact CG2-CD2 4.39Å
26	R	94.6	Very high	92	Very high	76 Å²	76	60.7 Å²	60.7	29%	0.287	31%	0.306	S	S	.	.	H	α-helix	trans	-54.6	-37.9	173.7	-75.4	-176.6	-87.1	-100.4	5.3	112.4	F22 N23 K30 K62 P64	F22-R26 WeakPolarHBondContact O-CB 3.46Å; F22-R26 WeakPolarHBondContact O-CG 3.22Å; F22-R26 PolarHBondContact O-N 3.28Å; F22-R26 PolarHBondContact O-NE 2.96Å; N23-R26 PolarHBondContact OD1-NE 2.87Å; N23-R26 VanDerWaalsContact OD1-NE 3.08Å; N23-R26 PolarHBondContact OD1-NH2 2.89Å; R26-K30 WeakPolarHBondContact O-CG 3.32Å; R26-K30 PolarHBondContact O-N 2.7Å; R26-K62 PolarHBondContact NH1-O 3.42Å; R26-P64 HydrophobicContact CG-CB 3.62Å; R26-P64 HydrophobicContact CG-CG 4.01Å
27	T	93.6	Very high	92.2	Very high	63 Å²	63	61.8 Å²	61.8	39%	0.387	31%	0.31	S	S	.	.	H	α-helix	trans	-69.7	-37.4	176.5	-58.4	0	0	0	0	112.7	N23 R24 V25 K31	N23-T27 WeakPolarHBondContact O-CB 3.34Å; N23-T27 PolarHBondContact O-N 2.7Å; N23-T27 PolarHBondContact O-OG1 2.7Å; R24-T27 WeakPolarHBondContact O-CB 3.42Å; R24-T27 PolarHBondContact O-N 3.49Å; V25-T27 PolarHBondContact O-N 2.96Å; T27-K31 WeakPolarHBondContact O-CG 3.28Å; T27-K31 PolarHBondContact O-N 3.16Å
28	I	91.4	Very high	92.4	Very high	33 Å²	33	58.4 Å²	58.4	17%	0.169	30%	0.296	C	S	.	.	H	α-helix	trans	-71.4	-44.7	179.1	-73.1	165.4	0	0	0	110.8	L9 R24 V25 K30 K31 S32 F35 L238	L9-I28 HydrophobicContact CD2-CG2 4.47Å; R24-I28 HydrophobicContact CG-CD1 4.01Å; R24-I28 WeakPolarHBondContact O-CG1 3.38Å; R24-I28 PolarHBondContact O-N 2.76Å; V25-I28 PolarHBondContact O-N 2.96Å; I28-K30 VanDerWaalsContact C-N 3.33Å; I28-K30 PolarHBondContact O-N 3.04Å; I28-K31 PolarHBondContact O-N 2.84Å; I28-S32 WeakPolarHBondContact O-CB 3.06Å; I28-S32 PolarHBondContact O-N 3.03Å; I28-F35 HydrophobicContact CG2-CD2 4.39Å; I28-F35 HydrophobicContact CG2-CE2 3.72Å; I28-F35 HydrophobicContact CG2-CZ 4.14Å; I28-L238 HydrophobicContact CD1-CD2 3.44Å; I28-L238 VanDerWaalsContact CD1-CD2 3.44Å
29	Q	91	Very high	92.6	Very high	30 Å²	30	58.4 Å²	58.4	14%	0.14	30%	0.296	C	S	.	.	H	α-helix	trans	-59.1	-44.1	176	-70.3	-173.7	-50.6	0	0	112.1	V25 K31 S32 G33 F35	V25-Q29 PolarHBondContact O-N 2.9Å; Q29-K31 PolarHBondContact O-N 3.07Å; Q29-S32 PolarHBondContact O-N 3.18Å; Q29-G33 WeakPolarHBondContact CA-O 3.5Å; Q29-G33 CarbonylContact O-C 3.55Å; Q29-G33 VanDerWaalsContact O-CA 3.3Å; Q29-G33 WeakPolarHBondContact O-CA 3.33Å; Q29-G33 PolarHBondContact O-N 3.42Å; Q29-F35 HydrophobicContact CG-CD2 4.18Å
30	K	91.7	Very high	92.8	Very high	192 Å²	192	56.9 Å²	56.9	84%	0.835	29%	0.287	S	S	*	.	H	α-helix	trans	-61.3	-23.5	175	-75.2	-178.9	177.7	-172.1	0	114.4	R26 I28	R26-K30 WeakPolarHBondContact O-CG 3.32Å; R26-K30 PolarHBondContact O-N 2.7Å; I28-K30 VanDerWaalsContact C-N 3.33Å; I28-K30 PolarHBondContact O-N 3.04Å
31	K	91.1	Very high	92.8	Very high	174 Å²	174	53.6 Å²	53.6	76%	0.757	27%	0.268	S	S	*	.	H	α-helix	trans	-100.5	-28	-178.7	-74.7	-169.5	175.1	-162.3	0	114.4	T27 I28 Q29	T27-K31 WeakPolarHBondContact O-CG 3.28Å; T27-K31 PolarHBondContact O-N 3.16Å; I28-K31 PolarHBondContact O-N 2.84Å; Q29-K31 PolarHBondContact O-N 3.07Å
32	S	84.8	Confident	92.6	Very high	65 Å²	65	53.7 Å²	53.7	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-125.8	6.9	-169.2	-59	0	0	0	0	113.2	R7 I28 Q29	R7-S32 VanDerWaalsContact CZ-O 3.25Å; R7-S32 PolarHBondContact NH1-O 3.25Å; R7-S32 PolarHBondContact NH2-O 3.43Å; I28-S32 WeakPolarHBondContact O-CB 3.06Å; I28-S32 PolarHBondContact O-N 3.03Å; Q29-S32 PolarHBondContact O-N 3.18Å
33	G	85.8	Confident	92.6	Very high	35 Å²	35	54.8 Å²	54.8	36%	0.361	27%	0.274	S	S	.	.			trans	77.4	175	-173.4	0	0	0	0	0	112.9	R7 Q29 F35	R7-G33 PolarHBondContact NH1-O 3.3Å; Q29-G33 WeakPolarHBondContact CA-O 3.5Å; Q29-G33 CarbonylContact O-C 3.55Å; Q29-G33 VanDerWaalsContact O-CA 3.3Å; Q29-G33 WeakPolarHBondContact O-CA 3.33Å; Q29-G33 PolarHBondContact O-N 3.42Å; G33-F35 VanDerWaalsContact O-CD2 3.27Å; G33-F35 WeakPolarHBondContact O-CD2 3.22Å; G33-F35 WeakPolarHBondContact O-CE2 3.1Å
34	N	89.3	Confident	92.5	Very high	129 Å²	129	51.2 Å²	51.2	69%	0.69	26%	0.255	S	S	*	.			trans	-63	153.9	-173.5	-64.6	-4.8	0	0	0	113.3	R7	R7-N34 PolarHBondContact NH1-O 3.05Å
35	F	92.6	Very high	92.4	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.053	23%	0.233	C	C	.	.			trans	-128.4	144.9	175.3	-77.6	-101.9	0	0	0	107.1	R7 L9 I28 Q29 G33 I65 A240	R7-F35 HydrophobicContact CB-CD1 3.87Å; R7-F35 HydrophobicContact CB-CE1 4.28Å; R7-F35 HydrophobicContact CB-CG 4.31Å; R7-F35 CarbonylContact O-C 3.56Å; R7-F35 WeakPolarHBondContact O-CA 3.47Å; L9-F35 HydrophobicContact CD1-CG 4.37Å; L9-F35 HydrophobicContact CD2-CD1 3.57Å; L9-F35 HydrophobicContact CD2-CE1 3.51Å; L9-F35 HydrophobicContact CD2-CE2 4.5Å; L9-F35 HydrophobicContact CD2-CG 4.13Å; L9-F35 HydrophobicContact CD2-CZ 4Å; L9-F35 HydrophobicContact CG-CB 4.27Å; L9-F35 HydrophobicContact CG-CD1 3.67Å; L9-F35 HydrophobicContact CG-CE1 4.15Å; L9-F35 HydrophobicContact CG-CG 3.96Å; I28-F35 HydrophobicContact CG2-CD2 4.39Å; I28-F35 HydrophobicContact CG2-CE2 3.72Å; I28-F35 HydrophobicContact CG2-CZ 4.14Å; Q29-F35 HydrophobicContact CG-CD2 4.18Å; G33-F35 VanDerWaalsContact O-CD2 3.27Å; G33-F35 WeakPolarHBondContact O-CD2 3.22Å; G33-F35 WeakPolarHBondContact O-CE2 3.1Å; F35-I65 HydrophobicContact CB-CD1 4.47Å; F35-I65 WeakPolarHBondContact O-CG2 3.41Å; F35-A240 HydrophobicContact CE1-CB 3.86Å; F35-A240 HydrophobicContact CZ-CB 3.99Å
36	D	91.5	Very high	91.9	Very high	80 Å²	80	45.8 Å²	45.8	43%	0.428	24%	0.237	S	C	.	.	S	Bend	trans	-82	-47	-170.3	-50.2	-55	0	0	0	111.5	L6 R7	L6-D36 WeakPolarHBondContact CA-OD2 3.15Å; R7-D36 PolarHBondContact N-OD2 3.26Å; R7-D36 PolarHBondContact O-N 2.93Å
37	L	93.8	Very high	90.8	Very high	29 Å²	29	45.9 Å²	45.9	15%	0.152	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	152.2	-174.1	-54	173.4	0	0	0	112.4	L8 L9 L39 Q66 Y68	L8-L37 HydrophobicContact CD2-CB 3.76Å; L8-L37 HydrophobicContact CD2-CD1 3.97Å; L8-L37 HydrophobicContact CD2-CG 4.07Å; L9-L37 PolarHBondContact N-O 2.82Å; L37-L39 HydrophobicContact CB-CD2 4.49Å; L37-Q66 WeakPolarHBondContact CA-O 3.42Å; L37-Q66 HydrophobicContact CD2-CB 3.86Å; L37-Q66 HydrophobicContact CD2-CG 3.8Å; L37-Y68 HydrophobicContact CD1-CD2 4.28Å; L37-Y68 HydrophobicContact CD1-CE2 3.94Å; L37-Y68 HydrophobicContact CD2-CD2 4.25Å; L37-Y68 HydrophobicContact CD2-CE2 3.64Å; L37-Y68 HydrophobicContact CG-CE2 4.34Å
38	L	96.4	Very high	89.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.2	164.6	179	61.8	0	0	0	110	L9 C11 L21 F22 V25 I65 Q66 T67 Y68 L238	L9-L38 HydrophobicContact CB-CD1 3.54Å; L9-L38 HydrophobicContact CD1-CD1 4.49Å; L9-L38 CarbonylContact O-C 3.42Å; L9-L38 WeakPolarHBondContact O-CA 3.42Å; C11-L38 HydrophobicContact CB-CD1 4.11Å; L21-L38 HydrophobicContact CD1-CD2 4.43Å; L21-L38 HydrophobicContact CD2-CD2 4.2Å; L21-L38 HydrophobicContact CG-CD2 4.37Å; F22-L38 HydrophobicContact CD1-CD2 4.46Å; F22-L38 HydrophobicContact CE1-CD2 4.05Å; V25-L38 HydrophobicContact CG2-CD2 4.11Å; L38-I65 HydrophobicContact CB-CD1 3.82Å; L38-I65 HydrophobicContact CB-CG1 4.07Å; L38-Q66 PolarHBondContact N-O 2.89Å; L38-T67 HydrophobicContact CB-CG2 4.28Å; L38-T67 HydrophobicContact CD2-CG2 3.83Å; L38-T67 HydrophobicContact CG-CG2 4.07Å; L38-T67 CarbonylContact O-C 3.45Å; L38-T67 WeakPolarHBondContact O-CA 3.4Å; L38-Y68 PolarHBondContact O-N 2.66Å; L38-L238 HydrophobicContact CD1-CD1 3.87Å
39	L	96.8	Very high	88.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	102.7	-179.4	-52.1	179.5	0	0	0	109.5	L9 A10 C11 L37 Y68 I110 I151 L153	L9-L39 PolarHBondContact O-N 3.11Å; A10-L39 CarbonylContact C-O 3.53Å; A10-L39 WeakPolarHBondContact CA-O 3.4Å; C11-L39 PolarHBondContact N-O 2.68Å; L37-L39 HydrophobicContact CB-CD2 4.49Å; L39-Y68 HydrophobicContact CD2-CD2 3.94Å; L39-Y68 HydrophobicContact CD2-CG 4.49Å; L39-I110 HydrophobicContact CD1-CD1 4.19Å; L39-I110 HydrophobicContact CD2-CD1 4Å; L39-I151 HydrophobicContact CD1-CD1 4.07Å; L39-I151 HydrophobicContact CD1-CG2 4.48Å; L39-L153 HydrophobicContact CB-CD1 4.34Å; L39-L153 HydrophobicContact CB-CD2 4.4Å; L39-L153 HydrophobicContact CD1-CD1 4.43Å; L39-L153 HydrophobicContact CD1-CD2 4.14Å; L39-L153 HydrophobicContact CD2-CD1 4.45Å
40	C	96.6	Very high	87.6	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.014	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	111.4	177.3	-68.8	0	0	0	0	110.1	F44 Y68 V69 L70	C40-F44 HydrophobicContact CB-CD2 4.12Å; C40-Y68 PolarHBondContact N-O 3.18Å; C40-V69 HydrophobicContact CB-CB 4.42Å; C40-V69 HydrophobicContact CB-CG1 4.06Å; C40-L70 PolarHBondContact O-N 3.34Å; C40-L70 VanDerWaalsContact O-N 3.16Å
41	V	94.8	Very high	87	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.28	C	S	.	.			trans	-103.3	-3.9	-176.2	-62.4	0	0	0	0	114.6	C11 L70 L153 S155 F194 A196	C11-V41 WeakPolarHBondContact O-CG2 3.26Å; C11-V41 PolarHBondContact O-N 3.17Å; V41-L70 HydrophobicContact CB-CD1 4.14Å; V41-L70 HydrophobicContact CG1-CD1 4.35Å; V41-L153 HydrophobicContact CG1-CB 3.92Å; V41-L153 HydrophobicContact CG1-CD1 4.45Å; V41-L153 HydrophobicContact CG1-CD2 3.6Å; V41-L153 HydrophobicContact CG1-CG 4.18Å; V41-S155 VanDerWaalsContact O-CA 3.23Å; V41-S155 WeakPolarHBondContact O-CA 3.45Å; V41-S155 WeakPolarHBondContact O-CB 3.33Å; V41-F194 HydrophobicContact CG1-CB 3.95Å; V41-F194 HydrophobicContact CG2-CB 4.11Å; V41-A196 HydrophobicContact CG2-CB 4.2Å
42	G	91.8	Very high	86.8	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.01	26%	0.257	C	S	.	.	S	Bend	trans	-103.7	-164.6	175.6	0	0	0	0	0	114.1	D13 F44 A196	D13-G42 WeakPolarHBondContact OD1-CA 3.32Å; G42-F44 PolarHBondContact O-N 3.26Å; G42-F44 VanDerWaalsContact O-N 3.15Å; G42-A196 VanDerWaalsContact CA-CB 3.4Å
43	N	93.4	Very high	87	Confident	23 Å²	23	40.1 Å²	40.1	12%	0.123	24%	0.237	C	C	.	.			trans	-58.6	112.9	169.5	-73.1	-20.7	0	0	0	110.7	D13 V14 D15 N73 L197	D13-N43 HydrophobicContact CB-CB 4.4Å; D13-N43 PolarHBondContact OD1-N 3.2Å; V14-N43 WeakPolarHBondContact CA-O 3.43Å; V14-N43 PolarHBondContact N-O 3.45Å; D15-N43 PolarHBondContact N-O 3.15Å; D15-N43 WeakPolarHBondContact OD1-CB 3.48Å; N43-N73 WeakPolarHBondContact OD1-CB 3.43Å; N43-N73 PolarHBondContact OD1-ND2 3.29Å; N43-L197 WeakPolarHBondContact OD1-CD2 3.46Å
44	F	93.1	Very high	87.1	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.018	24%	0.235	C	C	.	.			trans	-77.1	-47.4	176.4	-165.9	-113.1	0	0	0	111.8	V14 G16 F18 F22 C40 G42 W53 T67 V69 I93	V14-F44 HydrophobicContact CB-CD2 4.26Å; V14-F44 HydrophobicContact CG2-CD2 3.83Å; V14-F44 HydrophobicContact CG2-CE2 4.29Å; G16-F44 PolarHBondContact N-O 3.19Å; G16-F44 VanDerWaalsContact N-O 3.09Å; F18-F44 AromaticContact CD1-CE1 3.97Å; F18-F44 HydrophobicContact CD1-CE1 3.97Å; F18-F44 HydrophobicContact CD1-CE2 4.12Å; F18-F44 AromaticContact CD1-CZ 3.7Å; F18-F44 HydrophobicContact CD1-CZ 3.7Å; F18-F44 AromaticContact CE1-CD1 3.66Å; F18-F44 HydrophobicContact CE1-CD1 3.66Å; F18-F44 HydrophobicContact CE1-CD2 4.24Å; F18-F44 AromaticContact CE1-CE1 3.38Å; F18-F44 HydrophobicContact CE1-CE1 3.38Å; F18-F44 AromaticContact CE1-CE2 4Å; F18-F44 HydrophobicContact CE1-CE2 4Å; F18-F44 HydrophobicContact CE1-CG 4.08Å; F18-F44 AromaticContact CE1-CZ 3.56Å; F18-F44 HydrophobicContact CE1-CZ 3.56Å; F18-F44 VanDerWaalsContact CE1-O 3.31Å; F18-F44 WeakPolarHBondContact CE1-O 3.45Å; F18-F44 HydrophobicContact CZ-CD1 4.33Å; F18-F44 HydrophobicContact CZ-CE1 4.23Å; F22-F44 HydrophobicContact CZ-CZ 4.45Å; C40-F44 HydrophobicContact CB-CD2 4.12Å; G42-F44 PolarHBondContact O-N 3.26Å; G42-F44 VanDerWaalsContact O-N 3.15Å; F44-W53 HydrophobicContact CE1-CZ3 4.17Å; F44-T67 HydrophobicContact CE2-CG2 4.48Å; F44-V69 HydrophobicContact CB-CB 4.44Å; F44-V69 HydrophobicContact CB-CG1 4.48Å; F44-V69 HydrophobicContact CD1-CG1 4.06Å; F44-V69 HydrophobicContact CD2-CB 4.35Å; F44-V69 HydrophobicContact CD2-CG1 3.55Å; F44-V69 HydrophobicContact CE1-CG1 4.14Å; F44-V69 HydrophobicContact CE2-CG1 3.66Å; F44-V69 HydrophobicContact CG-CB 4.23Å; F44-V69 HydrophobicContact CG-CG1 3.77Å; F44-V69 HydrophobicContact CZ-CG1 3.96Å; F44-I93 HydrophobicContact CE1-CG2 3.89Å; F44-I93 HydrophobicContact CZ-CD1 4.32Å; F44-I93 HydrophobicContact CZ-CG2 3.88Å
45	F	91.5	Very high	87.2	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.018	22%	0.217	C	C	.	.	S	Bend	trans	-93	153	179.8	-61.3	-73.3	0	0	0	112.7	F18 W53 T77 Y80 F81 L89	F18-F45 AromaticContact CZ-CD1 3.78Å; F18-F45 HydrophobicContact CZ-CD1 3.78Å; F18-F45 HydrophobicContact CZ-CE1 4.05Å; F45-W53 HydrophobicContact CD1-CD2 4.48Å; F45-W53 HydrophobicContact CD1-CG 4.48Å; F45-W53 AromaticContact CE1-CD2 3.53Å; F45-W53 HydrophobicContact CE1-CD2 3.53Å; F45-W53 AromaticContact CE1-CE2 3.61Å; F45-W53 AromaticContact CE1-CE3 3.82Å; F45-W53 HydrophobicContact CE1-CE3 3.82Å; F45-W53 AromaticContact CE1-CG 3.9Å; F45-W53 HydrophobicContact CE1-CG 3.9Å; F45-W53 HydrophobicContact CE1-CH2 4.32Å; F45-W53 HydrophobicContact CE1-CZ2 4.03Å; F45-W53 HydrophobicContact CE1-CZ3 4.21Å; F45-W53 AromaticContact CE1-NE1 3.93Å; F45-W53 HydrophobicContact CZ-CD2 4.29Å; F45-W53 AromaticContact CZ-CE2 3.98Å; F45-W53 HydrophobicContact CZ-CE3 4.47Å; F45-W53 HydrophobicContact CZ-CH2 4.19Å; F45-W53 AromaticContact CZ-CZ2 3.95Å; F45-W53 HydrophobicContact CZ-CZ2 3.95Å; F45-W53 HydrophobicContact CZ-CZ3 4.42Å; F45-T77 HydrophobicContact CB-CG2 3.84Å; F45-Y80 HydrophobicContact CB-CD2 3.57Å; F45-Y80 HydrophobicContact CB-CE2 3.71Å; F45-Y80 HydrophobicContact CB-CG 4.45Å; F45-Y80 HydrophobicContact CD1-CD1 4.3Å; F45-Y80 AromaticContact CD1-CD2 3.84Å; F45-Y80 HydrophobicContact CD1-CD2 3.84Å; F45-Y80 HydrophobicContact CD1-CE2 4.13Å; F45-Y80 AromaticContact CD1-CG 3.92Å; F45-Y80 HydrophobicContact CD1-CG 3.92Å; F45-Y80 AromaticContact CD2-CD2 3.71Å; F45-Y80 HydrophobicContact CD2-CD2 3.71Å; F45-Y80 AromaticContact CD2-CG 3.88Å; F45-Y80 HydrophobicContact CD2-CG 3.88Å; F45-Y80 HydrophobicContact CE1-CD1 4.34Å; F45-Y80 HydrophobicContact CE1-CD2 4.49Å; F45-Y80 HydrophobicContact CE1-CG 4.12Å; F45-Y80 VanDerWaalsContact CE2-CB 3.42Å; F45-Y80 HydrophobicContact CE2-CD2 4.37Å; F45-Y80 HydrophobicContact CE2-CG 4.06Å; F45-Y80 AromaticContact CG-CD2 3.41Å; F45-Y80 HydrophobicContact CG-CD2 3.41Å; F45-Y80 VanDerWaalsContact CG-CD2 3.41Å; F45-Y80 AromaticContact CG-CE2 3.92Å; F45-Y80 HydrophobicContact CG-CE2 3.92Å; F45-Y80 AromaticContact CG-CG 3.8Å; F45-Y80 HydrophobicContact CG-CG 3.8Å; F45-Y80 HydrophobicContact CZ-CG 4.19Å; F45-F81 AromaticContact CD2-CE2 3.65Å; F45-F81 HydrophobicContact CD2-CE2 3.65Å; F45-F81 AromaticContact CD2-CZ 3.67Å; F45-F81 HydrophobicContact CD2-CZ 3.67Å; F45-F81 HydrophobicContact CE2-CE1 4.06Å; F45-F81 AromaticContact CE2-CE2 3.82Å; F45-F81 HydrophobicContact CE2-CE2 3.82Å; F45-F81 AromaticContact CE2-CZ 3.55Å; F45-F81 HydrophobicContact CE2-CZ 3.55Å; F45-L89 HydrophobicContact CE2-CD1 4.11Å; F45-L89 HydrophobicContact CZ-CD1 4.04Å
46	G	84.8	Confident	87	Confident	9 Å²	9	38.1 Å²	38.1	9%	0.093	22%	0.215	C	C	.	.			trans	-79.2	172.4	167.4	0	0	0	0	0	113.1	T48 D50 T77	G46-T48 PolarHBondContact O-N 3.12Å; G46-D50 PolarHBondContact N-OD2 3.35Å; G46-T77 WeakPolarHBondContact O-CG2 3.28Å
47	S	71.4	Confident	86.9	Confident	79 Å²	79	39.5 Å²	39.5	55%	0.552	22%	0.217	S	C	*	.	S	Bend	trans	-72.7	-4.9	170.1	-60.1	0	0	0	0	113.4	E76	S47-E76 WeakPolarHBondContact CB-OE2 3.25Å; S47-E76 PolarHBondContact OG-OE2 3.5Å
48	T	70.1	Confident	86.6	Confident	94 Å²	94	42 Å²	42	58%	0.577	23%	0.234	S	C	*	.	S	Bend	trans	-105.8	168.3	-177.4	39.6	0	0	0	0	112	G46 D50 Y80	G46-T48 PolarHBondContact O-N 3.12Å; T48-D50 PolarHBondContact O-N 2.8Å; T48-D50 PolarHBondContact OG1-OD1 2.88Å; T48-Y80 PolarHBondContact O-OH 2.83Å
49	Q	66.2	Low	86.2	Confident	164 Å²	164	43.4 Å²	43.4	77%	0.766	25%	0.248	S	C	*	.			trans	-79.3	95.3	167.8	-171	170.2	7.1	0	0	109	A51	Q49-A51 PolarHBondContact O-N 3.19Å
50	D	72.8	Confident	85.8	Confident	21 Å²	21	50.9 Å²	50.9	11%	0.112	28%	0.281	C	S	.	.			trans	-75.4	110.7	-169.4	-61.1	-27	0	0	0	111.2	G16 F18 G46 T48 E52 W53	G16-D50 VanDerWaalsContact CA-OD2 3.32Å; G16-D50 WeakPolarHBondContact CA-OD2 3.48Å; F18-D50 HydrophobicContact CE2-CB 4.3Å; G46-D50 PolarHBondContact N-OD2 3.35Å; T48-D50 PolarHBondContact O-N 2.8Å; T48-D50 PolarHBondContact OG1-OD1 2.88Å; D50-E52 PolarHBondContact O-N 3.38Å; D50-W53 HydrophobicContact CB-CB 4.22Å; D50-W53 VanDerWaalsContact O-CB 3.31Å; D50-W53 WeakPolarHBondContact O-CB 3.42Å; D50-W53 PolarHBondContact O-N 2.9Å
51	A	79.3	Confident	85.5	Confident	84 Å²	84	53.6 Å²	53.6	69%	0.694	29%	0.292	S	S	*	.	H	α-helix	trans	-61.8	-29.3	-178.9	0	0	0	0	0	113.4	Q49 W53	Q49-A51 PolarHBondContact O-N 3.19Å; A51-W53 VanDerWaalsContact C-N 3.29Å; A51-W53 PolarHBondContact O-N 2.89Å
52	E	86	Confident	85.3	Confident	60 Å²	60	58.3 Å²	58.3	28%	0.28	31%	0.313	S	S	.	.	H	α-helix	trans	-59.8	-39	170.4	-72.8	-173.7	-147.9	0	0	111.6	F18 D19 D50 E54 E55 Y56	F18-E52 HydrophobicContact CD2-CB 3.91Å; F18-E52 PolarHBondContact N-OE2 3.32Å; F18-E52 VanDerWaalsContact N-OE2 3.15Å; D19-E52 WeakPolarHBondContact CB-OE2 3.33Å; D19-E52 PolarHBondContact N-OE2 3.28Å; D50-E52 PolarHBondContact O-N 3.38Å; E52-E54 PolarHBondContact O-N 3.06Å; E52-E55 WeakPolarHBondContact O-CB 3.25Å; E52-E55 PolarHBondContact O-N 3.25Å; E52-E55 VanDerWaalsContact O-N 3.11Å; E52-Y56 VanDerWaalsContact O-CD2 3.31Å; E52-Y56 WeakPolarHBondContact O-CD2 3.26Å; E52-Y56 PolarHBondContact O-N 3.44Å
53	W	89.7	Confident	85.3	Confident	12 Å²	12	58.4 Å²	58.4	5%	0.045	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-42.6	-175.2	176.7	-123.4	0	0	0	112.5	F18 F44 F45 D50 A51 E55 Y56 K57 L89 A90 I93	F18-W53 HydrophobicContact CD2-CB 4.5Å; F18-W53 HydrophobicContact CE2-CB 3.87Å; F18-W53 HydrophobicContact CE2-CE3 4.35Å; F18-W53 HydrophobicContact CZ-CE3 4.33Å; F44-W53 HydrophobicContact CE1-CZ3 4.17Å; F45-W53 HydrophobicContact CD1-CD2 4.48Å; F45-W53 HydrophobicContact CD1-CG 4.48Å; F45-W53 AromaticContact CE1-CD2 3.53Å; F45-W53 HydrophobicContact CE1-CD2 3.53Å; F45-W53 AromaticContact CE1-CE2 3.61Å; F45-W53 AromaticContact CE1-CE3 3.82Å; F45-W53 HydrophobicContact CE1-CE3 3.82Å; F45-W53 AromaticContact CE1-CG 3.9Å; F45-W53 HydrophobicContact CE1-CG 3.9Å; F45-W53 HydrophobicContact CE1-CH2 4.32Å; F45-W53 HydrophobicContact CE1-CZ2 4.03Å; F45-W53 HydrophobicContact CE1-CZ3 4.21Å; F45-W53 AromaticContact CE1-NE1 3.93Å; F45-W53 HydrophobicContact CZ-CD2 4.29Å; F45-W53 AromaticContact CZ-CE2 3.98Å; F45-W53 HydrophobicContact CZ-CE3 4.47Å; F45-W53 HydrophobicContact CZ-CH2 4.19Å; F45-W53 AromaticContact CZ-CZ2 3.95Å; F45-W53 HydrophobicContact CZ-CZ2 3.95Å; F45-W53 HydrophobicContact CZ-CZ3 4.42Å; D50-W53 HydrophobicContact CB-CB 4.22Å; D50-W53 VanDerWaalsContact O-CB 3.31Å; D50-W53 WeakPolarHBondContact O-CB 3.42Å; D50-W53 PolarHBondContact O-N 2.9Å; A51-W53 VanDerWaalsContact C-N 3.29Å; A51-W53 PolarHBondContact O-N 2.89Å; W53-E55 PolarHBondContact O-N 2.92Å; W53-Y56 PolarHBondContact O-N 3.42Å; W53-K57 HydrophobicContact CD2-CB 4.44Å; W53-K57 HydrophobicContact CZ2-CB 4.25Å; W53-K57 HydrophobicContact CZ2-CD 4.48Å; W53-K57 VanDerWaalsContact O-CB 3.31Å; W53-K57 WeakPolarHBondContact O-CB 3.47Å; W53-K57 PolarHBondContact O-N 3.5Å; W53-L89 HydrophobicContact CH2-CB 3.67Å; W53-L89 HydrophobicContact CZ2-CB 3.92Å; W53-L89 WeakPolarHBondContact CZ2-O 3.26Å; W53-A90 HydrophobicContact CH2-CB 3.61Å; W53-A90 HydrophobicContact CZ2-CB 4.39Å; W53-A90 HydrophobicContact CZ3-CB 4.05Å; W53-I93 HydrophobicContact CZ3-CD1 4.03Å
54	E	88	Confident	85.3	Confident	67 Å²	67	59.1 Å²	59.1	31%	0.313	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-23.3	178.6	-68.1	-61.3	152.1	0	0	112.4	E52 K57 T58	E52-E54 PolarHBondContact O-N 3.06Å; E54-K57 IonicContact OE1-NZ 2.6Å; E54-K57 PolarHBondContact OE1-NZ 2.9Å; E54-K57 IonicContact OE2-NZ 4Å; E54-K57 PolarHBondContact OE2-NZ 3.31Å; E54-T58 VanDerWaalsContact O-CB 3.31Å; E54-T58 WeakPolarHBondContact O-CB 3.22Å; E54-T58 VanDerWaalsContact O-CG2 3.29Å; E54-T58 WeakPolarHBondContact O-CG2 3.46Å; E54-T58 PolarHBondContact O-N 3.28Å; E54-T58 PolarHBondContact O-OG1 2.89Å
55	E	90.3	Very high	85.4	Confident	65 Å²	65	59.6 Å²	59.6	30%	0.304	32%	0.322	S	S	.	.	H	α-helix	trans	-76.1	-33.4	172.6	-59.8	-165.9	131.8	0	0	113.2	E52 W53 G59 K60 K61	E52-E55 WeakPolarHBondContact O-CB 3.25Å; E52-E55 PolarHBondContact O-N 3.25Å; E52-E55 VanDerWaalsContact O-N 3.11Å; W53-E55 PolarHBondContact O-N 2.92Å; E55-G59 PolarHBondContact O-N 3.42Å; E55-K60 HydrophobicContact CB-CB 4.32Å; E55-K60 HydrophobicContact CB-CD 4.48Å; E55-K60 HydrophobicContact CG-CD 4.32Å; E55-K60 WeakPolarHBondContact O-CB 3.4Å; E55-K60 PolarHBondContact O-N 2.84Å; E55-K61 HydrophobicContact CB-CB 4.5Å; E55-K61 HydrophobicContact CB-CD 4.04Å; E55-K61 HydrophobicContact CB-CG 4.23Å; E55-K61 PolarHBondContact O-N 3.16Å; E55-K61 WeakPolarHBondContact OE2-CD 3.49Å; E55-K61 WeakPolarHBondContact OE2-CE 3.48Å; E55-K61 IonicContact OE2-NZ 2.91Å; E55-K61 PolarHBondContact OE2-NZ 2.66Å
56	Y	89.6	Confident	85.5	Confident	3 Å²	3	61.6 Å²	61.6	1%	0.012	33%	0.331	C	S	.	.	H	α-helix	trans	-73	-45.2	171.6	-74.1	-83.9	0	0	0	111.1	F18 D19 F22 E52 W53 T58 G59 K61 I93	F18-Y56 HydrophobicContact CB-CD2 4.05Å; F18-Y56 HydrophobicContact CB-CE2 3.66Å; D19-Y56 WeakPolarHBondContact OD1-CE2 3.42Å; D19-Y56 PolarHBondContact OD1-OH 2.75Å; F22-Y56 HydrophobicContact CD2-CD1 4.42Å; F22-Y56 AromaticContact CD2-CE1 3.56Å; F22-Y56 HydrophobicContact CD2-CE1 3.56Å; F22-Y56 HydrophobicContact CD2-CE2 4.37Å; F22-Y56 AromaticContact CD2-CZ 3.56Å; F22-Y56 HydrophobicContact CE2-CD1 4.16Å; F22-Y56 AromaticContact CE2-CE1 3.74Å; F22-Y56 HydrophobicContact CE2-CE1 3.74Å; E52-Y56 VanDerWaalsContact O-CD2 3.31Å; E52-Y56 WeakPolarHBondContact O-CD2 3.26Å; E52-Y56 PolarHBondContact O-N 3.44Å; W53-Y56 PolarHBondContact O-N 3.42Å; Y56-T58 VanDerWaalsContact C-N 3.33Å; Y56-T58 PolarHBondContact O-N 2.93Å; Y56-G59 PolarHBondContact O-N 3.25Å; Y56-K61 WeakPolarHBondContact CA-O 3.18Å; Y56-K61 HydrophobicContact CD1-CB 3.74Å; Y56-K61 HydrophobicContact CD2-CB 4.13Å; Y56-K61 HydrophobicContact CD2-CD 4.4Å; Y56-K61 HydrophobicContact CE1-CB 3.54Å; Y56-K61 HydrophobicContact CE2-CB 3.91Å; Y56-K61 HydrophobicContact CE2-CD 3.73Å; Y56-K61 HydrophobicContact CE2-CG 4.48Å; Y56-K61 HydrophobicContact CG-CB 4.02Å; Y56-I93 HydrophobicContact CD1-CD1 4.37Å
57	K	88.1	Confident	86.1	Confident	108 Å²	108	61.2 Å²	61.2	47%	0.47	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-28.9	178	172.6	166.8	159.9	-99.5	0	114	W53 E54	W53-K57 HydrophobicContact CD2-CB 4.44Å; W53-K57 HydrophobicContact CZ2-CB 4.25Å; W53-K57 HydrophobicContact CZ2-CD 4.48Å; W53-K57 VanDerWaalsContact O-CB 3.31Å; W53-K57 WeakPolarHBondContact O-CB 3.47Å; W53-K57 PolarHBondContact O-N 3.5Å; E54-K57 IonicContact OE1-NZ 2.6Å; E54-K57 PolarHBondContact OE1-NZ 2.9Å; E54-K57 IonicContact OE2-NZ 4Å; E54-K57 PolarHBondContact OE2-NZ 3.31Å
58	T	88.5	Confident	87.2	Confident	83 Å²	83	59 Å²	59	51%	0.509	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	5.3	170.6	57.3	0	0	0	0	114	E54 Y56 K60	E54-T58 VanDerWaalsContact O-CB 3.31Å; E54-T58 WeakPolarHBondContact O-CB 3.22Å; E54-T58 VanDerWaalsContact O-CG2 3.29Å; E54-T58 WeakPolarHBondContact O-CG2 3.46Å; E54-T58 PolarHBondContact O-N 3.28Å; E54-T58 PolarHBondContact O-OG1 2.89Å; Y56-T58 VanDerWaalsContact C-N 3.33Å; Y56-T58 PolarHBondContact O-N 2.93Å; T58-K60 PolarHBondContact O-N 2.91Å
59	G	86.7	Confident	88.4	Confident	29 Å²	29	54.5 Å²	54.5	30%	0.299	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	5	177.3	0	0	0	0	0	115.7	E55 Y56 K61	E55-G59 PolarHBondContact O-N 3.42Å; Y56-G59 PolarHBondContact O-N 3.25Å; G59-K61 VanDerWaalsContact C-N 3.27Å; G59-K61 PolarHBondContact O-N 3.34Å
60	K	88.9	Confident	89.8	Confident	157 Å²	157	46.8 Å²	46.8	68%	0.683	24%	0.243	S	C	*	.	S	Bend	trans	-63	-36.7	173.5	-63.8	175.7	-177.5	175.1	0	111.4	E55 T58	E55-K60 HydrophobicContact CB-CB 4.32Å; E55-K60 HydrophobicContact CB-CD 4.48Å; E55-K60 HydrophobicContact CG-CD 4.32Å; E55-K60 WeakPolarHBondContact O-CB 3.4Å; E55-K60 PolarHBondContact O-N 2.84Å; T58-K60 PolarHBondContact O-N 2.91Å
61	K	90.5	Very high	90.6	Very high	59 Å²	59	45.9 Å²	45.9	26%	0.257	24%	0.239	S	C	.	.	S	Bend	trans	-116.3	150.3	170.1	-69.2	177.3	175.2	164.2	0	109	D19 E55 Y56 G59	D19-K61 WeakPolarHBondContact OD1-CD 3.43Å; D19-K61 IonicContact OD1-NZ 3.46Å; D19-K61 PolarHBondContact OD1-NZ 2.86Å; D19-K61 IonicContact OD2-NZ 2.71Å; D19-K61 PolarHBondContact OD2-NZ 3.01Å; E55-K61 HydrophobicContact CB-CB 4.5Å; E55-K61 HydrophobicContact CB-CD 4.04Å; E55-K61 HydrophobicContact CB-CG 4.23Å; E55-K61 PolarHBondContact O-N 3.16Å; E55-K61 WeakPolarHBondContact OE2-CD 3.49Å; E55-K61 WeakPolarHBondContact OE2-CE 3.48Å; E55-K61 IonicContact OE2-NZ 2.91Å; E55-K61 PolarHBondContact OE2-NZ 2.66Å; Y56-K61 WeakPolarHBondContact CA-O 3.18Å; Y56-K61 HydrophobicContact CD1-CB 3.74Å; Y56-K61 HydrophobicContact CD2-CB 4.13Å; Y56-K61 HydrophobicContact CD2-CD 4.4Å; Y56-K61 HydrophobicContact CE1-CB 3.54Å; Y56-K61 HydrophobicContact CE2-CB 3.91Å; Y56-K61 HydrophobicContact CE2-CD 3.73Å; Y56-K61 HydrophobicContact CE2-CG 4.48Å; Y56-K61 HydrophobicContact CG-CB 4.02Å; G59-K61 VanDerWaalsContact C-N 3.27Å; G59-K61 PolarHBondContact O-N 3.34Å
62	K	90.2	Very high	91.1	Very high	99 Å²	99	42.2 Å²	42.2	43%	0.43	21%	0.208	S	C	.	.			trans	-131	142.4	-178.5	-60.1	-174.5	174.5	-150.4	0	110.2	R26 E91	R26-K62 PolarHBondContact NH1-O 3.42Å; K62-E91 WeakPolarHBondContact CD-OE1 3.48Å; K62-E91 WeakPolarHBondContact CE-OE1 3.22Å; K62-E91 WeakPolarHBondContact CE-OE2 3.37Å; K62-E91 IonicContact NZ-OE1 2.69Å; K62-E91 PolarHBondContact NZ-OE1 3.19Å; K62-E91 IonicContact NZ-OE2 2.87Å; K62-E91 PolarHBondContact NZ-OE2 3.39Å
63	A	92.7	Very high	91.3	Very high	3 Å²	3	39.6 Å²	39.6	3%	0.025	20%	0.196	C	C	.	.			trans	-67.4	137.5	170.5	0	0	0	0	0	109.3	F22 I65 N92 I93	F22-A63 HydrophobicContact CD1-CB 4.26Å; F22-A63 HydrophobicContact CE1-CB 3.67Å; F22-A63 HydrophobicContact CE2-CB 4.21Å; F22-A63 HydrophobicContact CZ-CB 3.64Å; A63-I65 PolarHBondContact O-N 2.86Å; A63-N92 HydrophobicContact CB-CB 4.08Å; A63-N92 PolarHBondContact O-ND2 3.04Å; A63-N92 VanDerWaalsContact O-ND2 3.17Å; A63-I93 HydrophobicContact CB-CD1 4.04Å; A63-I93 HydrophobicContact CB-CG1 3.66Å
64	P	93.5	Very high	91.1	Very high	37 Å²	37	41.5 Å²	41.5	24%	0.24	21%	0.208	C	C	.	.	S	Bend	trans	-74.4	-13.6	-173.4	31.5	-36	0	0	0	113.6	F22 V25 R26	F22-P64 HydrophobicContact CB-CG 4.3Å; F22-P64 HydrophobicContact CD1-CG 4.1Å; V25-P64 HydrophobicContact CB-CG 4.1Å; V25-P64 HydrophobicContact CG1-CG 3.7Å; R26-P64 HydrophobicContact CG-CB 3.62Å; R26-P64 HydrophobicContact CG-CG 4.01Å
65	I	94.3	Very high	91	Very high	15 Å²	15	42.6 Å²	42.6	8%	0.077	22%	0.22	C	C	.	.	S	Bend	trans	-150.8	160.5	175.9	48.7	-177.7	0	0	0	109.7	L9 V25 F35 L38 A63 T67	L9-I65 HydrophobicContact CD1-CD1 4.08Å; V25-I65 HydrophobicContact CG1-CD1 3.69Å; V25-I65 HydrophobicContact CG1-CG1 4.01Å; F35-I65 HydrophobicContact CB-CD1 4.47Å; F35-I65 WeakPolarHBondContact O-CG2 3.41Å; L38-I65 HydrophobicContact CB-CD1 3.82Å; L38-I65 HydrophobicContact CB-CG1 4.07Å; A63-I65 PolarHBondContact O-N 2.86Å; I65-T67 PolarHBondContact O-N 2.64Å; I65-T67 VanDerWaalsContact O-N 3.13Å; I65-T67 PolarHBondContact O-OG1 2.89Å
66	Q	94.3	Very high	90.7	Very high	46 Å²	46	44.2 Å²	44.2	22%	0.215	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	116.9	171.7	-177.7	56.8	34.2	0	0	110.4	L37 L38 Y68 T94	L37-Q66 WeakPolarHBondContact CA-O 3.42Å; L37-Q66 HydrophobicContact CD2-CB 3.86Å; L37-Q66 HydrophobicContact CD2-CG 3.8Å; L38-Q66 PolarHBondContact N-O 2.89Å; Q66-Y68 HydrophobicContact CG-CE1 4.38Å; Q66-Y68 HydrophobicContact CG-CE2 4.01Å; Q66-T94 PolarHBondContact NE2-OG1 3Å
67	T	96.1	Very high	90.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	110.9	-172	-60.4	0	0	0	0	109.2	F22 L38 F44 I65 V69 N92 I93 T94	F22-T67 HydrophobicContact CE1-CG2 4.33Å; L38-T67 HydrophobicContact CB-CG2 4.28Å; L38-T67 HydrophobicContact CD2-CG2 3.83Å; L38-T67 HydrophobicContact CG-CG2 4.07Å; L38-T67 CarbonylContact O-C 3.45Å; L38-T67 WeakPolarHBondContact O-CA 3.4Å; F44-T67 HydrophobicContact CE2-CG2 4.48Å; I65-T67 PolarHBondContact O-N 2.64Å; I65-T67 VanDerWaalsContact O-N 3.13Å; I65-T67 PolarHBondContact O-OG1 2.89Å; T67-V69 HydrophobicContact CG2-CG1 4.15Å; T67-N92 WeakPolarHBondContact CB-O 3.47Å; T67-N92 PolarHBondContact N-O 3.18Å; T67-I93 WeakPolarHBondContact O-CA 3.29Å; T67-T94 PolarHBondContact O-N 2.97Å
68	Y	96	Very high	90.4	Very high	32 Å²	32	40.9 Å²	40.9	13%	0.125	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	130.4	173.8	-67.7	-59.9	0	0	0	110.6	L37 L38 L39 C40 Q66 T94 L96 F102	L37-Y68 HydrophobicContact CD1-CD2 4.28Å; L37-Y68 HydrophobicContact CD1-CE2 3.94Å; L37-Y68 HydrophobicContact CD2-CD2 4.25Å; L37-Y68 HydrophobicContact CD2-CE2 3.64Å; L37-Y68 HydrophobicContact CG-CE2 4.34Å; L38-Y68 PolarHBondContact O-N 2.66Å; L39-Y68 HydrophobicContact CD2-CD2 3.94Å; L39-Y68 HydrophobicContact CD2-CG 4.49Å; C40-Y68 PolarHBondContact N-O 3.18Å; Q66-Y68 HydrophobicContact CG-CE1 4.38Å; Q66-Y68 HydrophobicContact CG-CE2 4.01Å; Y68-T94 WeakPolarHBondContact CA-O 3.45Å; Y68-T94 HydrophobicContact CD1-CG2 4.33Å; Y68-T94 HydrophobicContact CE1-CG2 4.2Å; Y68-L96 HydrophobicContact CD1-CD2 3.54Å; Y68-L96 HydrophobicContact CD1-CG 4.21Å; Y68-L96 HydrophobicContact CE1-CD2 4.17Å; Y68-L96 HydrophobicContact CG-CD2 3.86Å; Y68-L96 HydrophobicContact CG-CG 4.34Å; Y68-F102 HydrophobicContact CE2-CE1 4.07Å; Y68-F102 HydrophobicContact CE2-CZ 4.26Å; Y68-F102 AromaticContact CZ-CZ 3.93Å; Y68-F102 WeakPolarHBondContact OH-CZ 3.25Å
69	V	95.4	Very high	90.3	Very high	1 Å²	1	43 Å²	43	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.7	-179	-50.1	0	0	0	0	111.3	C40 F44 T67 F81 L89 I93 T94 L96	C40-V69 HydrophobicContact CB-CB 4.42Å; C40-V69 HydrophobicContact CB-CG1 4.06Å; F44-V69 HydrophobicContact CB-CB 4.44Å; F44-V69 HydrophobicContact CB-CG1 4.48Å; F44-V69 HydrophobicContact CD1-CG1 4.06Å; F44-V69 HydrophobicContact CD2-CB 4.35Å; F44-V69 HydrophobicContact CD2-CG1 3.55Å; F44-V69 HydrophobicContact CE1-CG1 4.14Å; F44-V69 HydrophobicContact CE2-CG1 3.66Å; F44-V69 HydrophobicContact CG-CB 4.23Å; F44-V69 HydrophobicContact CG-CG1 3.77Å; F44-V69 HydrophobicContact CZ-CG1 3.96Å; T67-V69 HydrophobicContact CG2-CG1 4.15Å; V69-F81 HydrophobicContact CG2-CE1 4.14Å; V69-L89 HydrophobicContact CG2-CD1 3.79Å; V69-I93 HydrophobicContact CG1-CG2 4.18Å; V69-T94 PolarHBondContact N-O 3.39Å; V69-L96 PolarHBondContact O-N 3.21Å; V69-L96 VanDerWaalsContact O-N 3.12Å
70	L	94.3	Very high	90.2	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	21%	0.213	C	C	.	.			trans	-76.3	162.6	162.5	-62.2	-173.2	0	0	0	110.9	C40 V41 L96 L153	C40-L70 PolarHBondContact O-N 3.34Å; C40-L70 VanDerWaalsContact O-N 3.16Å; V41-L70 HydrophobicContact CB-CD1 4.14Å; V41-L70 HydrophobicContact CG1-CD1 4.35Å; L70-L96 HydrophobicContact CD2-CD1 4.38Å; L70-L153 HydrophobicContact CD1-CB 4.3Å; L70-L153 HydrophobicContact CD2-CB 4.09Å
71	G	90.3	Very high	90.1	Very high	2 Å²	2	36.8 Å²	36.8	2%	0.021	19%	0.185	C	C	.	.			trans	-77.1	-179.7	-177	0	0	0	0	0	114.4	N73 Y95 S114	G71-N73 PolarHBondContact O-N 2.67Å; G71-Y95 VanDerWaalsContact N-CE2 3.34Å; G71-S114 PolarHBondContact N-OG 2.96Å
72	A	89.9	Confident	89.2	Confident	7 Å²	7	42.9 Å²	42.9	6%	0.058	21%	0.214	C	C	.	.			trans	-53.8	135	176.7	0	0	0	0	0	112.4	T77 V78 F81 G115 H126	A72-T77 WeakPolarHBondContact CB-OG1 3.34Å; A72-V78 HydrophobicContact CB-CG2 3.94Å; A72-F81 HydrophobicContact CB-CD2 3.72Å; A72-F81 HydrophobicContact CB-CE2 3.82Å; A72-G115 WeakPolarHBondContact O-CA 3.47Å; A72-H126 HydrophobicContact CB-CB 3.94Å; A72-H126 CarbonylContact O-C 3.56Å; A72-H126 WeakPolarHBondContact O-CA 3.23Å; A72-H126 VanDerWaalsContact O-CB 3.26Å; A72-H126 WeakPolarHBondContact O-CB 3.42Å
73	N	89.4	Confident	88.6	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.027	21%	0.214	C	C	.	.	S	Bend	trans	-104	-18	171.1	-53.2	-59.2	0	0	0	112	N43 G71 G115 T116 S155 L197	N43-N73 WeakPolarHBondContact OD1-CB 3.43Å; N43-N73 PolarHBondContact OD1-ND2 3.29Å; G71-N73 PolarHBondContact O-N 2.67Å; N73-G115 VanDerWaalsContact OD1-CA 3.27Å; N73-G115 WeakPolarHBondContact OD1-CA 3.32Å; N73-G115 PolarHBondContact OD1-N 2.73Å; N73-T116 HydrophobicContact CB-CG2 4.09Å; N73-S155 WeakPolarHBondContact OD1-CB 3.33Å; N73-S155 PolarHBondContact OD1-OG 2.7Å; N73-L197 HydrophobicContact CB-CD1 4.36Å; N73-L197 HydrophobicContact CB-CD2 4.2Å
74	N	87.2	Confident	87.6	Confident	53 Å²	53	45.9 Å²	45.9	28%	0.283	24%	0.238	S	C	.	.	S	Bend	trans	-119.8	152.8	-178	-65.1	18.4	0	0	0	109.7	E76 T77	N74-E76 VanDerWaalsContact C-N 3.29Å; N74-E76 PolarHBondContact O-N 3.08Å; N74-T77 PolarHBondContact O-N 2.87Å; N74-T77 PolarHBondContact O-OG1 2.92Å
75	P	84.3	Confident	86.8	Confident	89 Å²	89	50.4 Å²	50.4	58%	0.578	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-61.2	-35	176.3	23.7	-33.6	0	0	0	113.4	T77 V78	P75-T77 VanDerWaalsContact C-N 3.3Å; P75-T77 PolarHBondContact O-N 2.93Å; P75-V78 WeakPolarHBondContact O-CB 3.44Å; P75-V78 WeakPolarHBondContact O-CG2 3.09Å; P75-V78 PolarHBondContact O-N 2.91Å
76	E	84.9	Confident	86.4	Confident	99 Å²	99	51 Å²	51	46%	0.463	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-59.7	-37.8	-179.2	-62	157.8	166.5	0	0	112.6	S47 N74	S47-E76 WeakPolarHBondContact CB-OE2 3.25Å; S47-E76 PolarHBondContact OG-OE2 3.5Å; N74-E76 VanDerWaalsContact C-N 3.29Å; N74-E76 PolarHBondContact O-N 3.08Å
77	T	85.8	Confident	86	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.025	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-87.8	-6.5	-175.2	54	0	0	0	0	113.5	F45 G46 A72 N74 P75 Q79 Y80 F81	F45-T77 HydrophobicContact CB-CG2 3.84Å; G46-T77 WeakPolarHBondContact O-CG2 3.28Å; A72-T77 WeakPolarHBondContact CB-OG1 3.34Å; N74-T77 PolarHBondContact O-N 2.87Å; N74-T77 PolarHBondContact O-OG1 2.92Å; P75-T77 VanDerWaalsContact C-N 3.3Å; P75-T77 PolarHBondContact O-N 2.93Å; T77-Q79 PolarHBondContact O-N 2.98Å; T77-Y80 PolarHBondContact O-N 2.97Å; T77-F81 VanDerWaalsContact O-CD2 3.28Å; T77-F81 WeakPolarHBondContact O-CD2 3.44Å
78	V	86.1	Confident	85.8	Confident	38 Å²	38	56.4 Å²	56.4	23%	0.23	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-56.1	-37	178.5	172.6	0	0	0	0	112	A72 P75 Y80 F81 S125 H126	A72-V78 HydrophobicContact CB-CG2 3.94Å; P75-V78 WeakPolarHBondContact O-CB 3.44Å; P75-V78 WeakPolarHBondContact O-CG2 3.09Å; P75-V78 PolarHBondContact O-N 2.91Å; V78-Y80 PolarHBondContact O-N 2.8Å; V78-F81 PolarHBondContact O-N 2.88Å; V78-S125 VanDerWaalsContact CG1-OG 3.25Å; V78-S125 WeakPolarHBondContact CG1-OG 3.35Å; V78-S125 WeakPolarHBondContact CG2-OG 3.29Å; V78-H126 HydrophobicContact CG2-CB 3.88Å
79	Q	85.7	Confident	85.5	Confident	127 Å²	127	56.1 Å²	56.1	59%	0.593	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-59	-22.2	-177.2	67.8	-177	10.2	0	0	114.4	T77	T77-Q79 PolarHBondContact O-N 2.98Å
80	Y	84.4	Confident	85.2	Confident	34 Å²	34	56.6 Å²	56.6	13%	0.133	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-84.1	-11.9	178.2	-57	-63.7	0	0	0	113.3	F45 T48 T77 V78	F45-Y80 HydrophobicContact CB-CD2 3.57Å; F45-Y80 HydrophobicContact CB-CE2 3.71Å; F45-Y80 HydrophobicContact CB-CG 4.45Å; F45-Y80 HydrophobicContact CD1-CD1 4.3Å; F45-Y80 AromaticContact CD1-CD2 3.84Å; F45-Y80 HydrophobicContact CD1-CD2 3.84Å; F45-Y80 HydrophobicContact CD1-CE2 4.13Å; F45-Y80 AromaticContact CD1-CG 3.92Å; F45-Y80 HydrophobicContact CD1-CG 3.92Å; F45-Y80 AromaticContact CD2-CD2 3.71Å; F45-Y80 HydrophobicContact CD2-CD2 3.71Å; F45-Y80 AromaticContact CD2-CG 3.88Å; F45-Y80 HydrophobicContact CD2-CG 3.88Å; F45-Y80 HydrophobicContact CE1-CD1 4.34Å; F45-Y80 HydrophobicContact CE1-CD2 4.49Å; F45-Y80 HydrophobicContact CE1-CG 4.12Å; F45-Y80 VanDerWaalsContact CE2-CB 3.42Å; F45-Y80 HydrophobicContact CE2-CD2 4.37Å; F45-Y80 HydrophobicContact CE2-CG 4.06Å; F45-Y80 AromaticContact CG-CD2 3.41Å; F45-Y80 HydrophobicContact CG-CD2 3.41Å; F45-Y80 VanDerWaalsContact CG-CD2 3.41Å; F45-Y80 AromaticContact CG-CE2 3.92Å; F45-Y80 HydrophobicContact CG-CE2 3.92Å; F45-Y80 AromaticContact CG-CG 3.8Å; F45-Y80 HydrophobicContact CG-CG 3.8Å; F45-Y80 HydrophobicContact CZ-CG 4.19Å; T48-Y80 PolarHBondContact O-OH 2.83Å; T77-Y80 PolarHBondContact O-N 2.97Å; V78-Y80 PolarHBondContact O-N 2.8Å
81	F	86.1	Confident	85	Confident	22 Å²	22	60.4 Å²	60.4	10%	0.096	32%	0.321	C	S	.	.			trans	-117.4	88.4	-178.3	-56.4	-86.9	0	0	0	110.1	F45 V69 A72 T77 V78 L89 Y95	F45-F81 AromaticContact CD2-CE2 3.65Å; F45-F81 HydrophobicContact CD2-CE2 3.65Å; F45-F81 AromaticContact CD2-CZ 3.67Å; F45-F81 HydrophobicContact CD2-CZ 3.67Å; F45-F81 HydrophobicContact CE2-CE1 4.06Å; F45-F81 AromaticContact CE2-CE2 3.82Å; F45-F81 HydrophobicContact CE2-CE2 3.82Å; F45-F81 AromaticContact CE2-CZ 3.55Å; F45-F81 HydrophobicContact CE2-CZ 3.55Å; V69-F81 HydrophobicContact CG2-CE1 4.14Å; A72-F81 HydrophobicContact CB-CD2 3.72Å; A72-F81 HydrophobicContact CB-CE2 3.82Å; T77-F81 VanDerWaalsContact O-CD2 3.28Å; T77-F81 WeakPolarHBondContact O-CD2 3.44Å; V78-F81 PolarHBondContact O-N 2.88Å; F81-L89 HydrophobicContact CD1-CD1 4.39Å; F81-L89 HydrophobicContact CE1-CD1 4.06Å; F81-Y95 HydrophobicContact CB-CD1 4.49Å; F81-Y95 HydrophobicContact CB-CE1 4.24Å; F81-Y95 AromaticContact CD1-CD1 3.77Å; F81-Y95 HydrophobicContact CD1-CD1 3.77Å; F81-Y95 AromaticContact CD1-CD2 3.75Å; F81-Y95 HydrophobicContact CD1-CD2 3.75Å; F81-Y95 HydrophobicContact CD1-CE1 4.05Å; F81-Y95 HydrophobicContact CD1-CE2 4.08Å; F81-Y95 AromaticContact CD1-CG 3.59Å; F81-Y95 HydrophobicContact CD1-CG 3.59Å; F81-Y95 AromaticContact CE1-CD2 3.87Å; F81-Y95 HydrophobicContact CE1-CD2 3.87Å; F81-Y95 HydrophobicContact CE1-CE2 4.37Å; F81-Y95 HydrophobicContact CE1-CG 4.01Å
82	Q	73.3	Confident	85.2	Confident	186 Å²	186	63 Å²	63	87%	0.869	33%	0.334	S	S	*	.			trans	-81.6	-24.3	-171.8	-62.3	-176.3	-0.8	0	0	114.3
83	D	76.4	Confident	85.4	Confident	78 Å²	78	62.7 Å²	62.7	42%	0.417	33%	0.332	S	S	.	.			trans	-102.1	156.4	176.1	-153.5	-58.4	0	0	0	110.5	D85 C87 Y95	D83-D85 PolarHBondContact OD1-N 3.05Å; D83-C87 HydrophobicContact CB-CB 4.17Å; D83-Y95 WeakPolarHBondContact O-CE1 3.47Å
84	T	72.3	Confident	85.6	Confident	87 Å²	87	63.9 Å²	63.9	53%	0.534	34%	0.339	S	S	.	.	S	Bend	trans	-92.9	-26.8	172.5	53.1	0	0	0	0	113.2	G97 R98	T84-G97 WeakPolarHBondContact O-CA 3.3Å; T84-R98 PolarHBondContact O-N 2.76Å
85	D	77.1	Confident	86	Confident	132 Å²	132	62 Å²	62	71%	0.706	33%	0.328	S	S	*	.	S	Bend	trans	-100.6	-4.6	-164.1	-64.3	3.7	0	0	0	112.3	D83	D83-D85 PolarHBondContact OD1-N 3.05Å
86	G	84.4	Confident	86.3	Confident	27 Å²	27	58.3 Å²	58.3	28%	0.278	30%	0.304	S	S	.	.			trans	115.9	145.3	175.9	0	0	0	0	0	112.1	Y95	G86-Y95 CarbonylContact C-O 3.53Å; G86-Y95 WeakPolarHBondContact CA-O 3.25Å
87	C	87.1	Confident	86.6	Confident	34 Å²	34	53.7 Å²	53.7	23%	0.23	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	157.3	-178.7	57.8	0	0	0	0	112.5	D83 T94 Y95	D83-C87 HydrophobicContact CB-CB 4.17Å; C87-T94 CarbonylContact O-C 3.52Å; C87-Y95 PolarHBondContact N-O 3.16Å; C87-Y95 PolarHBondContact O-N 2.73Å
88	E	90.8	Very high	86.8	Confident	126 Å²	126	56.3 Å²	56.3	59%	0.589	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	126.4	165.2	-169.5	169.6	-158.4	0	0	109.2	A90 E91 N92	E88-A90 VanDerWaalsContact CG-O 3.29Å; E88-A90 WeakPolarHBondContact CG-O 3.37Å; E88-E91 WeakPolarHBondContact OE1-CA 3.33Å; E88-N92 PolarHBondContact OE1-N 3.41Å
89	L	89.8	Confident	87	Confident	27 Å²	27	57.9 Å²	57.9	14%	0.141	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-33.8	-178.5	-59.2	180	0	0	0	111.6	F45 W53 V69 F81 I93	F45-L89 HydrophobicContact CE2-CD1 4.11Å; F45-L89 HydrophobicContact CZ-CD1 4.04Å; W53-L89 HydrophobicContact CH2-CB 3.67Å; W53-L89 HydrophobicContact CZ2-CB 3.92Å; W53-L89 WeakPolarHBondContact CZ2-O 3.26Å; V69-L89 HydrophobicContact CG2-CD1 3.79Å; F81-L89 HydrophobicContact CD1-CD1 4.39Å; F81-L89 HydrophobicContact CE1-CD1 4.06Å; L89-I93 HydrophobicContact CB-CG2 4.4Å; L89-I93 PolarHBondContact N-O 3.14Å
90	A	90.9	Very high	87.2	Confident	11 Å²	11	52.3 Å²	52.3	9%	0.091	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	168.1	174	0	0	0	0	0	108.3	W53 E88 N92 I93	W53-A90 HydrophobicContact CH2-CB 3.61Å; W53-A90 HydrophobicContact CZ2-CB 4.39Å; W53-A90 HydrophobicContact CZ3-CB 4.05Å; E88-A90 VanDerWaalsContact CG-O 3.29Å; E88-A90 WeakPolarHBondContact CG-O 3.37Å; A90-N92 PolarHBondContact O-N 3.03Å; A90-I93 HydrophobicContact CB-CB 4.39Å; A90-I93 HydrophobicContact CB-CD1 4.29Å; A90-I93 PolarHBondContact N-O 2.81Å; A90-I93 CarbonylContact O-C 3.39Å; A90-I93 WeakPolarHBondContact O-CA 3.43Å; A90-I93 PolarHBondContact O-N 3.07Å; A90-I93 VanDerWaalsContact O-O 3.1Å
91	E	90.1	Very high	87.5	Confident	81 Å²	81	54.7 Å²	54.7	38%	0.379	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	124.6	-177.2	-171.2	-179.1	150.7	0	0	112.5	K62 E88 I93	K62-E91 WeakPolarHBondContact CD-OE1 3.48Å; K62-E91 WeakPolarHBondContact CE-OE1 3.22Å; K62-E91 WeakPolarHBondContact CE-OE2 3.37Å; K62-E91 IonicContact NZ-OE1 2.69Å; K62-E91 PolarHBondContact NZ-OE1 3.19Å; K62-E91 IonicContact NZ-OE2 2.87Å; K62-E91 PolarHBondContact NZ-OE2 3.39Å; E88-E91 WeakPolarHBondContact OE1-CA 3.33Å; E91-I93 VanDerWaalsContact C-N 3.25Å; E91-I93 PolarHBondContact O-N 3.48Å
92	N	92.6	Very high	87.5	Confident	56 Å²	56	56.5 Å²	56.5	30%	0.299	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	17.1	-172.9	-55.5	-34.1	0	0	0	114.8	A63 T67 E88 A90	A63-N92 HydrophobicContact CB-CB 4.08Å; A63-N92 PolarHBondContact O-ND2 3.04Å; A63-N92 VanDerWaalsContact O-ND2 3.17Å; T67-N92 WeakPolarHBondContact CB-O 3.47Å; T67-N92 PolarHBondContact N-O 3.18Å; E88-N92 PolarHBondContact OE1-N 3.41Å; A90-N92 PolarHBondContact O-N 3.03Å
93	I	94.8	Very high	88.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	107.5	177.9	-53.8	-180	0	0	0	109.6	F22 F44 W53 Y56 A63 T67 V69 L89 A90 E91	F22-I93 HydrophobicContact CE2-CD1 4.06Å; F22-I93 HydrophobicContact CZ-CD1 3.84Å; F22-I93 HydrophobicContact CZ-CG1 4.35Å; F44-I93 HydrophobicContact CE1-CG2 3.89Å; F44-I93 HydrophobicContact CZ-CD1 4.32Å; F44-I93 HydrophobicContact CZ-CG2 3.88Å; W53-I93 HydrophobicContact CZ3-CD1 4.03Å; Y56-I93 HydrophobicContact CD1-CD1 4.37Å; A63-I93 HydrophobicContact CB-CD1 4.04Å; A63-I93 HydrophobicContact CB-CG1 3.66Å; T67-I93 WeakPolarHBondContact O-CA 3.29Å; V69-I93 HydrophobicContact CG1-CG2 4.18Å; L89-I93 HydrophobicContact CB-CG2 4.4Å; L89-I93 PolarHBondContact N-O 3.14Å; A90-I93 HydrophobicContact CB-CB 4.39Å; A90-I93 HydrophobicContact CB-CD1 4.29Å; A90-I93 PolarHBondContact N-O 2.81Å; A90-I93 CarbonylContact O-C 3.39Å; A90-I93 WeakPolarHBondContact O-CA 3.43Å; A90-I93 PolarHBondContact O-N 3.07Å; A90-I93 VanDerWaalsContact O-O 3.1Å; E91-I93 VanDerWaalsContact C-N 3.25Å; E91-I93 PolarHBondContact O-N 3.48Å
94	T	94.2	Very high	88.3	Confident	31 Å²	31	47.2 Å²	47.2	19%	0.19	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	125.1	-173.5	-49.2	0	0	0	0	111.6	Q66 T67 Y68 V69 C87	Q66-T94 PolarHBondContact NE2-OG1 3Å; T67-T94 PolarHBondContact O-N 2.97Å; Y68-T94 WeakPolarHBondContact CA-O 3.45Å; Y68-T94 HydrophobicContact CD1-CG2 4.33Å; Y68-T94 HydrophobicContact CE1-CG2 4.2Å; V69-T94 PolarHBondContact N-O 3.39Å; C87-T94 CarbonylContact O-C 3.52Å
95	Y	94.4	Very high	88.5	Confident	12 Å²	12	49.8 Å²	49.8	5%	0.047	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	126.9	167.6	166.6	-132.8	0	0	0	110.3	G71 F81 D83 G86 C87 G97 R98	G71-Y95 VanDerWaalsContact N-CE2 3.34Å; F81-Y95 HydrophobicContact CB-CD1 4.49Å; F81-Y95 HydrophobicContact CB-CE1 4.24Å; F81-Y95 AromaticContact CD1-CD1 3.77Å; F81-Y95 HydrophobicContact CD1-CD1 3.77Å; F81-Y95 AromaticContact CD1-CD2 3.75Å; F81-Y95 HydrophobicContact CD1-CD2 3.75Å; F81-Y95 HydrophobicContact CD1-CE1 4.05Å; F81-Y95 HydrophobicContact CD1-CE2 4.08Å; F81-Y95 AromaticContact CD1-CG 3.59Å; F81-Y95 HydrophobicContact CD1-CG 3.59Å; F81-Y95 AromaticContact CE1-CD2 3.87Å; F81-Y95 HydrophobicContact CE1-CD2 3.87Å; F81-Y95 HydrophobicContact CE1-CE2 4.37Å; F81-Y95 HydrophobicContact CE1-CG 4.01Å; D83-Y95 WeakPolarHBondContact O-CE1 3.47Å; G86-Y95 CarbonylContact C-O 3.53Å; G86-Y95 WeakPolarHBondContact CA-O 3.25Å; C87-Y95 PolarHBondContact N-O 3.16Å; C87-Y95 PolarHBondContact O-N 2.73Å; Y95-G97 VanDerWaalsContact C-N 3.29Å; Y95-G97 VanDerWaalsContact CE2-N 3.29Å; Y95-G97 WeakPolarHBondContact CE2-O 3.47Å; Y95-G97 PolarHBondContact O-N 2.86Å; Y95-R98 PolarHBondContact OH-N 2.77Å
96	L	91.5	Very high	88.7	Confident	13 Å²	13	45.6 Å²	45.6	7%	0.068	26%	0.255	C	S	.	.			trans	-72	-17.3	-177.2	-70.6	172.9	0	0	0	114.4	Y68 V69 L70 F102 Y112 L153	Y68-L96 HydrophobicContact CD1-CD2 3.54Å; Y68-L96 HydrophobicContact CD1-CG 4.21Å; Y68-L96 HydrophobicContact CE1-CD2 4.17Å; Y68-L96 HydrophobicContact CG-CD2 3.86Å; Y68-L96 HydrophobicContact CG-CG 4.34Å; V69-L96 PolarHBondContact O-N 3.21Å; V69-L96 VanDerWaalsContact O-N 3.12Å; L70-L96 HydrophobicContact CD2-CD1 4.38Å; L96-F102 HydrophobicContact CD2-CB 4.49Å; L96-Y112 HydrophobicContact CB-CD1 4.07Å; L96-Y112 HydrophobicContact CB-CD2 3.73Å; L96-Y112 HydrophobicContact CB-CE1 4.12Å; L96-Y112 HydrophobicContact CB-CE2 3.78Å; L96-Y112 HydrophobicContact CB-CG 3.88Å; L96-Y112 HydrophobicContact CD1-CD1 3.96Å; L96-Y112 HydrophobicContact CD1-CG 3.95Å; L96-Y112 HydrophobicContact CD2-CE1 4.45Å; L96-Y112 HydrophobicContact CG-CD1 4.42Å; L96-Y112 HydrophobicContact CG-CG 4.5Å; L96-Y112 WeakPolarHBondContact O-CE2 3.43Å; L96-Y112 PolarHBondContact O-OH 3.3Å; L96-L153 HydrophobicContact CD1-CD1 3.98Å
97	G	90.6	Very high	88.6	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.01	25%	0.25	C	S	.	.			trans	100.3	175.7	-172.2	0	0	0	0	0	113.6	T84 Y95 S114	T84-G97 WeakPolarHBondContact O-CA 3.3Å; Y95-G97 VanDerWaalsContact C-N 3.29Å; Y95-G97 VanDerWaalsContact CE2-N 3.29Å; Y95-G97 WeakPolarHBondContact CE2-O 3.47Å; Y95-G97 PolarHBondContact O-N 2.86Å; G97-S114 PolarHBondContact O-OG 2.72Å
98	R	89.4	Confident	88.7	Confident	59 Å²	59	43.6 Å²	43.6	22%	0.223	24%	0.24	C	C	.	.	S	Bend	trans	-66.7	-42.1	-171.8	-170	-178	-173.3	174.6	8.2	112.7	T84 Y95 S114 V123 P124 S127	T84-R98 PolarHBondContact O-N 2.76Å; Y95-R98 PolarHBondContact OH-N 2.77Å; R98-S114 WeakPolarHBondContact O-CB 3.23Å; R98-S114 PolarHBondContact O-N 3.26Å; R98-V123 VanDerWaalsContact NH2-CG1 3.35Å; R98-V123 PolarHBondContact NH2-O 3.22Å; R98-P124 PolarHBondContact NH2-O 2.99Å; R98-S127 PolarHBondContact NE-O 3.05Å; R98-S127 VanDerWaalsContact NE-O 3.14Å; R98-S127 PolarHBondContact NH2-O 2.91Å
99	K	91.2	Very high	88.8	Confident	72 Å²	72	39.4 Å²	39.4	31%	0.313	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	148.7	178.4	69.1	-171.6	179.8	-178.1	0	109.3	Y112 L113 D132	K99-Y112 VanDerWaalsContact C-CE2 3.4Å; K99-Y112 WeakPolarHBondContact CA-O 3.41Å; K99-L113 HydrophobicContact CB-CD1 3.78Å; K99-D132 HydrophobicContact CD-CB 3.8Å; K99-D132 WeakPolarHBondContact CE-OD1 3.19Å; K99-D132 IonicContact NZ-OD1 3.92Å; K99-D132 PolarHBondContact NZ-OD1 2.84Å
100	G	90.4	Very high	89	Confident	10 Å²	10	38.2 Å²	38.2	10%	0.103	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.3	-164.1	174.3	0	0	0	0	0	113.2	V111 Y112	G100-V111 WeakPolarHBondContact O-CG1 3.46Å; G100-Y112 VanDerWaalsContact C-CE1 3.47Å; G100-Y112 PolarHBondContact N-O 3.05Å; G100-Y112 VanDerWaalsContact N-O 3.09Å; G100-Y112 PolarHBondContact O-N 3.41Å
101	F	89.3	Confident	89.3	Confident	84 Å²	84	37.7 Å²	37.7	37%	0.368	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	137.3	168.5	71.8	-86.1	0	0	0	110	I110 V111 M139 L140	F101-I110 CarbonylContact C-O 3.49Å; F101-I110 WeakPolarHBondContact CA-O 3.46Å; F101-V111 HydrophobicContact CB-CG2 4.07Å; F101-M139 HydrophobicContact CD1-SD 3.91Å; F101-M139 HydrophobicContact CE1-CG 4.11Å; F101-M139 HydrophobicContact CE1-SD 3.77Å; F101-L140 HydrophobicContact CB-CD2 4.21Å; F101-L140 HydrophobicContact CD1-CD2 3.76Å; F101-L140 HydrophobicContact CD1-CG 4.5Å; F101-L140 HydrophobicContact CE1-CD2 4.27Å; F101-L140 HydrophobicContact CG-CD2 3.91Å
102	F	87.6	Confident	89.5	Confident	60 Å²	60	35 Å²	35	26%	0.263	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.3	172.8	171.5	-103.1	0	0	0	108	Y68 L96 I110 Y112	Y68-F102 HydrophobicContact CE2-CE1 4.07Å; Y68-F102 HydrophobicContact CE2-CZ 4.26Å; Y68-F102 AromaticContact CZ-CZ 3.93Å; Y68-F102 WeakPolarHBondContact OH-CZ 3.25Å; L96-F102 HydrophobicContact CD2-CB 4.49Å; F102-I110 HydrophobicContact CD1-CD1 4.25Å; F102-I110 HydrophobicContact CD1-CG1 4.44Å; F102-I110 PolarHBondContact N-O 3.3Å; F102-I110 PolarHBondContact O-N 3.34Å; F102-Y112 HydrophobicContact CB-CE1 4.18Å
103	T	87.6	Confident	89.6	Confident	56 Å²	56	32.4 Å²	32.4	34%	0.344	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	112.1	169.2	-58.5	0	0	0	0	107.8	L108 Q109	T103-L108 WeakPolarHBondContact CA-O 3.37Å; T103-Q109 HydrophobicContact CG2-CG 4.15Å; T103-Q109 PolarHBondContact OG1-NE2 2.61Å; T103-Q109 VanDerWaalsContact OG1-NE2 3.1Å
104	G	78.3	Confident	89.5	Confident	12 Å²	12	32.6 Å²	32.6	12%	0.124	18%	0.184	C	C	.	.			trans	-69.9	162.4	177.2	0	0	0	0	0	112	S106 G107 L108	G104-S106 PolarHBondContact O-N 2.89Å; G104-S106 VanDerWaalsContact O-N 3.13Å; G104-G107 WeakPolarHBondContact O-CA 3.38Å; G104-G107 PolarHBondContact O-N 3.22Å; G104-L108 PolarHBondContact N-O 3.25Å
105	S	75.9	Confident	89.3	Confident	141 Å²	141	31.1 Å²	31.1	99%	0.986	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-26.5	175.7	51.4	0	0	0	0	113.5	G107	S105-G107 PolarHBondContact O-N 2.75Å
106	S	80.9	Confident	89.2	Confident	44 Å²	44	32.4 Å²	32.4	31%	0.308	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-0.3	171.7	56.2	0	0	0	0	114.8	L6 G104 L108 L248	L6-S106 VanDerWaalsContact CD1-OG 3.27Å; L6-S106 WeakPolarHBondContact CD1-OG 3.44Å; G104-S106 PolarHBondContact O-N 2.89Å; G104-S106 VanDerWaalsContact O-N 3.13Å; S106-L108 VanDerWaalsContact C-N 3.3Å; S106-L108 PolarHBondContact O-N 2.9Å; S106-L248 WeakPolarHBondContact O-CD1 3.38Å
107	G	83.6	Confident	89.1	Confident	17 Å²	17	35.3 Å²	35.3	18%	0.175	20%	0.197	C	C	.	.			trans	81.4	-1.6	-176.7	0	0	0	0	0	115.3	G104 S105 Q109	G104-G107 WeakPolarHBondContact O-CA 3.38Å; G104-G107 PolarHBondContact O-N 3.22Å; S105-G107 PolarHBondContact O-N 2.75Å; G107-Q109 PolarHBondContact O-N 3.36Å
108	L	89.4	Confident	88.9	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.016	21%	0.205	C	C	.	.			trans	-62.6	124.8	177.8	-178.1	69.1	0	0	0	111.5	L6 L8 T103 G104 S106 I110 D150 I151 I243 P245	L6-L108 HydrophobicContact CD1-CB 3.76Å; L6-L108 HydrophobicContact CD1-CD1 4.32Å; L6-L108 HydrophobicContact CD1-CD2 3.95Å; L6-L108 HydrophobicContact CD1-CG 4.23Å; L8-L108 HydrophobicContact CD1-CD2 3.86Å; L8-L108 HydrophobicContact CD2-CD2 4.37Å; T103-L108 WeakPolarHBondContact CA-O 3.37Å; G104-L108 PolarHBondContact N-O 3.25Å; S106-L108 VanDerWaalsContact C-N 3.3Å; S106-L108 PolarHBondContact O-N 2.9Å; L108-I110 HydrophobicContact CD2-CD1 3.97Å; L108-I110 HydrophobicContact CD2-CG1 4.09Å; L108-I110 HydrophobicContact CG-CG1 4.11Å; L108-D150 HydrophobicContact CD1-CB 3.64Å; L108-I151 HydrophobicContact CD1-CD1 4.21Å; L108-I151 HydrophobicContact CD1-CG1 4.46Å; L108-I151 HydrophobicContact CD2-CD1 4.21Å; L108-I243 HydrophobicContact CD1-CD1 4.16Å; L108-I243 HydrophobicContact CD1-CG2 3.84Å; L108-P245 HydrophobicContact CB-CG 3.89Å; L108-P245 HydrophobicContact CD1-CG 4.18Å
109	Q	92.2	Very high	88.5	Confident	37 Å²	37	40 Å²	40	17%	0.173	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	110.5	-179.9	-56.5	-154.7	-88.5	0	0	112.6	T103 G107 D150 I151	T103-Q109 HydrophobicContact CG2-CG 4.15Å; T103-Q109 PolarHBondContact OG1-NE2 2.61Å; T103-Q109 VanDerWaalsContact OG1-NE2 3.1Å; G107-Q109 PolarHBondContact O-N 3.36Å; Q109-D150 PolarHBondContact N-OD2 3.01Å; Q109-D150 WeakPolarHBondContact O-CB 3.28Å; Q109-D150 PolarHBondContact O-N 3.35Å; Q109-I151 PolarHBondContact O-N 2.93Å; Q109-I151 VanDerWaalsContact O-N 3.09Å
110	I	94.8	Very high	87.8	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	113.2	179.2	-51.6	-174.7	0	0	0	109	L39 F101 F102 L108 I151 L153	L39-I110 HydrophobicContact CD1-CD1 4.19Å; L39-I110 HydrophobicContact CD2-CD1 4Å; F101-I110 CarbonylContact C-O 3.49Å; F101-I110 WeakPolarHBondContact CA-O 3.46Å; F102-I110 HydrophobicContact CD1-CD1 4.25Å; F102-I110 HydrophobicContact CD1-CG1 4.44Å; F102-I110 PolarHBondContact N-O 3.3Å; F102-I110 PolarHBondContact O-N 3.34Å; L108-I110 HydrophobicContact CD2-CD1 3.97Å; L108-I110 HydrophobicContact CD2-CG1 4.09Å; L108-I110 HydrophobicContact CG-CG1 4.11Å; I110-I151 HydrophobicContact CD1-CD1 4.41Å; I110-I151 HydrophobicContact CG1-CB 4.31Å; I110-I151 HydrophobicContact CG1-CD1 4.25Å; I110-I151 HydrophobicContact CG2-CB 4.31Å; I110-I151 HydrophobicContact CG2-CG2 4.37Å; I110-L153 HydrophobicContact CG2-CD1 3.5Å; I110-L153 VanDerWaalsContact CG2-CD1 3.5Å; I110-L153 HydrophobicContact CG2-CG 3.74Å
111	V	95.4	Very high	87	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	139.9	170.7	-176.2	0	0	0	0	109.2	G100 F101 L136 L140 V149 I151 L152 L153 L188	G100-V111 WeakPolarHBondContact O-CG1 3.46Å; F101-V111 HydrophobicContact CB-CG2 4.07Å; V111-L136 HydrophobicContact CG1-CD1 4.14Å; V111-L136 HydrophobicContact CG1-CD2 3.83Å; V111-L136 HydrophobicContact CG1-CG 4.16Å; V111-L140 HydrophobicContact CB-CD1 4.45Å; V111-L140 HydrophobicContact CG1-CD1 3.9Å; V111-L140 HydrophobicContact CG2-CD1 3.61Å; V111-V149 HydrophobicContact CG2-CB 4Å; V111-V149 HydrophobicContact CG2-CG1 3.76Å; V111-V149 HydrophobicContact CG2-CG2 3.87Å; V111-I151 PolarHBondContact N-O 2.88Å; V111-L152 HydrophobicContact CB-CD1 4Å; V111-L152 HydrophobicContact CG1-CD1 3.88Å; V111-L152 CarbonylContact O-C 3.48Å; V111-L152 WeakPolarHBondContact O-CA 3.28Å; V111-L153 PolarHBondContact O-N 3.31Å; V111-L188 HydrophobicContact CB-CD1 4.31Å; V111-L188 HydrophobicContact CG1-CD1 3.71Å; V111-L188 HydrophobicContact CG2-CD1 4.35Å
112	Y	95.1	Very high	86.4	Confident	24 Å²	24	46.2 Å²	46.2	9%	0.094	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	145.8	-178.9	55.1	-87.7	0	0	0	112.6	L96 K99 G100 F102 L153	L96-Y112 HydrophobicContact CB-CD1 4.07Å; L96-Y112 HydrophobicContact CB-CD2 3.73Å; L96-Y112 HydrophobicContact CB-CE1 4.12Å; L96-Y112 HydrophobicContact CB-CE2 3.78Å; L96-Y112 HydrophobicContact CB-CG 3.88Å; L96-Y112 HydrophobicContact CD1-CD1 3.96Å; L96-Y112 HydrophobicContact CD1-CG 3.95Å; L96-Y112 HydrophobicContact CD2-CE1 4.45Å; L96-Y112 HydrophobicContact CG-CD1 4.42Å; L96-Y112 HydrophobicContact CG-CG 4.5Å; L96-Y112 WeakPolarHBondContact O-CE2 3.43Å; L96-Y112 PolarHBondContact O-OH 3.3Å; K99-Y112 VanDerWaalsContact C-CE2 3.4Å; K99-Y112 WeakPolarHBondContact CA-O 3.41Å; G100-Y112 VanDerWaalsContact C-CE1 3.47Å; G100-Y112 PolarHBondContact N-O 3.05Å; G100-Y112 VanDerWaalsContact N-O 3.09Å; G100-Y112 PolarHBondContact O-N 3.41Å; F102-Y112 HydrophobicContact CB-CE1 4.18Å; Y112-L153 WeakPolarHBondContact CA-O 3.32Å
113	L	94.6	Very high	86	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	113.6	171.2	-175.5	66.5	0	0	0	108.7	K99 F128 V133 L153 T154 I181 L184	K99-L113 HydrophobicContact CB-CD1 3.78Å; L113-F128 HydrophobicContact CD1-CB 3.79Å; L113-F128 HydrophobicContact CD1-CD1 4.37Å; L113-F128 HydrophobicContact CD1-CG 4.11Å; L113-F128 HydrophobicContact CD2-CB 4.32Å; L113-F128 HydrophobicContact CD2-CD1 3.81Å; L113-F128 HydrophobicContact CD2-CD2 3.89Å; L113-F128 HydrophobicContact CD2-CE1 4.04Å; L113-F128 HydrophobicContact CD2-CE2 4.13Å; L113-F128 HydrophobicContact CD2-CG 3.74Å; L113-F128 HydrophobicContact CD2-CZ 4.2Å; L113-F128 HydrophobicContact CG-CB 4.15Å; L113-F128 HydrophobicContact CG-CD1 3.78Å; L113-F128 HydrophobicContact CG-CE1 4.32Å; L113-F128 HydrophobicContact CG-CG 3.92Å; L113-V133 HydrophobicContact CD2-CG2 3.67Å; L113-L153 PolarHBondContact N-O 3.09Å; L113-T154 HydrophobicContact CB-CG2 4.13Å; L113-I181 HydrophobicContact CD2-CG1 4.43Å; L113-L184 HydrophobicContact CD2-CD2 4.03Å
114	S	93	Very high	85.7	Confident	4 Å²	4	43.9 Å²	43.9	3%	0.028	26%	0.263	C	S	.	.			trans	-90.4	149.9	-177.3	-64	0	0	0	0	111.6	G71 G97 R98	G71-S114 PolarHBondContact N-OG 2.96Å; G97-S114 PolarHBondContact O-OG 2.72Å; R98-S114 WeakPolarHBondContact O-CB 3.23Å; R98-S114 PolarHBondContact O-N 3.26Å
115	G	90.9	Very high	85.9	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.01	28%	0.283	C	S	.	.	S	Bend	trans	88	-167.6	174.6	0	0	0	0	0	115.2	A72 N73 H126 F128 P156	A72-G115 WeakPolarHBondContact O-CA 3.47Å; N73-G115 VanDerWaalsContact OD1-CA 3.27Å; N73-G115 WeakPolarHBondContact OD1-CA 3.32Å; N73-G115 PolarHBondContact OD1-N 2.73Å; G115-H126 CarbonylContact C-O 3.6Å; G115-H126 WeakPolarHBondContact CA-O 3.2Å; G115-F128 VanDerWaalsContact O-CE1 3.28Å; G115-F128 WeakPolarHBondContact O-CE1 3.33Å; G115-P156 WeakPolarHBondContact O-CD 3.25Å; G115-P156 WeakPolarHBondContact O-CG 3.33Å
116	T	90.6	Very high	86.3	Confident	39 Å²	39	41.9 Å²	41.9	24%	0.239	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	159.9	-176	49	0	0	0	0	113.1	N73 S118 H126 S127 F128 L197	N73-T116 HydrophobicContact CB-CG2 4.09Å; T116-S118 PolarHBondContact O-N 2.75Å; T116-H126 PolarHBondContact N-O 3.29Å; T116-H126 PolarHBondContact OG1-O 2.93Å; T116-S127 CarbonylContact O-C 3.57Å; T116-S127 WeakPolarHBondContact O-CA 3.42Å; T116-S127 WeakPolarHBondContact O-CB 3.2Å; T116-S127 PolarHBondContact OG1-OG 2.99Å; T116-F128 WeakPolarHBondContact O-CD1 3.42Å; T116-F128 PolarHBondContact O-N 3.4Å; T116-L197 HydrophobicContact CG2-CD1 4.33Å
117	E	90	Very high	86.7	Confident	74 Å²	74	40 Å²	40	35%	0.346	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	123.9	175.3	177.6	168.2	172.1	0	0	110.5	F128 S178 A179 L180	E117-F128 HydrophobicContact CB-CE2 3.73Å; E117-F128 HydrophobicContact CB-CZ 3.81Å; E117-F128 HydrophobicContact CG-CE2 4.25Å; E117-S178 VanDerWaalsContact OE2-CA 3.22Å; E117-S178 WeakPolarHBondContact OE2-CA 3.47Å; E117-S178 WeakPolarHBondContact OE2-CB 3.44Å; E117-S178 PolarHBondContact OE2-OG 3.24Å; E117-A179 PolarHBondContact OE2-N 3.29Å; E117-L180 HydrophobicContact CG-CD1 3.86Å; E117-L180 HydrophobicContact CG-CG 4.43Å
118	S	86.4	Confident	87	Confident	24 Å²	24	39.2 Å²	39.2	17%	0.168	22%	0.222	C	C	.	.			trans	-134.9	147.5	170.5	-175.9	0	0	0	0	112.5	T116 S120 F128	T116-S118 PolarHBondContact O-N 2.75Å; S118-S120 PolarHBondContact OG-N 2.82Å; S118-S120 PolarHBondContact OG-OG 2.74Å; S118-F128 PolarHBondContact N-O 3.49Å
119	L	80.5	Confident	87	Confident	135 Å²	135	39.3 Å²	39.3	71%	0.707	22%	0.223	S	C	*	.			trans	-109	4.7	175.6	-58.4	177.6	0	0	0	112.6	P130	L119-P130 HydrophobicContact CD2-CG 3.9Å
120	S	76.3	Confident	86.9	Confident	53 Å²	53	40 Å²	40	37%	0.371	23%	0.231	S	C	.	.			trans	-76.7	142.2	177.9	65.3	0	0	0	0	112	S118 P122 V123 P124	S118-S120 PolarHBondContact OG-N 2.82Å; S118-S120 PolarHBondContact OG-OG 2.74Å; S120-P122 CarbonylContact C-O 3.55Å; S120-P122 CarbonylContact O-C 3.49Å; S120-P122 VanDerWaalsContact O-C 3.24Å; S120-P122 PolarHBondContact OG-O 3.27Å; S120-V123 WeakPolarHBondContact O-CA 3.02Å; S120-V123 PolarHBondContact O-N 3.16Å; S120-P124 VanDerWaalsContact OG-CD 3.3Å; S120-P124 WeakPolarHBondContact OG-CD 3.43Å
121	E	74.9	Confident	86.5	Confident	125 Å²	125	46.2 Å²	46.2	58%	0.584	26%	0.258	S	S	*	.	S	Bend	trans	-115.7	120.8	170.9	-70.4	-76.5	-169.5	0	0	108.5	K131	E121-K131 WeakPolarHBondContact OE1-CE 3.46Å; E121-K131 IonicContact OE1-NZ 2.65Å; E121-K131 PolarHBondContact OE1-NZ 3.26Å; E121-K131 IonicContact OE2-NZ 3.22Å
122	P	76.4	Confident	86.2	Confident	118 Å²	118	47 Å²	47	77%	0.766	26%	0.262	S	S	*	.	S	Bend	cis	-68.8	152.6	-0.7	30.7	-36.3	0	0	0	113.5	S120	S120-P122 CarbonylContact C-O 3.55Å; S120-P122 CarbonylContact O-C 3.49Å; S120-P122 VanDerWaalsContact O-C 3.24Å; S120-P122 PolarHBondContact OG-O 3.27Å
123	V	78.4	Confident	85.8	Confident	29 Å²	29	46.1 Å²	46.1	18%	0.176	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-78	121.9	179.9	-169.2	0	0	0	0	110	R98 S120	R98-V123 VanDerWaalsContact NH2-CG1 3.35Å; R98-V123 PolarHBondContact NH2-O 3.22Å; S120-V123 WeakPolarHBondContact O-CA 3.02Å; S120-V123 PolarHBondContact O-N 3.16Å
124	P	82.6	Confident	85.5	Confident	37 Å²	37	49.3 Å²	49.3	24%	0.24	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-55.9	152.4	-178.7	-26.2	33.6	0	0	0	113.8	R98 S120 H126 S127	R98-P124 PolarHBondContact NH2-O 2.99Å; S120-P124 VanDerWaalsContact OG-CD 3.3Å; S120-P124 WeakPolarHBondContact OG-CD 3.43Å; P124-H126 PolarHBondContact O-N 2.65Å; P124-S127 PolarHBondContact O-N 3.34Å; P124-S127 VanDerWaalsContact O-O 3.14Å
125	S	81.3	Confident	85.2	Confident	75 Å²	75	51.4 Å²	51.4	52%	0.524	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-31.1	176.4	47.1	0	0	0	0	113.4	V78 S127	V78-S125 VanDerWaalsContact CG1-OG 3.25Å; V78-S125 WeakPolarHBondContact CG1-OG 3.35Å; V78-S125 WeakPolarHBondContact CG2-OG 3.29Å; S125-S127 VanDerWaalsContact C-N 3.29Å; S125-S127 PolarHBondContact O-N 3.48Å
126	H	85.4	Confident	85	Confident	37 Å²	37	51.5 Å²	51.5	17%	0.171	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	16	175.6	59.7	-93.5	0	0	0	114	A72 V78 G115 T116 P124	A72-H126 HydrophobicContact CB-CB 3.94Å; A72-H126 CarbonylContact O-C 3.56Å; A72-H126 WeakPolarHBondContact O-CA 3.23Å; A72-H126 VanDerWaalsContact O-CB 3.26Å; A72-H126 WeakPolarHBondContact O-CB 3.42Å; V78-H126 HydrophobicContact CG2-CB 3.88Å; G115-H126 CarbonylContact C-O 3.6Å; G115-H126 WeakPolarHBondContact CA-O 3.2Å; T116-H126 PolarHBondContact N-O 3.29Å; T116-H126 PolarHBondContact OG1-O 2.93Å; P124-H126 PolarHBondContact O-N 2.65Å
127	S	89.1	Confident	84.8	Confident	4 Å²	4	55.3 Å²	55.3	3%	0.028	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	158.5	-176.2	-57.2	0	0	0	0	113.6	R98 T116 P124 S125	R98-S127 PolarHBondContact NE-O 3.05Å; R98-S127 VanDerWaalsContact NE-O 3.14Å; R98-S127 PolarHBondContact NH2-O 2.91Å; T116-S127 CarbonylContact O-C 3.57Å; T116-S127 WeakPolarHBondContact O-CA 3.42Å; T116-S127 WeakPolarHBondContact O-CB 3.2Å; T116-S127 PolarHBondContact OG1-OG 2.99Å; P124-S127 PolarHBondContact O-N 3.34Å; P124-S127 VanDerWaalsContact O-O 3.14Å; S125-S127 VanDerWaalsContact C-N 3.29Å; S125-S127 PolarHBondContact O-N 3.48Å
128	F	90.1	Very high	84.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	155.2	171	61.9	-101.7	0	0	0	111.3	L113 G115 T116 E117 S118 D132 V133 P156 L180 I181	L113-F128 HydrophobicContact CD1-CB 3.79Å; L113-F128 HydrophobicContact CD1-CD1 4.37Å; L113-F128 HydrophobicContact CD1-CG 4.11Å; L113-F128 HydrophobicContact CD2-CB 4.32Å; L113-F128 HydrophobicContact CD2-CD1 3.81Å; L113-F128 HydrophobicContact CD2-CD2 3.89Å; L113-F128 HydrophobicContact CD2-CE1 4.04Å; L113-F128 HydrophobicContact CD2-CE2 4.13Å; L113-F128 HydrophobicContact CD2-CG 3.74Å; L113-F128 HydrophobicContact CD2-CZ 4.2Å; L113-F128 HydrophobicContact CG-CB 4.15Å; L113-F128 HydrophobicContact CG-CD1 3.78Å; L113-F128 HydrophobicContact CG-CE1 4.32Å; L113-F128 HydrophobicContact CG-CG 3.92Å; G115-F128 VanDerWaalsContact O-CE1 3.28Å; G115-F128 WeakPolarHBondContact O-CE1 3.33Å; T116-F128 WeakPolarHBondContact O-CD1 3.42Å; T116-F128 PolarHBondContact O-N 3.4Å; E117-F128 HydrophobicContact CB-CE2 3.73Å; E117-F128 HydrophobicContact CB-CZ 3.81Å; E117-F128 HydrophobicContact CG-CE2 4.25Å; S118-F128 PolarHBondContact N-O 3.49Å; F128-D132 HydrophobicContact CB-CB 4.37Å; F128-V133 HydrophobicContact CD2-CG2 4.17Å; F128-P156 HydrophobicContact CE1-CG 4.06Å; F128-P156 HydrophobicContact CZ-CG 4.37Å; F128-L180 HydrophobicContact CD2-CD1 4.25Å; F128-L180 HydrophobicContact CE2-CB 4.18Å; F128-L180 HydrophobicContact CE2-CD1 4.07Å; F128-I181 HydrophobicContact CE1-CD1 4.01Å; F128-I181 HydrophobicContact CE1-CG1 4.45Å; F128-I181 HydrophobicContact CE2-CG1 4.31Å; F128-I181 HydrophobicContact CZ-CD1 3.62Å; F128-I181 HydrophobicContact CZ-CG1 3.75Å
129	S	90.2	Very high	84.4	Confident	5 Å²	5	60.3 Å²	60.3	4%	0.035	34%	0.335	C	S	.	.			trans	-116.1	169.2	-178.8	72.9	0	0	0	0	112.9	K131 D132 V133	S129-K131 PolarHBondContact O-N 2.85Å; S129-K131 WeakPolarHBondContact OG-CB 3.35Å; S129-K131 PolarHBondContact OG-N 2.93Å; S129-D132 WeakPolarHBondContact CB-OD2 3.37Å; S129-D132 PolarHBondContact N-OD2 2.97Å; S129-D132 WeakPolarHBondContact O-CB 3.5Å; S129-D132 PolarHBondContact O-N 3.09Å; S129-D132 PolarHBondContact OG-N 2.68Å; S129-D132 PolarHBondContact OG-OD2 2.97Å; S129-V133 PolarHBondContact O-N 3.2Å
130	P	88.6	Confident	84.4	Confident	52 Å²	52	54.8 Å²	54.8	34%	0.338	31%	0.306	S	S	.	.	H	α-helix	trans	-55.9	-29.9	169.6	-24.3	32.9	0	0	0	113.5	L119 S134 L180	L119-P130 HydrophobicContact CD2-CG 3.9Å; P130-S134 VanDerWaalsContact O-CB 3.29Å; P130-S134 WeakPolarHBondContact O-CB 3.45Å; P130-S134 PolarHBondContact O-N 3.38Å; P130-S134 PolarHBondContact O-OG 3.28Å; P130-L180 HydrophobicContact CB-CD1 4.34Å; P130-L180 HydrophobicContact CB-CD2 4.06Å; P130-L180 HydrophobicContact CG-CD1 3.86Å; P130-L180 HydrophobicContact CG-CD2 4.07Å
131	K	87.6	Confident	84.4	Confident	132 Å²	132	54.4 Å²	54.4	57%	0.574	30%	0.303	S	S	*	.	H	α-helix	trans	-68.2	-37.2	176.6	-60.7	169.7	178.3	168.2	0	111.4	E121 S129 S135	E121-K131 WeakPolarHBondContact OE1-CE 3.46Å; E121-K131 IonicContact OE1-NZ 2.65Å; E121-K131 PolarHBondContact OE1-NZ 3.26Å; E121-K131 IonicContact OE2-NZ 3.22Å; S129-K131 PolarHBondContact O-N 2.85Å; S129-K131 WeakPolarHBondContact OG-CB 3.35Å; S129-K131 PolarHBondContact OG-N 2.93Å; K131-S135 WeakPolarHBondContact O-CB 3.24Å; K131-S135 PolarHBondContact O-N 2.86Å
132	D	87.4	Confident	84	Confident	17 Å²	17	52.2 Å²	52.2	9%	0.091	30%	0.301	C	S	.	.	H	α-helix	trans	-68.5	-46.1	179.1	-64.4	-59.8	0	0	0	111.8	K99 F128 S129 S135 L136	K99-D132 HydrophobicContact CD-CB 3.8Å; K99-D132 WeakPolarHBondContact CE-OD1 3.19Å; K99-D132 IonicContact NZ-OD1 3.92Å; K99-D132 PolarHBondContact NZ-OD1 2.84Å; F128-D132 HydrophobicContact CB-CB 4.37Å; S129-D132 WeakPolarHBondContact CB-OD2 3.37Å; S129-D132 PolarHBondContact N-OD2 2.97Å; S129-D132 WeakPolarHBondContact O-CB 3.5Å; S129-D132 PolarHBondContact O-N 3.09Å; S129-D132 PolarHBondContact OG-N 2.68Å; S129-D132 PolarHBondContact OG-OD2 2.97Å; D132-S135 WeakPolarHBondContact O-CB 3.27Å; D132-S135 PolarHBondContact O-N 2.73Å; D132-L136 WeakPolarHBondContact O-CB 3.48Å; D132-L136 PolarHBondContact O-N 2.82Å
133	V	87.9	Confident	83.4	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-41.2	175.8	166.9	0	0	0	0	111.5	L113 F128 S129 L136 R137 L180 L184	L113-V133 HydrophobicContact CD2-CG2 3.67Å; F128-V133 HydrophobicContact CD2-CG2 4.17Å; S129-V133 PolarHBondContact O-N 3.2Å; V133-L136 PolarHBondContact O-N 3.47Å; V133-R137 WeakPolarHBondContact O-CB 3.23Å; V133-R137 PolarHBondContact O-N 3.39Å; V133-L180 HydrophobicContact CB-CB 4.49Å; V133-L180 HydrophobicContact CG1-CB 4.43Å; V133-L180 HydrophobicContact CG2-CB 4.04Å; V133-L184 HydrophobicContact CG1-CB 4.03Å; V133-L184 HydrophobicContact CG1-CD1 4.22Å
134	S	87.1	Confident	82.2	Confident	67 Å²	67	54 Å²	54	47%	0.469	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-42.1	174.6	-58.1	0	0	0	0	112	P130 R137 T138	P130-S134 VanDerWaalsContact O-CB 3.29Å; P130-S134 WeakPolarHBondContact O-CB 3.45Å; P130-S134 PolarHBondContact O-N 3.38Å; P130-S134 PolarHBondContact O-OG 3.28Å; S134-R137 PolarHBondContact O-N 2.81Å; S134-T138 PolarHBondContact O-N 3.43Å; S134-T138 PolarHBondContact O-OG1 2.91Å; S134-T138 VanDerWaalsContact O-OG1 3.09Å
135	S	88.3	Confident	81.3	Confident	49 Å²	49	59.6 Å²	59.6	34%	0.343	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-45.3	176.2	166.7	0	0	0	0	112	K131 D132 T138 M139	K131-S135 WeakPolarHBondContact O-CB 3.24Å; K131-S135 PolarHBondContact O-N 2.86Å; D132-S135 WeakPolarHBondContact O-CB 3.27Å; D132-S135 PolarHBondContact O-N 2.73Å; S135-T138 PolarHBondContact O-N 3.49Å; S135-M139 WeakPolarHBondContact O-CB 3.27Å; S135-M139 PolarHBondContact O-N 3.47Å
136	L	86.6	Confident	81.3	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-67.4	-39.9	178.7	-172.2	59.9	0	0	0	111.9	V111 D132 V133 M139 L140 L184	V111-L136 HydrophobicContact CG1-CD1 4.14Å; V111-L136 HydrophobicContact CG1-CD2 3.83Å; V111-L136 HydrophobicContact CG1-CG 4.16Å; D132-L136 WeakPolarHBondContact O-CB 3.48Å; D132-L136 PolarHBondContact O-N 2.82Å; V133-L136 PolarHBondContact O-N 3.47Å; L136-M139 PolarHBondContact O-N 2.98Å; L136-L140 HydrophobicContact CD1-CD1 4.1Å; L136-L140 HydrophobicContact CG-CD1 4.31Å; L136-L140 PolarHBondContact O-N 2.78Å; L136-L184 HydrophobicContact CD2-CD1 4.22Å; L136-L184 HydrophobicContact CD2-CD2 4.12Å; L136-L184 HydrophobicContact CG-CD1 4.41Å
137	R	86.7	Confident	81.1	Confident	120 Å²	120	63.3 Å²	63.3	45%	0.453	35%	0.351	S	S	.	.	H	α-helix	trans	-61.3	-48.4	172.6	178.9	178.7	172.5	168.8	-4.8	111.8	V133 S134 M139 L140 C141 S187	V133-R137 WeakPolarHBondContact O-CB 3.23Å; V133-R137 PolarHBondContact O-N 3.39Å; S134-R137 PolarHBondContact O-N 2.81Å; R137-M139 VanDerWaalsContact C-N 3.33Å; R137-M139 PolarHBondContact O-N 2.91Å; R137-L140 PolarHBondContact O-N 3.42Å; R137-C141 VanDerWaalsContact O-CB 3.28Å; R137-C141 WeakPolarHBondContact O-CB 3.5Å; R137-C141 PolarHBondContact O-N 3.23Å; R137-C141 PolarHBondContact O-SG 2.76Å; R137-S187 WeakPolarHBondContact CD-OG 3.47Å; R137-S187 VanDerWaalsContact CZ-OG 3.22Å; R137-S187 PolarHBondContact NE-OG 3.06Å; R137-S187 PolarHBondContact NH1-OG 3.42Å
138	T	85.8	Confident	81.1	Confident	97 Å²	97	63.5 Å²	63.5	60%	0.595	35%	0.354	S	S	*	.	H	α-helix	trans	-65.3	-36.6	179.8	-61.6	0	0	0	0	112.1	S134 S135 L140 S142	S134-T138 PolarHBondContact O-N 3.43Å; S134-T138 PolarHBondContact O-OG1 2.91Å; S134-T138 VanDerWaalsContact O-OG1 3.09Å; S135-T138 PolarHBondContact O-N 3.49Å; T138-L140 VanDerWaalsContact C-N 3.32Å; T138-L140 PolarHBondContact O-N 2.68Å; T138-S142 WeakPolarHBondContact O-CB 3.3Å; T138-S142 PolarHBondContact O-N 2.79Å; T138-S142 PolarHBondContact O-OG 3.36Å
139	M	81.7	Confident	81.2	Confident	106 Å²	106	63.7 Å²	63.7	52%	0.522	36%	0.355	S	S	.	.	H	α-helix	trans	-62.4	-35.9	177	-176.6	-178.4	-71.3	0	0	113	F101 S135 L136 R137	F101-M139 HydrophobicContact CD1-SD 3.91Å; F101-M139 HydrophobicContact CE1-CG 4.11Å; F101-M139 HydrophobicContact CE1-SD 3.77Å; S135-M139 WeakPolarHBondContact O-CB 3.27Å; S135-M139 PolarHBondContact O-N 3.47Å; L136-M139 PolarHBondContact O-N 2.98Å; R137-M139 VanDerWaalsContact C-N 3.33Å; R137-M139 PolarHBondContact O-N 2.91Å
140	L	80.4	Confident	81.4	Confident	19 Å²	19	63.4 Å²	63.4	10%	0.099	35%	0.353	C	S	.	.	H	α-helix	trans	-96.8	-42.8	-175.5	-68.4	167.3	0	0	0	113.2	F101 V111 L136 R137 T138 S142 F146 L188	F101-L140 HydrophobicContact CB-CD2 4.21Å; F101-L140 HydrophobicContact CD1-CD2 3.76Å; F101-L140 HydrophobicContact CD1-CG 4.5Å; F101-L140 HydrophobicContact CE1-CD2 4.27Å; F101-L140 HydrophobicContact CG-CD2 3.91Å; V111-L140 HydrophobicContact CB-CD1 4.45Å; V111-L140 HydrophobicContact CG1-CD1 3.9Å; V111-L140 HydrophobicContact CG2-CD1 3.61Å; L136-L140 HydrophobicContact CD1-CD1 4.1Å; L136-L140 HydrophobicContact CG-CD1 4.31Å; L136-L140 PolarHBondContact O-N 2.78Å; R137-L140 PolarHBondContact O-N 3.42Å; T138-L140 VanDerWaalsContact C-N 3.32Å; T138-L140 PolarHBondContact O-N 2.68Å; L140-S142 PolarHBondContact O-N 3.28Å; L140-F146 HydrophobicContact CB-CE2 4.05Å; L140-F146 WeakPolarHBondContact O-CD2 3.49Å; L140-L188 HydrophobicContact CB-CD2 3.79Å; L140-L188 HydrophobicContact CD1-CD1 3.96Å; L140-L188 HydrophobicContact CD1-CD2 3.6Å; L140-L188 HydrophobicContact CD1-CG 4.46Å; L140-L188 HydrophobicContact CG-CD2 4.35Å
141	C	76	Confident	81.8	Confident	44 Å²	44	61 Å²	61	30%	0.297	34%	0.337	S	S	.	.	H	α-helix	trans	-86.9	0.8	-173.5	-55.3	0	0	0	0	114.6	R137 A143 F146	R137-C141 VanDerWaalsContact O-CB 3.28Å; R137-C141 WeakPolarHBondContact O-CB 3.5Å; R137-C141 PolarHBondContact O-N 3.23Å; R137-C141 PolarHBondContact O-SG 2.76Å; C141-A143 VanDerWaalsContact C-N 3.33Å; C141-F146 HydrophobicContact CB-CD1 4.29Å; C141-F146 VanDerWaalsContact SG-CE1 3.6Å
142	S	65.8	Low	82.2	Confident	79 Å²	79	54.7 Å²	54.7	55%	0.552	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-15.5	175.9	48.3	0	0	0	0	113.7	T138 L140 S144	T138-S142 WeakPolarHBondContact O-CB 3.3Å; T138-S142 PolarHBondContact O-N 2.79Å; T138-S142 PolarHBondContact O-OG 3.36Å; L140-S142 PolarHBondContact O-N 3.28Å; S142-S144 PolarHBondContact O-N 3.03Å
143	A	63.8	Low	82.7	Confident	58 Å²	58	54 Å²	54	48%	0.479	31%	0.306	S	S	.	.	S	Bend	trans	-68.7	126.8	173.1	0	0	0	0	0	111	C141 Q145 F146	C141-A143 VanDerWaalsContact C-N 3.33Å; A143-Q145 PolarHBondContact O-N 3.46Å; A143-F146 HydrophobicContact CB-CB 4.5Å; A143-F146 WeakPolarHBondContact O-CB 3.41Å; A143-F146 PolarHBondContact O-N 3.29Å
144	S	53	Low	83.1	Confident	126 Å²	126	53.6 Å²	53.6	88%	0.881	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-4.3	-176.1	56	0	0	0	0	115.7	S142	S142-S144 PolarHBondContact O-N 3.03Å
145	Q	64.6	Low	83.5	Confident	155 Å²	155	50.4 Å²	50.4	72%	0.724	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	29.8	173.5	-57.6	-170.2	15.3	0	0	112.8	A143 K147	A143-Q145 PolarHBondContact O-N 3.46Å; Q145-K147 PolarHBondContact O-N 3.17Å
146	F	80.9	Confident	83.8	Confident	58 Å²	58	48.7 Å²	48.7	25%	0.254	27%	0.269	S	S	.	.			trans	-62.3	105.1	177.5	-179.1	-100.3	0	0	0	111.7	L140 C141 A143 V149 L188	L140-F146 HydrophobicContact CB-CE2 4.05Å; L140-F146 WeakPolarHBondContact O-CD2 3.49Å; C141-F146 HydrophobicContact CB-CD1 4.29Å; C141-F146 VanDerWaalsContact SG-CE1 3.6Å; A143-F146 HydrophobicContact CB-CB 4.5Å; A143-F146 WeakPolarHBondContact O-CB 3.41Å; A143-F146 PolarHBondContact O-N 3.29Å; F146-V149 HydrophobicContact CE2-CG1 3.86Å; F146-V149 HydrophobicContact CZ-CG1 4Å; F146-L188 HydrophobicContact CZ-CB 4.5Å; F146-L188 HydrophobicContact CZ-CD2 4.04Å; F146-L188 WeakPolarHBondContact CZ-O 3.4Å
147	K	81.4	Confident	84.2	Confident	132 Å²	132	48.6 Å²	48.6	57%	0.574	27%	0.268	S	S	*	.			trans	-86.9	-29.7	179.5	-69.7	170.1	-173.7	171.9	0	113	Q145 H219 M246	Q145-K147 PolarHBondContact O-N 3.17Å; K147-H219 PolarHBondContact O-CE1 3.22Å; K147-M246 HydrophobicContact CB-CE 4.17Å
148	G	88.1	Confident	84.5	Confident	9 Å²	9	42.9 Å²	42.9	9%	0.093	25%	0.247	C	C	.	.			trans	145.5	-167.7	-173.7	0	0	0	0	0	111	L188	G148-L188 VanDerWaalsContact CA-O 3.27Å; G148-L188 WeakPolarHBondContact CA-O 3.02Å
149	V	92.8	Very high	84.8	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.018	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	157.7	177.7	-58.6	0	0	0	0	112.1	V111 F146 L188 K189 P190 R191 M246	V111-V149 HydrophobicContact CG2-CB 4Å; V111-V149 HydrophobicContact CG2-CG1 3.76Å; V111-V149 HydrophobicContact CG2-CG2 3.87Å; F146-V149 HydrophobicContact CE2-CG1 3.86Å; F146-V149 HydrophobicContact CZ-CG1 4Å; V149-L188 HydrophobicContact CG2-CB 4.42Å; V149-L188 PolarHBondContact N-O 3.32Å; V149-K189 PolarHBondContact N-O 3.1Å; V149-P190 HydrophobicContact CG2-CB 3.89Å; V149-P190 CarbonylContact O-C 3.56Å; V149-P190 VanDerWaalsContact O-CA 3.22Å; V149-P190 WeakPolarHBondContact O-CA 3.45Å; V149-R191 PolarHBondContact O-N 2.93Å; V149-M246 VanDerWaalsContact O-SD 3.41Å
150	D	94.6	Very high	85.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	-50.8	-179.5	-77.2	-63.9	0	0	0	112	L108 Q109 R191 Y192 I243 P245 M246	L108-D150 HydrophobicContact CD1-CB 3.64Å; Q109-D150 PolarHBondContact N-OD2 3.01Å; Q109-D150 WeakPolarHBondContact O-CB 3.28Å; Q109-D150 PolarHBondContact O-N 3.35Å; D150-R191 WeakPolarHBondContact O-CB 3.49Å; D150-R191 PolarHBondContact O-N 3.12Å; D150-R191 IonicContact OD1-CZ 2.65Å; D150-R191 IonicContact OD1-NH1 3.78Å; D150-R191 PolarHBondContact OD1-NH1 3.49Å; D150-Y192 PolarHBondContact O-N 3.11Å; D150-I243 HydrophobicContact CB-CD1 3.93Å; D150-P245 WeakPolarHBondContact OD1-CA 3.31Å; D150-P245 WeakPolarHBondContact OD2-CA 3.47Å; D150-M246 VanDerWaalsContact CG-N 3.34Å; D150-M246 WeakPolarHBondContact OD1-CG 3.11Å; D150-M246 PolarHBondContact OD1-N 3.43Å; D150-M246 PolarHBondContact OD2-N 2.79Å
151	I	96.9	Very high	85.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.2	-174	-51.5	-179.9	0	0	0	110.4	L8 L39 L108 Q109 I110 V111 L153 Y192 F194 F241 I243	L8-I151 HydrophobicContact CD1-CD1 3.6Å; L39-I151 HydrophobicContact CD1-CD1 4.07Å; L39-I151 HydrophobicContact CD1-CG2 4.48Å; L108-I151 HydrophobicContact CD1-CD1 4.21Å; L108-I151 HydrophobicContact CD1-CG1 4.46Å; L108-I151 HydrophobicContact CD2-CD1 4.21Å; Q109-I151 PolarHBondContact O-N 2.93Å; Q109-I151 VanDerWaalsContact O-N 3.09Å; I110-I151 HydrophobicContact CD1-CD1 4.41Å; I110-I151 HydrophobicContact CG1-CB 4.31Å; I110-I151 HydrophobicContact CG1-CD1 4.25Å; I110-I151 HydrophobicContact CG2-CB 4.31Å; I110-I151 HydrophobicContact CG2-CG2 4.37Å; V111-I151 PolarHBondContact N-O 2.88Å; I151-L153 HydrophobicContact CG2-CD2 3.52Å; I151-L153 HydrophobicContact CG2-CG 4.13Å; I151-Y192 CarbonylContact C-O 3.31Å; I151-Y192 WeakPolarHBondContact CA-O 3.42Å; I151-F194 HydrophobicContact CG2-CD2 3.97Å; I151-F194 HydrophobicContact CG2-CE2 4.25Å; I151-F241 HydrophobicContact CD1-CE2 4.3Å; I151-F241 HydrophobicContact CD1-CZ 3.99Å; I151-I243 HydrophobicContact CG1-CD1 4.24Å
152	L	97.3	Very high	86.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.3	165.2	177	60.6	0	0	0	109.5	V111 T154 L184 A185 L188 P190 Y192 H193 F194	V111-L152 HydrophobicContact CB-CD1 4Å; V111-L152 HydrophobicContact CG1-CD1 3.88Å; V111-L152 CarbonylContact O-C 3.48Å; V111-L152 WeakPolarHBondContact O-CA 3.28Å; L152-T154 HydrophobicContact CD1-CG2 3.99Å; L152-T154 HydrophobicContact CD2-CG2 4.49Å; L152-T154 HydrophobicContact CG-CG2 4.06Å; L152-L184 HydrophobicContact CD1-CD2 4.21Å; L152-A185 HydrophobicContact CD2-CB 4.01Å; L152-L188 HydrophobicContact CD1-CD1 4.31Å; L152-P190 HydrophobicContact CB-CB 3.71Å; L152-P190 HydrophobicContact CB-CG 3.89Å; L152-P190 HydrophobicContact CD2-CG 4.12Å; L152-Y192 PolarHBondContact N-O 2.81Å; L152-H193 HydrophobicContact CB-CB 4.42Å; L152-H193 WeakPolarHBondContact O-CA 3.24Å; L152-H193 PolarHBondContact O-CD2 2.87Å; L152-F194 PolarHBondContact O-N 3.01Å
153	L	97.4	Very high	87.4	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.1	177.6	-54.1	-177.1	0	0	0	109.4	L39 V41 L70 L96 I110 V111 Y112 L113 I151 F194	L39-L153 HydrophobicContact CB-CD1 4.34Å; L39-L153 HydrophobicContact CB-CD2 4.4Å; L39-L153 HydrophobicContact CD1-CD1 4.43Å; L39-L153 HydrophobicContact CD1-CD2 4.14Å; L39-L153 HydrophobicContact CD2-CD1 4.45Å; V41-L153 HydrophobicContact CG1-CB 3.92Å; V41-L153 HydrophobicContact CG1-CD1 4.45Å; V41-L153 HydrophobicContact CG1-CD2 3.6Å; V41-L153 HydrophobicContact CG1-CG 4.18Å; L70-L153 HydrophobicContact CD1-CB 4.3Å; L70-L153 HydrophobicContact CD2-CB 4.09Å; L96-L153 HydrophobicContact CD1-CD1 3.98Å; I110-L153 HydrophobicContact CG2-CD1 3.5Å; I110-L153 VanDerWaalsContact CG2-CD1 3.5Å; I110-L153 HydrophobicContact CG2-CG 3.74Å; V111-L153 PolarHBondContact O-N 3.31Å; Y112-L153 WeakPolarHBondContact CA-O 3.32Å; L113-L153 PolarHBondContact N-O 3.09Å; I151-L153 HydrophobicContact CG2-CD2 3.52Å; I151-L153 HydrophobicContact CG2-CG 4.13Å; L153-F194 HydrophobicContact CD2-CB 4.13Å; L153-F194 HydrophobicContact CD2-CD2 4.08Å
154	T	96.4	Very high	88.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	133.7	175.5	63.4	0	0	0	0	110.7	L113 L152 P156 I181 H193 F194 A195	L113-T154 HydrophobicContact CB-CG2 4.13Å; L152-T154 HydrophobicContact CD1-CG2 3.99Å; L152-T154 HydrophobicContact CD2-CG2 4.49Å; L152-T154 HydrophobicContact CG-CG2 4.06Å; T154-P156 PolarHBondContact OG1-O 3.31Å; T154-P156 VanDerWaalsContact OG1-O 3.12Å; T154-I181 HydrophobicContact CG2-CD1 4.25Å; T154-I181 HydrophobicContact CG2-CG1 4.4Å; T154-I181 HydrophobicContact CG2-CG2 4.04Å; T154-H193 PolarHBondContact OG1-NE2 2.75Å; T154-F194 PolarHBondContact N-O 3.08Å; T154-A195 VanDerWaalsContact O-CA 3.22Å; T154-A195 WeakPolarHBondContact O-CA 3.49Å; T154-A195 WeakPolarHBondContact O-CB 3.08Å
155	S	94.5	Very high	90.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-63.3	-51.7	-178.6	-22.4	0	0	0	0	113.5	V41 N73 A196	V41-S155 VanDerWaalsContact O-CA 3.23Å; V41-S155 WeakPolarHBondContact O-CA 3.45Å; V41-S155 WeakPolarHBondContact O-CB 3.33Å; N73-S155 WeakPolarHBondContact OD1-CB 3.33Å; N73-S155 PolarHBondContact OD1-OG 2.7Å; S155-A196 CarbonylContact O-C 3.24Å; S155-A196 PolarHBondContact O-N 3.5Å
156	P	94.6	Very high	91.2	Very high	12 Å²	12	30.1 Å²	30.1	8%	0.078	15%	0.15	C	C	.	.	S	Bend	trans	-76.1	154.7	176.1	-6.5	24.1	0	0	0	111.1	G115 F128 T154 I181 L197	G115-P156 WeakPolarHBondContact O-CD 3.25Å; G115-P156 WeakPolarHBondContact O-CG 3.33Å; F128-P156 HydrophobicContact CE1-CG 4.06Å; F128-P156 HydrophobicContact CZ-CG 4.37Å; T154-P156 PolarHBondContact OG1-O 3.31Å; T154-P156 VanDerWaalsContact OG1-O 3.12Å; P156-I181 HydrophobicContact CB-CD1 3.89Å; P156-I181 HydrophobicContact CG-CD1 3.82Å; P156-I181 WeakPolarHBondContact O-CD1 3.32Å; P156-L197 HydrophobicContact CB-CD1 4.37Å; P156-L197 HydrophobicContact CG-CD1 4.16Å
157	W	94.7	Very high	91.3	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-70.2	151.2	172.6	-67.4	24.8	0	0	0	110.7	V161 V171 T173 G177 S178 A195 A196 E198 Y202 F223 A225	W157-V161 HydrophobicContact CE3-CG1 4.03Å; W157-V171 HydrophobicContact CE3-CG1 4.11Å; W157-V171 HydrophobicContact CH2-CB 3.91Å; W157-V171 HydrophobicContact CH2-CG1 3.83Å; W157-V171 HydrophobicContact CH2-CG2 3.95Å; W157-V171 HydrophobicContact CZ2-CG1 4.48Å; W157-V171 HydrophobicContact CZ2-CG2 4.48Å; W157-V171 HydrophobicContact CZ3-CB 4.01Å; W157-V171 HydrophobicContact CZ3-CG1 3.63Å; W157-T173 HydrophobicContact CE3-CG2 3.91Å; W157-T173 HydrophobicContact CZ3-CG2 3.8Å; W157-G177 CarbonylContact O-C 3.46Å; W157-G177 WeakPolarHBondContact O-CA 3.49Å; W157-S178 PolarHBondContact O-N 3.04Å; W157-A195 HydrophobicContact CG-CB 4.38Å; W157-A196 PolarHBondContact NE1-O 2.89Å; W157-E198 HydrophobicContact CD2-CB 4.31Å; W157-E198 HydrophobicContact CD2-CG 3.72Å; W157-E198 VanDerWaalsContact CE2-CG 3.49Å; W157-E198 HydrophobicContact CE3-CG 4.5Å; W157-E198 HydrophobicContact CG-CG 3.73Å; W157-E198 HydrophobicContact CH2-CB 4.5Å; W157-E198 HydrophobicContact CZ2-CB 3.7Å; W157-E198 HydrophobicContact CZ2-CG 4.08Å; W157-Y202 HydrophobicContact CE3-CD1 4.36Å; W157-Y202 VanDerWaalsContact CH2-CB 3.5Å; W157-Y202 HydrophobicContact CH2-CD1 4.14Å; W157-Y202 HydrophobicContact CH2-CG 4.2Å; W157-Y202 AromaticContact CZ3-CD1 3.67Å; W157-Y202 HydrophobicContact CZ3-CD1 3.67Å; W157-Y202 HydrophobicContact CZ3-CG 4.17Å; W157-F223 HydrophobicContact CB-CZ 4.38Å; W157-F223 HydrophobicContact CD2-CE1 4.41Å; W157-F223 HydrophobicContact CD2-CZ 4.19Å; W157-F223 HydrophobicContact CE3-CE1 4.37Å; W157-F223 HydrophobicContact CG-CZ 4.09Å; W157-A225 HydrophobicContact CD2-CB 3.99Å; W157-A225 HydrophobicContact CH2-CB 3.97Å; W157-A225 HydrophobicContact CZ2-CB 3.21Å
158	P	93.8	Very high	91.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-63.6	131.7	160.3	18.1	-21.6	0	0	0	110.7	V161 I181 F223 Y266	P158-V161 HydrophobicContact CB-CB 4.45Å; P158-V161 HydrophobicContact CG-CB 3.96Å; P158-V161 HydrophobicContact CG-CG2 4.05Å; P158-V161 WeakPolarHBondContact O-CB 3.3Å; P158-V161 WeakPolarHBondContact O-CG1 3.44Å; P158-V161 PolarHBondContact O-N 3.33Å; P158-I181 HydrophobicContact CB-CB 4.49Å; P158-I181 HydrophobicContact CB-CG2 3.88Å; P158-I181 HydrophobicContact CG-CG2 4.33Å; P158-F223 HydrophobicContact CG-CD2 4.04Å; P158-F223 HydrophobicContact CG-CE2 3.67Å; P158-F223 HydrophobicContact CG-CZ 4.29Å; P158-Y266 HydrophobicContact CB-CE1 3.71Å; P158-Y266 VanDerWaalsContact CB-OH 3.31Å; P158-Y266 WeakPolarHBondContact CB-OH 3.32Å; P158-Y266 HydrophobicContact CG-CE1 4.32Å; P158-Y266 WeakPolarHBondContact CG-OH 3.35Å
159	K	91.7	Very high	90.6	Very high	52 Å²	52	29.5 Å²	29.5	23%	0.226	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	147.1	171.1	-167.3	165.9	-172.1	163.4	0	110.8	V161 K174 S178 A179 S182	K159-V161 PolarHBondContact O-N 3.25Å; K159-K174 WeakPolarHBondContact CE-O 3.15Å; K159-S178 WeakPolarHBondContact CB-O 3.21Å; K159-S178 PolarHBondContact N-O 3.16Å; K159-A179 HydrophobicContact CD-CB 4.41Å; K159-S182 WeakPolarHBondContact CA-OG 3.38Å; K159-S182 PolarHBondContact N-OG 3.06Å; K159-S182 PolarHBondContact O-OG 3.2Å
160	Y	91.4	Very high	89.8	Confident	103 Å²	103	35.9 Å²	35.9	40%	0.404	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	11.2	-177.3	-47.9	-54.8	0	0	0	116	G162 N163 T173 K174 P265	Y160-G162 PolarHBondContact O-N 2.78Å; Y160-N163 VanDerWaalsContact O-CB 3.25Å; Y160-N163 WeakPolarHBondContact O-CB 3.48Å; Y160-N163 PolarHBondContact O-N 2.81Å; Y160-T173 VanDerWaalsContact CA-O 3.29Å; Y160-T173 WeakPolarHBondContact CA-O 3.29Å; Y160-T173 PolarHBondContact N-O 3.4Å; Y160-K174 HydrophobicContact CD1-CB 4.27Å; Y160-K174 HydrophobicContact CD1-CG 4.25Å; Y160-K174 HydrophobicContact CE1-CB 4.34Å; Y160-P265 WeakPolarHBondContact O-CB 3.39Å
161	V	91.1	Very high	89.2	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-29.6	-175.6	64.2	0	0	0	0	114.7	W157 P158 K159 N163 T173 Y202 R204 F223 P265 Y266	W157-V161 HydrophobicContact CE3-CG1 4.03Å; P158-V161 HydrophobicContact CB-CB 4.45Å; P158-V161 HydrophobicContact CG-CB 3.96Å; P158-V161 HydrophobicContact CG-CG2 4.05Å; P158-V161 WeakPolarHBondContact O-CB 3.3Å; P158-V161 WeakPolarHBondContact O-CG1 3.44Å; P158-V161 PolarHBondContact O-N 3.33Å; K159-V161 PolarHBondContact O-N 3.25Å; V161-N163 VanDerWaalsContact C-N 3.29Å; V161-N163 PolarHBondContact O-N 3.01Å; V161-T173 HydrophobicContact CG1-CG2 3.59Å; V161-Y202 HydrophobicContact CG1-CE1 4.3Å; V161-R204 WeakPolarHBondContact O-CD 3.44Å; V161-R204 PolarHBondContact O-NE 3.35Å; V161-F223 HydrophobicContact CG1-CE1 4.25Å; V161-F223 HydrophobicContact CG2-CB 4.21Å; V161-F223 HydrophobicContact CG2-CD1 3.58Å; V161-F223 HydrophobicContact CG2-CD2 4.08Å; V161-F223 HydrophobicContact CG2-CE1 3.92Å; V161-F223 HydrophobicContact CG2-CE2 4.41Å; V161-F223 HydrophobicContact CG2-CG 3.66Å; V161-F223 HydrophobicContact CG2-CZ 4.32Å; V161-P265 WeakPolarHBondContact O-CB 3.26Å; V161-Y266 HydrophobicContact CB-CE1 4.26Å
162	G	88.1	Confident	88.4	Confident	16 Å²	16	39.6 Å²	39.6	17%	0.165	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.4	174.9	0	0	0	0	0	115.7	Y160 F164 G165 T173 Y202	Y160-G162 PolarHBondContact O-N 2.78Å; G162-F164 PolarHBondContact O-N 3.15Å; G162-G165 PolarHBondContact O-N 2.82Å; G162-G165 VanDerWaalsContact O-N 3.08Å; G162-T173 WeakPolarHBondContact CA-OG1 3.43Å; G162-T173 PolarHBondContact N-OG1 3.08Å; G162-Y202 WeakPolarHBondContact CA-OH 3.47Å
163	N	88.5	Confident	87.7	Confident	43 Å²	43	40 Å²	40	23%	0.23	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	132.6	177.1	-82.5	-5.8	0	0	0	110.9	Y160 V161 G165 R204 P265	Y160-N163 VanDerWaalsContact O-CB 3.25Å; Y160-N163 WeakPolarHBondContact O-CB 3.48Å; Y160-N163 PolarHBondContact O-N 2.81Å; V161-N163 VanDerWaalsContact C-N 3.29Å; V161-N163 PolarHBondContact O-N 3.01Å; N163-G165 PolarHBondContact O-N 3.26Å; N163-R204 PolarHBondContact O-NH2 3.5Å; N163-P265 HydrophobicContact CB-CB 3.97Å; N163-P265 WeakPolarHBondContact CB-O 3.39Å; N163-P265 PolarHBondContact ND2-O 3.36Å; N163-P265 VanDerWaalsContact ND2-O 3.12Å
164	F	85.9	Confident	86.8	Confident	120 Å²	120	45.9 Å²	45.9	53%	0.526	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	5.6	-176.5	-40.3	-68.4	0	0	0	115.7	G162 T262 E263	G162-F164 PolarHBondContact O-N 3.15Å; F164-T262 VanDerWaalsContact O-CB 3.32Å; F164-T262 WeakPolarHBondContact O-CB 3.4Å; F164-T262 WeakPolarHBondContact O-CG2 3.35Å; F164-E263 HydrophobicContact CB-CB 4.47Å; F164-E263 HydrophobicContact CD2-CB 4.04Å; F164-E263 HydrophobicContact CG-CB 4.19Å
165	G	86.6	Confident	86	Confident	27 Å²	27	53.7 Å²	53.7	28%	0.278	29%	0.29	S	S	.	.	S	Bend	trans	-100.1	-176.3	-177.7	0	0	0	0	0	114.3	G162 N163	G162-G165 PolarHBondContact O-N 2.82Å; G162-G165 VanDerWaalsContact O-N 3.08Å; N163-G165 PolarHBondContact O-N 3.26Å
166	N	88.4	Confident	85.3	Confident	55 Å²	55	54.7 Å²	54.7	29%	0.294	30%	0.297	S	S	.	.	S	Bend	trans	-64.7	153.8	161.6	56.6	-46.9	0	0	0	111	S168 Y202 E203 R204 L205	N166-S168 PolarHBondContact O-N 3.39Å; N166-Y202 WeakPolarHBondContact O-CE2 3.44Å; N166-Y202 PolarHBondContact O-OH 2.97Å; N166-E203 PolarHBondContact ND2-O 3.26Å; N166-R204 WeakPolarHBondContact OD1-CA 3.29Å; N166-L205 HydrophobicContact CB-CD1 4.39Å; N166-L205 HydrophobicContact CB-CG 4.1Å; N166-L205 PolarHBondContact OD1-N 2.9Å
167	S	83.4	Confident	84.9	Confident	104 Å²	104	55.3 Å²	55.3	73%	0.727	31%	0.305	S	S	*	.			trans	-57.8	136.3	178.7	-177	0	0	0	0	112.4	G169 Y202	S167-G169 PolarHBondContact O-N 3.45Å; S167-G169 PolarHBondContact OG-N 2.93Å; S167-Y202 WeakPolarHBondContact O-CE2 3.46Å
168	S	76	Confident	84.7	Confident	18 Å²	18	55.4 Å²	55.4	13%	0.126	31%	0.306	C	S	.	.			trans	-80.8	8.7	173.1	48.7	0	0	0	0	113.9	N166 E170 V171	N166-S168 PolarHBondContact O-N 3.39Å; S168-E170 PolarHBondContact O-N 2.91Å; S168-V171 WeakPolarHBondContact CB-O 3.37Å; S168-V171 PolarHBondContact O-N 2.85Å; S168-V171 PolarHBondContact OG-O 2.97Å
169	G	79.6	Confident	84.5	Confident	64 Å²	64	57.8 Å²	57.8	66%	0.66	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-114.9	177.7	0	0	0	0	0	111.8	S167	S167-G169 PolarHBondContact O-N 3.45Å; S167-G169 PolarHBondContact OG-N 2.93Å
170	E	74.9	Confident	84.5	Confident	136 Å²	136	56.8 Å²	56.8	64%	0.636	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-22.4	-175.2	-59.7	158.3	151.1	0	0	113.1	S168 K235	S168-E170 PolarHBondContact O-N 2.91Å; E170-K235 IonicContact OE1-NZ 2.82Å; E170-K235 PolarHBondContact OE1-NZ 3.29Å; E170-K235 WeakPolarHBondContact OE2-CE 3.43Å; E170-K235 IonicContact OE2-NZ 3.48Å; E170-K235 PolarHBondContact OE2-NZ 2.89Å
171	V	81.2	Confident	84.6	Confident	14 Å²	14	51.9 Å²	51.9	9%	0.085	30%	0.304	C	S	.	.			trans	-92.6	114.3	-171.2	-179.3	0	0	0	0	110.5	W157 S168 T173 C176 E198	W157-V171 HydrophobicContact CE3-CG1 4.11Å; W157-V171 HydrophobicContact CH2-CB 3.91Å; W157-V171 HydrophobicContact CH2-CG1 3.83Å; W157-V171 HydrophobicContact CH2-CG2 3.95Å; W157-V171 HydrophobicContact CZ2-CG1 4.48Å; W157-V171 HydrophobicContact CZ2-CG2 4.48Å; W157-V171 HydrophobicContact CZ3-CB 4.01Å; W157-V171 HydrophobicContact CZ3-CG1 3.63Å; S168-V171 WeakPolarHBondContact CB-O 3.37Å; S168-V171 PolarHBondContact O-N 2.85Å; S168-V171 PolarHBondContact OG-O 2.97Å; V171-T173 PolarHBondContact O-N 2.84Å; V171-C176 HydrophobicContact CG1-CB 4.39Å; V171-C176 WeakPolarHBondContact CG1-SG 3.44Å; V171-E198 HydrophobicContact CG1-CB 4.29Å; V171-E198 HydrophobicContact CG1-CG 4.3Å; V171-E198 HydrophobicContact CG2-CB 4.34Å
172	D	81.1	Confident	84.7	Confident	65 Å²	65	52.3 Å²	52.3	35%	0.348	31%	0.307	S	S	.	.			trans	-77.3	90.4	174.8	-174.9	-9.3	0	0	0	111.3	K174 K175 C176	D172-K174 PolarHBondContact O-N 2.77Å; D172-K174 WeakPolarHBondContact OD1-CB 3.33Å; D172-K174 PolarHBondContact OD1-N 3.49Å; D172-K175 HydrophobicContact CB-CB 4.42Å; D172-K175 PolarHBondContact O-N 2.86Å; D172-K175 WeakPolarHBondContact OD2-CD 3.39Å; D172-K175 WeakPolarHBondContact OD2-CE 3.36Å; D172-K175 WeakPolarHBondContact OD2-CG 3.38Å; D172-K175 IonicContact OD2-NZ 3.83Å; D172-K175 PolarHBondContact OD2-NZ 3.28Å; D172-C176 PolarHBondContact O-N 3.17Å; D172-C176 PolarHBondContact O-SG 3.33Å
173	T	82.3	Confident	84.9	Confident	8 Å²	8	54.3 Å²	54.3	5%	0.049	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-6.1	178.7	56.8	0	0	0	0	115	W157 Y160 V161 G162 V171	W157-T173 HydrophobicContact CE3-CG2 3.91Å; W157-T173 HydrophobicContact CZ3-CG2 3.8Å; Y160-T173 VanDerWaalsContact CA-O 3.29Å; Y160-T173 WeakPolarHBondContact CA-O 3.29Å; Y160-T173 PolarHBondContact N-O 3.4Å; V161-T173 HydrophobicContact CG1-CG2 3.59Å; G162-T173 WeakPolarHBondContact CA-OG1 3.43Å; G162-T173 PolarHBondContact N-OG1 3.08Å; V171-T173 PolarHBondContact O-N 2.84Å
174	K	78.6	Confident	85.1	Confident	126 Å²	126	52.2 Å²	52.2	55%	0.548	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-19.1	171.3	-57.9	179.8	-179.9	176.2	0	112.6	K159 Y160 D172	K159-K174 WeakPolarHBondContact CE-O 3.15Å; Y160-K174 HydrophobicContact CD1-CB 4.27Å; Y160-K174 HydrophobicContact CD1-CG 4.25Å; Y160-K174 HydrophobicContact CE1-CB 4.34Å; D172-K174 PolarHBondContact O-N 2.77Å; D172-K174 WeakPolarHBondContact OD1-CB 3.33Å; D172-K174 PolarHBondContact OD1-N 3.49Å
175	K	78.6	Confident	85.5	Confident	163 Å²	163	46.5 Å²	46.5	71%	0.709	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-44	177.8	-64.4	-172.1	-171.2	101	0	112.4	D172	D172-K175 HydrophobicContact CB-CB 4.42Å; D172-K175 PolarHBondContact O-N 2.86Å; D172-K175 WeakPolarHBondContact OD2-CD 3.39Å; D172-K175 WeakPolarHBondContact OD2-CE 3.36Å; D172-K175 WeakPolarHBondContact OD2-CG 3.38Å; D172-K175 IonicContact OD2-NZ 3.83Å; D172-K175 PolarHBondContact OD2-NZ 3.28Å
176	C	80.8	Confident	85.7	Confident	22 Å²	22	46.8 Å²	46.8	15%	0.149	28%	0.282	C	S	.	.	S	Bend	trans	-78.2	171.9	177.4	81.5	0	0	0	0	112.5	V171 D172 E198	V171-C176 HydrophobicContact CG1-CB 4.39Å; V171-C176 WeakPolarHBondContact CG1-SG 3.44Å; D172-C176 PolarHBondContact O-N 3.17Å; D172-C176 PolarHBondContact O-SG 3.33Å; C176-E198 WeakPolarHBondContact CB-OE1 3.43Å; C176-E198 WeakPolarHBondContact CB-OE2 3.47Å
177	G	85.8	Confident	85.8	Confident	24 Å²	24	45.1 Å²	45.1	25%	0.247	27%	0.274	C	S	.	.	S	Bend	trans	75.6	165	176.8	0	0	0	0	0	116.3	W157	W157-G177 CarbonylContact O-C 3.46Å; W157-G177 WeakPolarHBondContact O-CA 3.49Å
178	S	90.4	Very high	86.2	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.028	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-90.4	134.3	-177.5	167.9	0	0	0	0	111.9	E117 W157 K159 L180 I181 S182	E117-S178 VanDerWaalsContact OE2-CA 3.22Å; E117-S178 WeakPolarHBondContact OE2-CA 3.47Å; E117-S178 WeakPolarHBondContact OE2-CB 3.44Å; E117-S178 PolarHBondContact OE2-OG 3.24Å; W157-S178 PolarHBondContact O-N 3.04Å; K159-S178 WeakPolarHBondContact CB-O 3.21Å; K159-S178 PolarHBondContact N-O 3.16Å; S178-L180 PolarHBondContact OG-N 3.44Å; S178-I181 PolarHBondContact OG-N 3.34Å; S178-I181 VanDerWaalsContact OG-N 3.1Å; S178-S182 PolarHBondContact O-N 2.94Å; S178-S182 PolarHBondContact O-OG 2.78Å; S178-S182 VanDerWaalsContact O-OG 3.07Å
179	A	90.8	Very high	87.1	Confident	50 Å²	50	41.6 Å²	41.6	41%	0.413	24%	0.243	S	C	.	.	H	α-helix	trans	-74.3	-30.3	173.1	0	0	0	0	0	111.9	E117 K159 S182 S183	E117-A179 PolarHBondContact OE2-N 3.29Å; K159-A179 HydrophobicContact CD-CB 4.41Å; A179-S182 WeakPolarHBondContact O-CB 3.44Å; A179-S182 PolarHBondContact O-N 3.3Å; A179-S183 PolarHBondContact O-N 3.03Å; A179-S183 VanDerWaalsContact O-N 3.11Å
180	L	91.3	Very high	87.8	Confident	30 Å²	30	38.5 Å²	38.5	16%	0.157	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-38.8	174.1	-57.9	176.3	0	0	0	111.3	E117 F128 P130 V133 S178 S183 L184	E117-L180 HydrophobicContact CG-CD1 3.86Å; E117-L180 HydrophobicContact CG-CG 4.43Å; F128-L180 HydrophobicContact CD2-CD1 4.25Å; F128-L180 HydrophobicContact CE2-CB 4.18Å; F128-L180 HydrophobicContact CE2-CD1 4.07Å; P130-L180 HydrophobicContact CB-CD1 4.34Å; P130-L180 HydrophobicContact CB-CD2 4.06Å; P130-L180 HydrophobicContact CG-CD1 3.86Å; P130-L180 HydrophobicContact CG-CD2 4.07Å; V133-L180 HydrophobicContact CB-CB 4.49Å; V133-L180 HydrophobicContact CG1-CB 4.43Å; V133-L180 HydrophobicContact CG2-CB 4.04Å; S178-L180 PolarHBondContact OG-N 3.44Å; L180-S183 PolarHBondContact O-N 3.41Å; L180-L184 WeakPolarHBondContact O-CB 3.22Å; L180-L184 PolarHBondContact O-N 3.44Å
181	I	93.4	Very high	88.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.5	-37	175.1	-64.5	175.9	0	0	0	111.2	L113 F128 T154 P156 P158 S178 S183 L184 A185	L113-I181 HydrophobicContact CD2-CG1 4.43Å; F128-I181 HydrophobicContact CE1-CD1 4.01Å; F128-I181 HydrophobicContact CE1-CG1 4.45Å; F128-I181 HydrophobicContact CE2-CG1 4.31Å; F128-I181 HydrophobicContact CZ-CD1 3.62Å; F128-I181 HydrophobicContact CZ-CG1 3.75Å; T154-I181 HydrophobicContact CG2-CD1 4.25Å; T154-I181 HydrophobicContact CG2-CG1 4.4Å; T154-I181 HydrophobicContact CG2-CG2 4.04Å; P156-I181 HydrophobicContact CB-CD1 3.89Å; P156-I181 HydrophobicContact CG-CD1 3.82Å; P156-I181 WeakPolarHBondContact O-CD1 3.32Å; P158-I181 HydrophobicContact CB-CB 4.49Å; P158-I181 HydrophobicContact CB-CG2 3.88Å; P158-I181 HydrophobicContact CG-CG2 4.33Å; S178-I181 PolarHBondContact OG-N 3.34Å; S178-I181 VanDerWaalsContact OG-N 3.1Å; I181-S183 PolarHBondContact O-N 3.24Å; I181-L184 PolarHBondContact O-N 2.91Å; I181-A185 WeakPolarHBondContact O-CB 3.38Å; I181-A185 PolarHBondContact O-N 2.8Å
182	S	93.5	Very high	89.6	Confident	9 Å²	9	34.5 Å²	34.5	6%	0.063	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-47	172	-44.8	0	0	0	0	111.7	K159 S178 A179 A185 A186 Y266	K159-S182 WeakPolarHBondContact CA-OG 3.38Å; K159-S182 PolarHBondContact N-OG 3.06Å; K159-S182 PolarHBondContact O-OG 3.2Å; S178-S182 PolarHBondContact O-N 2.94Å; S178-S182 PolarHBondContact O-OG 2.78Å; S178-S182 VanDerWaalsContact O-OG 3.07Å; A179-S182 WeakPolarHBondContact O-CB 3.44Å; A179-S182 PolarHBondContact O-N 3.3Å; S182-A185 PolarHBondContact O-N 3.26Å; S182-A186 VanDerWaalsContact O-CB 3.3Å; S182-A186 WeakPolarHBondContact O-CB 3.45Å; S182-A186 PolarHBondContact O-N 2.93Å; S182-Y266 WeakPolarHBondContact O-CD2 3.28Å
183	S	91.9	Very high	90.3	Very high	58 Å²	58	31.4 Å²	31.4	41%	0.406	17%	0.173	S	C	.	.	H	α-helix	trans	-63.2	-40.4	176.5	-174.8	0	0	0	0	112.2	A179 L180 I181 S187	A179-S183 PolarHBondContact O-N 3.03Å; A179-S183 VanDerWaalsContact O-N 3.11Å; L180-S183 PolarHBondContact O-N 3.41Å; I181-S183 PolarHBondContact O-N 3.24Å; S183-S187 WeakPolarHBondContact O-CB 3.35Å; S183-S187 PolarHBondContact O-N 2.96Å; S183-S187 PolarHBondContact O-OG 3.01Å
184	L	92.4	Very high	91.1	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.6	-50.1	175.8	-173.5	65.2	0	0	0	111.6	L113 V133 L136 L152 L180 I181 A186 S187 L188	L113-L184 HydrophobicContact CD2-CD2 4.03Å; V133-L184 HydrophobicContact CG1-CB 4.03Å; V133-L184 HydrophobicContact CG1-CD1 4.22Å; L136-L184 HydrophobicContact CD2-CD1 4.22Å; L136-L184 HydrophobicContact CD2-CD2 4.12Å; L136-L184 HydrophobicContact CG-CD1 4.41Å; L152-L184 HydrophobicContact CD1-CD2 4.21Å; L180-L184 WeakPolarHBondContact O-CB 3.22Å; L180-L184 PolarHBondContact O-N 3.44Å; I181-L184 PolarHBondContact O-N 2.91Å; L184-A186 PolarHBondContact O-N 2.65Å; L184-S187 PolarHBondContact O-N 3.38Å; L184-S187 VanDerWaalsContact O-N 3.14Å; L184-L188 HydrophobicContact CD1-CD1 3.58Å; L184-L188 HydrophobicContact CD1-CG 3.83Å; L184-L188 HydrophobicContact CD2-CD1 4.48Å; L184-L188 HydrophobicContact CG-CD1 3.82Å; L184-L188 HydrophobicContact CG-CG 4.23Å; L184-L188 WeakPolarHBondContact O-CB 3.26Å; L184-L188 WeakPolarHBondContact O-CG 3.49Å; L184-L188 PolarHBondContact O-N 2.84Å
185	A	93.9	Very high	91.9	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.7	-37	-179.6	0	0	0	0	0	112.4	L152 I181 S182 S187 K189 P190 Y266	L152-A185 HydrophobicContact CD2-CB 4.01Å; I181-A185 WeakPolarHBondContact O-CB 3.38Å; I181-A185 PolarHBondContact O-N 2.8Å; S182-A185 PolarHBondContact O-N 3.26Å; A185-S187 VanDerWaalsContact C-N 3.33Å; A185-K189 PolarHBondContact O-N 3.4Å; A185-K189 VanDerWaalsContact O-N 3.12Å; A185-P190 WeakPolarHBondContact O-CD 3.48Å; A185-Y266 HydrophobicContact CB-CD2 4.31Å; A185-Y266 HydrophobicContact CB-CE2 3.58Å
186	A	92.1	Very high	92.7	Very high	33 Å²	33	17.3 Å²	17.3	27%	0.273	11%	0.111	S	C	.	.	H	α-helix	trans	-63.5	-36.9	171.6	0	0	0	0	0	112.7	S182 L184 Y266	S182-A186 VanDerWaalsContact O-CB 3.3Å; S182-A186 WeakPolarHBondContact O-CB 3.45Å; S182-A186 PolarHBondContact O-N 2.93Å; L184-A186 PolarHBondContact O-N 2.65Å; A186-Y266 HydrophobicContact CB-CD2 3.98Å; A186-Y266 HydrophobicContact CB-CG 4.47Å
187	S	90.8	Very high	93.2	Very high	19 Å²	19	18.1 Å²	18.1	13%	0.133	11%	0.114	C	C	.	.	H	α-helix	trans	-78.7	-45.6	-178.6	-56.1	0	0	0	0	112.7	R137 S183 L184 A185	R137-S187 WeakPolarHBondContact CD-OG 3.47Å; R137-S187 VanDerWaalsContact CZ-OG 3.22Å; R137-S187 PolarHBondContact NE-OG 3.06Å; R137-S187 PolarHBondContact NH1-OG 3.42Å; S183-S187 WeakPolarHBondContact O-CB 3.35Å; S183-S187 PolarHBondContact O-N 2.96Å; S183-S187 PolarHBondContact O-OG 3.01Å; L184-S187 PolarHBondContact O-N 3.38Å; L184-S187 VanDerWaalsContact O-N 3.14Å; A185-S187 VanDerWaalsContact C-N 3.33Å
188	L	91.7	Very high	93.4	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-81.5	-18	-174.8	-66.5	-172	0	0	0	114	V111 L140 F146 G148 V149 L152 L184	V111-L188 HydrophobicContact CB-CD1 4.31Å; V111-L188 HydrophobicContact CG1-CD1 3.71Å; V111-L188 HydrophobicContact CG2-CD1 4.35Å; L140-L188 HydrophobicContact CB-CD2 3.79Å; L140-L188 HydrophobicContact CD1-CD1 3.96Å; L140-L188 HydrophobicContact CD1-CD2 3.6Å; L140-L188 HydrophobicContact CD1-CG 4.46Å; L140-L188 HydrophobicContact CG-CD2 4.35Å; F146-L188 HydrophobicContact CZ-CB 4.5Å; F146-L188 HydrophobicContact CZ-CD2 4.04Å; F146-L188 WeakPolarHBondContact CZ-O 3.4Å; G148-L188 VanDerWaalsContact CA-O 3.27Å; G148-L188 WeakPolarHBondContact CA-O 3.02Å; V149-L188 HydrophobicContact CG2-CB 4.42Å; V149-L188 PolarHBondContact N-O 3.32Å; L152-L188 HydrophobicContact CD1-CD1 4.31Å; L184-L188 HydrophobicContact CD1-CD1 3.58Å; L184-L188 HydrophobicContact CD1-CG 3.83Å; L184-L188 HydrophobicContact CD2-CD1 4.48Å; L184-L188 HydrophobicContact CG-CD1 3.82Å; L184-L188 HydrophobicContact CG-CG 4.23Å; L184-L188 WeakPolarHBondContact O-CB 3.26Å; L184-L188 WeakPolarHBondContact O-CG 3.49Å; L184-L188 PolarHBondContact O-N 2.84Å
189	K	93.9	Very high	93.3	Very high	48 Å²	48	26.4 Å²	26.4	21%	0.209	14%	0.144	C	C	.	.			trans	46.6	61.5	178.1	-60.8	173.8	173.9	-176.8	0	111.3	V149 A185 N209 H219	V149-K189 PolarHBondContact N-O 3.1Å; A185-K189 PolarHBondContact O-N 3.4Å; A185-K189 VanDerWaalsContact O-N 3.12Å; K189-N209 HydrophobicContact CB-CB 4.06Å; K189-N209 HydrophobicContact CD-CB 4.05Å; K189-N209 WeakPolarHBondContact CE-O 3.43Å; K189-N209 HydrophobicContact CG-CB 3.94Å; K189-N209 PolarHBondContact NZ-O 2.84Å; K189-H219 PolarHBondContact O-CE1 2.93Å; K189-H219 PolarHBondContact O-NE2 2.98Å
190	P	95.4	Very high	93.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	161.1	179.8	28.5	-33.1	0	0	0	111.5	V149 L152 A185 H193 T221	V149-P190 HydrophobicContact CG2-CB 3.89Å; V149-P190 CarbonylContact O-C 3.56Å; V149-P190 VanDerWaalsContact O-CA 3.22Å; V149-P190 WeakPolarHBondContact O-CA 3.45Å; L152-P190 HydrophobicContact CB-CB 3.71Å; L152-P190 HydrophobicContact CB-CG 3.89Å; L152-P190 HydrophobicContact CD2-CG 4.12Å; A185-P190 WeakPolarHBondContact O-CD 3.48Å; P190-H193 HydrophobicContact CG-CB 4.15Å; P190-T221 HydrophobicContact CG-CG2 3.92Å; P190-T221 WeakPolarHBondContact O-CA 3.2Å; P190-T221 WeakPolarHBondContact O-CB 3.46Å; P190-T221 WeakPolarHBondContact O-CG2 3.12Å; P190-T221 PolarHBondContact O-OG1 3.07Å
191	R	95.3	Very high	93.5	Very high	35 Å²	35	25.2 Å²	25.2	13%	0.132	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-37.5	167	-72.9	172	63.5	-150.5	9.1	112.1	V149 D150 H219 T221 R222 V244 M246 M249	V149-R191 PolarHBondContact O-N 2.93Å; D150-R191 WeakPolarHBondContact O-CB 3.49Å; D150-R191 PolarHBondContact O-N 3.12Å; D150-R191 IonicContact OD1-CZ 2.65Å; D150-R191 IonicContact OD1-NH1 3.78Å; D150-R191 PolarHBondContact OD1-NH1 3.49Å; R191-H219 HydrophobicContact CG-CB 4.43Å; R191-H219 WeakPolarHBondContact CG-CD2 3.38Å; R191-T221 CarbonylContact O-C 3.45Å; R191-R222 PolarHBondContact O-N 2.77Å; R191-V244 PolarHBondContact NH1-O 3.48Å; R191-M246 VanDerWaalsContact CD-SD 3.52Å; R191-M246 HydrophobicContact CG-CG 4.29Å; R191-M246 HydrophobicContact CG-SD 3.88Å; R191-M249 PolarHBondContact NH2-SD 2.86Å
192	Y	97	Very high	93.5	Very high	30 Å²	30	25.6 Å²	25.6	12%	0.118	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.1	170.8	-70.7	-95	0	0	0	110.4	D150 I151 L152 F194 R222 I224 F241 I243	D150-Y192 PolarHBondContact O-N 3.11Å; I151-Y192 CarbonylContact C-O 3.31Å; I151-Y192 WeakPolarHBondContact CA-O 3.42Å; L152-Y192 PolarHBondContact N-O 2.81Å; Y192-F194 HydrophobicContact CD1-CE2 4.24Å; Y192-F194 AromaticContact CD1-CZ 3.93Å; Y192-F194 HydrophobicContact CD1-CZ 3.93Å; Y192-F194 HydrophobicContact CG-CE2 4.26Å; Y192-F194 HydrophobicContact CG-CZ 4.4Å; Y192-R222 CarbonylContact C-O 3.59Å; Y192-R222 WeakPolarHBondContact CA-O 3.31Å; Y192-R222 HydrophobicContact CD1-CB 4.07Å; Y192-R222 HydrophobicContact CE1-CB 4.21Å; Y192-I224 HydrophobicContact CD1-CD1 3.93Å; Y192-I224 HydrophobicContact CE1-CD1 4.47Å; Y192-F241 HydrophobicContact CD1-CD2 4.19Å; Y192-F241 HydrophobicContact CD1-CE2 4.22Å; Y192-F241 HydrophobicContact CD2-CD2 4.45Å; Y192-F241 HydrophobicContact CD2-CE2 4.14Å; Y192-F241 AromaticContact CE1-CD2 3.88Å; Y192-F241 HydrophobicContact CE1-CD2 3.88Å; Y192-F241 HydrophobicContact CE1-CE2 4.34Å; Y192-F241 HydrophobicContact CE1-CG 4.46Å; Y192-F241 HydrophobicContact CE2-CD2 4.16Å; Y192-F241 HydrophobicContact CE2-CE2 4.27Å; Y192-F241 HydrophobicContact CG-CD2 4.46Å; Y192-F241 HydrophobicContact CG-CE2 4.11Å; Y192-F241 AromaticContact CZ-CD2 3.86Å; Y192-I243 HydrophobicContact CD2-CD1 3.72Å; Y192-I243 HydrophobicContact CE2-CD1 3.88Å; Y192-I243 HydrophobicContact CE2-CG1 4.28Å
193	H	97.5	Very high	93.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	117.7	171.4	-175.1	-177.9	0	0	0	108.9	L152 T154 P190 T221 R222 F223 I224	L152-H193 HydrophobicContact CB-CB 4.42Å; L152-H193 WeakPolarHBondContact O-CA 3.24Å; L152-H193 PolarHBondContact O-CD2 2.87Å; T154-H193 PolarHBondContact OG1-NE2 2.75Å; P190-H193 HydrophobicContact CG-CB 4.15Å; H193-T221 HydrophobicContact CB-CG2 4.42Å; H193-R222 PolarHBondContact N-O 3.22Å; H193-F223 HydrophobicContact CB-CD2 3.98Å; H193-F223 AromaticContact CG-CD2 3.82Å; H193-F223 AromaticContact ND1-CD2 3.85Å; H193-F223 WeakPolarHBondContact O-CA 3.44Å; H193-I224 PolarHBondContact O-N 3.21Å
194	F	97.8	Very high	93.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.2	179.2	-65.2	-77.9	0	0	0	111.6	A10 V41 I151 L152 L153 T154 Y192 I224 L226 Y239 F241	A10-F194 HydrophobicContact CB-CD1 3.59Å; A10-F194 HydrophobicContact CB-CD2 4.22Å; A10-F194 HydrophobicContact CB-CE1 3.61Å; A10-F194 HydrophobicContact CB-CE2 4.23Å; A10-F194 HydrophobicContact CB-CG 3.92Å; A10-F194 HydrophobicContact CB-CZ 3.94Å; V41-F194 HydrophobicContact CG1-CB 3.95Å; V41-F194 HydrophobicContact CG2-CB 4.11Å; I151-F194 HydrophobicContact CG2-CD2 3.97Å; I151-F194 HydrophobicContact CG2-CE2 4.25Å; L152-F194 PolarHBondContact O-N 3.01Å; L153-F194 HydrophobicContact CD2-CB 4.13Å; L153-F194 HydrophobicContact CD2-CD2 4.08Å; T154-F194 PolarHBondContact N-O 3.08Å; Y192-F194 HydrophobicContact CD1-CE2 4.24Å; Y192-F194 AromaticContact CD1-CZ 3.93Å; Y192-F194 HydrophobicContact CD1-CZ 3.93Å; Y192-F194 HydrophobicContact CG-CE2 4.26Å; Y192-F194 HydrophobicContact CG-CZ 4.4Å; F194-I224 WeakPolarHBondContact CA-O 3.34Å; F194-I224 HydrophobicContact CD1-CB 3.89Å; F194-I224 HydrophobicContact CD1-CD1 4.47Å; F194-I224 HydrophobicContact CD1-CG2 4.45Å; F194-I224 HydrophobicContact CE1-CB 3.86Å; F194-I224 HydrophobicContact CE1-CD1 3.88Å; F194-I224 HydrophobicContact CE1-CG1 4.23Å; F194-I224 HydrophobicContact CE1-CG2 4.38Å; F194-I224 HydrophobicContact CZ-CD1 4.26Å; F194-L226 HydrophobicContact CD1-CD1 4.48Å; F194-Y239 AromaticContact CE1-CD1 3.78Å; F194-Y239 HydrophobicContact CE1-CD1 3.78Å; F194-Y239 HydrophobicContact CE1-CE1 4.29Å; F194-Y239 HydrophobicContact CE1-CG 4.43Å; F194-Y239 HydrophobicContact CZ-CD1 4.13Å; F194-Y239 HydrophobicContact CZ-CE1 4.45Å; F194-F241 HydrophobicContact CE1-CE1 4.41Å; F194-F241 AromaticContact CE2-CE1 3.68Å; F194-F241 HydrophobicContact CE2-CE1 3.68Å; F194-F241 HydrophobicContact CE2-CE2 4.2Å; F194-F241 AromaticContact CE2-CZ 3.47Å; F194-F241 HydrophobicContact CE2-CZ 3.47Å; F194-F241 VanDerWaalsContact CE2-CZ 3.47Å; F194-F241 AromaticContact CZ-CD1 3.87Å; F194-F241 HydrophobicContact CZ-CD1 3.87Å; F194-F241 AromaticContact CZ-CE1 3.4Å; F194-F241 HydrophobicContact CZ-CE1 3.4Å; F194-F241 VanDerWaalsContact CZ-CE1 3.4Å; F194-F241 HydrophobicContact CZ-CE2 4.21Å; F194-F241 HydrophobicContact CZ-CG 4.45Å; F194-F241 AromaticContact CZ-CZ 3.6Å; F194-F241 HydrophobicContact CZ-CZ 3.6Å
195	A	96.4	Very high	93.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	170.3	177.8	0	0	0	0	0	113.5	T154 W157 F223 I224 A225 L226	T154-A195 VanDerWaalsContact O-CA 3.22Å; T154-A195 WeakPolarHBondContact O-CA 3.49Å; T154-A195 WeakPolarHBondContact O-CB 3.08Å; W157-A195 HydrophobicContact CG-CB 4.38Å; A195-F223 HydrophobicContact CB-CE2 3.94Å; A195-F223 HydrophobicContact CB-CZ 3.95Å; A195-I224 PolarHBondContact N-O 3.05Å; A195-A225 VanDerWaalsContact O-CA 3.3Å; A195-A225 WeakPolarHBondContact O-CA 3.26Å; A195-L226 PolarHBondContact O-N 2.9Å
196	A	94.5	Very high	93.6	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.008	14%	0.139	C	C	.	.			trans	-147.8	-141.3	-174.3	0	0	0	0	0	111.4	V41 G42 S155 W157 E198	V41-A196 HydrophobicContact CG2-CB 4.2Å; G42-A196 VanDerWaalsContact CA-CB 3.4Å; S155-A196 CarbonylContact O-C 3.24Å; S155-A196 PolarHBondContact O-N 3.5Å; W157-A196 PolarHBondContact NE1-O 2.89Å; A196-E198 PolarHBondContact O-N 3.12Å
197	L	91.3	Very high	93.7	Very high	40 Å²	40	27.2 Å²	27.2	21%	0.209	13%	0.126	C	C	.	.	S	Bend	trans	65	-39.8	177.6	-59.7	-178.5	0	0	0	117	D13 N43 N73 T116 P156 K199	D13-L197 PolarHBondContact OD1-N 2.75Å; D13-L197 PolarHBondContact OD2-N 3.41Å; N43-L197 WeakPolarHBondContact OD1-CD2 3.46Å; N73-L197 HydrophobicContact CB-CD1 4.36Å; N73-L197 HydrophobicContact CB-CD2 4.2Å; T116-L197 HydrophobicContact CG2-CD1 4.33Å; P156-L197 HydrophobicContact CB-CD1 4.37Å; P156-L197 HydrophobicContact CG-CD1 4.16Å; L197-K199 WeakPolarHBondContact O-CG 3.31Å; L197-K199 PolarHBondContact O-N 3.11Å
198	E	89.6	Confident	93.8	Very high	63 Å²	63	28.7 Å²	28.7	29%	0.294	13%	0.128	S	C	.	.	S	Bend	trans	-73.5	7.2	-180	-56.1	-67.1	158.7	0	0	113.5	W157 V171 C176 A196 S200	W157-E198 HydrophobicContact CD2-CB 4.31Å; W157-E198 HydrophobicContact CD2-CG 3.72Å; W157-E198 VanDerWaalsContact CE2-CG 3.49Å; W157-E198 HydrophobicContact CE3-CG 4.5Å; W157-E198 HydrophobicContact CG-CG 3.73Å; W157-E198 HydrophobicContact CH2-CB 4.5Å; W157-E198 HydrophobicContact CZ2-CB 3.7Å; W157-E198 HydrophobicContact CZ2-CG 4.08Å; V171-E198 HydrophobicContact CG1-CB 4.29Å; V171-E198 HydrophobicContact CG1-CG 4.3Å; V171-E198 HydrophobicContact CG2-CB 4.34Å; C176-E198 WeakPolarHBondContact CB-OE1 3.43Å; C176-E198 WeakPolarHBondContact CB-OE2 3.47Å; A196-E198 PolarHBondContact O-N 3.12Å; E198-S200 PolarHBondContact O-N 2.62Å
199	K	89.6	Confident	93.8	Very high	138 Å²	138	28.8 Å²	28.8	60%	0.6	13%	0.129	S	C	*	.	S	Bend	trans	57.4	8.5	175.7	-52	-170.6	-178.9	177.1	0	116.7	L197 A227 N228	L197-K199 WeakPolarHBondContact O-CG 3.31Å; L197-K199 PolarHBondContact O-N 3.11Å; K199-A227 WeakPolarHBondContact O-CB 3.5Å; K199-N228 WeakPolarHBondContact CA-OD1 3.29Å; K199-N228 WeakPolarHBondContact CB-OD1 3.47Å; K199-N228 WeakPolarHBondContact CG-OD1 3.44Å
200	S	91.4	Very high	93.6	Very high	10 Å²	10	27 Å²	27	7%	0.07	12%	0.121	C	C	.	.	S	Bend	trans	-127.1	158.7	-174.7	-158.5	0	0	0	0	112.5	E198 L226	E198-S200 PolarHBondContact O-N 2.62Å; S200-L226 CarbonylContact O-C 3.53Å
201	Y	93.3	Very high	93.1	Very high	46 Å²	46	28.7 Å²	28.7	18%	0.18	13%	0.131	C	C	.	.			trans	-96	127.7	176.5	177.2	-101.4	0	0	0	110.4	E203 I224 A225 L226 K236	Y201-E203 HydrophobicContact CE1-CB 3.78Å; Y201-E203 PolarHBondContact OH-OE2 3.44Å; Y201-I224 HydrophobicContact CE2-CG2 3.85Å; Y201-A225 WeakPolarHBondContact CA-O 3.31Å; Y201-A225 WeakPolarHBondContact CD2-O 3.48Å; Y201-L226 HydrophobicContact CD2-CD2 4.01Å; Y201-L226 HydrophobicContact CE2-CD2 3.9Å; Y201-K236 HydrophobicContact CD1-CB 4.38Å; Y201-K236 HydrophobicContact CD1-CD 4.13Å; Y201-K236 HydrophobicContact CD2-CB 3.56Å; Y201-K236 HydrophobicContact CD2-CD 4.21Å; Y201-K236 WeakPolarHBondContact CD2-O 3.21Å; Y201-K236 HydrophobicContact CE1-CD 3.61Å; Y201-K236 HydrophobicContact CE2-CB 3.77Å; Y201-K236 HydrophobicContact CE2-CD 3.71Å; Y201-K236 HydrophobicContact CE2-CG 4.44Å; Y201-K236 HydrophobicContact CG-CB 3.85Å; Y201-K236 HydrophobicContact CG-CD 4.36Å; Y201-K236 WeakPolarHBondContact OH-CD 3.39Å; Y201-K236 PolarHBondContact OH-NZ 2.85Å
202	Y	93.6	Very high	92.5	Very high	7 Å²	7	30.4 Å²	30.4	3%	0.027	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	105.4	173	177.1	-130.7	0	0	0	110.7	W157 V161 G162 N166 S167 R204 F223 I224 A225	W157-Y202 HydrophobicContact CE3-CD1 4.36Å; W157-Y202 VanDerWaalsContact CH2-CB 3.5Å; W157-Y202 HydrophobicContact CH2-CD1 4.14Å; W157-Y202 HydrophobicContact CH2-CG 4.2Å; W157-Y202 AromaticContact CZ3-CD1 3.67Å; W157-Y202 HydrophobicContact CZ3-CD1 3.67Å; W157-Y202 HydrophobicContact CZ3-CG 4.17Å; V161-Y202 HydrophobicContact CG1-CE1 4.3Å; G162-Y202 WeakPolarHBondContact CA-OH 3.47Å; N166-Y202 WeakPolarHBondContact O-CE2 3.44Å; N166-Y202 PolarHBondContact O-OH 2.97Å; S167-Y202 WeakPolarHBondContact O-CE2 3.46Å; Y202-R204 HydrophobicContact CE1-CB 4.01Å; Y202-R204 HydrophobicContact CE1-CG 4.2Å; Y202-F223 HydrophobicContact CD1-CD1 4.17Å; Y202-F223 AromaticContact CD1-CE1 3.97Å; Y202-F223 HydrophobicContact CD1-CE1 3.97Å; Y202-F223 HydrophobicContact CE1-CD1 4.44Å; Y202-I224 WeakPolarHBondContact O-CA 3.38Å; Y202-A225 PolarHBondContact N-O 3.23Å; Y202-A225 VanDerWaalsContact N-O 3.12Å; Y202-A225 PolarHBondContact O-N 3.2Å
203	E	93.8	Very high	91.6	Very high	66 Å²	66	37.5 Å²	37.5	31%	0.308	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	108.2	167.2	-178.1	163.2	-144.2	0	0	107.7	N166 Y201 I224 K236 Y239	N166-E203 PolarHBondContact ND2-O 3.26Å; Y201-E203 HydrophobicContact CE1-CB 3.78Å; Y201-E203 PolarHBondContact OH-OE2 3.44Å; E203-I224 HydrophobicContact CG-CG1 4.37Å; E203-K236 IonicContact OE2-NZ 3.67Å; E203-Y239 VanDerWaalsContact OE1-CE2 3.24Å; E203-Y239 WeakPolarHBondContact OE1-CE2 3.27Å; E203-Y239 PolarHBondContact OE1-OH 3.14Å
204	R	93.1	Very high	90.9	Very high	6 Å²	6	45.2 Å²	45.2	2%	0.023	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-79.6	143.8	177.6	-165.7	-160.2	-179.4	-78.7	3	109.2	V161 N163 N166 Y202 F223 T262 E263	V161-R204 WeakPolarHBondContact O-CD 3.44Å; V161-R204 PolarHBondContact O-NE 3.35Å; N163-R204 PolarHBondContact O-NH2 3.5Å; N166-R204 WeakPolarHBondContact OD1-CA 3.29Å; Y202-R204 HydrophobicContact CE1-CB 4.01Å; Y202-R204 HydrophobicContact CE1-CG 4.2Å; R204-F223 HydrophobicContact CB-CB 4.05Å; R204-F223 HydrophobicContact CB-CD1 4.19Å; R204-F223 PolarHBondContact N-O 3.1Å; R204-T262 VanDerWaalsContact CZ-OG1 3.32Å; R204-T262 PolarHBondContact NH1-OG1 2.84Å; R204-T262 PolarHBondContact NH2-OG1 2.7Å; R204-E263 PolarHBondContact NH2-O 2.88Å
205	L	92.9	Very high	90.3	Very high	61 Å²	61	49.2 Å²	49.2	32%	0.319	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-48.6	148	160.5	-62.1	-177.3	0	0	0	110.2	N166 D260 T262	N166-L205 HydrophobicContact CB-CD1 4.39Å; N166-L205 HydrophobicContact CB-CG 4.1Å; N166-L205 PolarHBondContact OD1-N 2.9Å; L205-D260 HydrophobicContact CD2-CB 4.27Å; L205-T262 HydrophobicContact CB-CG2 3.8Å; L205-T262 HydrophobicContact CD1-CG2 4.07Å
206	P	94.3	Very high	89.7	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-61.5	150.8	177.9	-21.2	33.9	0	0	0	111.6	A220 T221 R222 P258 D260 V261 T262	P206-A220 HydrophobicContact CB-CB 4.16Å; P206-T221 CarbonylContact C-O 3.44Å; P206-T221 WeakPolarHBondContact CA-O 3.45Å; P206-R222 HydrophobicContact CB-CG 4.4Å; P206-R222 HydrophobicContact CG-CG 4.28Å; P206-P258 HydrophobicContact CB-CB 4.3Å; P206-P258 HydrophobicContact CB-CG 3.89Å; P206-P258 HydrophobicContact CG-CB 3.89Å; P206-P258 HydrophobicContact CG-CG 3.81Å; P206-D260 WeakPolarHBondContact CD-OD2 3.36Å; P206-V261 HydrophobicContact CB-CG2 4.32Å; P206-V261 WeakPolarHBondContact O-CA 3.38Å; P206-T262 PolarHBondContact O-N 2.66Å; P206-T262 PolarHBondContact O-OG1 2.8Å
207	Y	94	Very high	89.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.5	170.1	62.9	-99.2	0	0	0	112.7	N209 A220 T221 E263 N264 P265 Y266	Y207-N209 WeakPolarHBondContact CE2-OD1 3.45Å; Y207-A220 CarbonylContact O-C 3.38Å; Y207-A220 WeakPolarHBondContact O-CA 3.48Å; Y207-A220 WeakPolarHBondContact O-CB 3.33Å; Y207-T221 HydrophobicContact CE1-CG2 3.84Å; Y207-T221 VanDerWaalsContact CE2-CB 3.46Å; Y207-T221 HydrophobicContact CE2-CG2 4.17Å; Y207-T221 WeakPolarHBondContact CE2-OG1 3.43Å; Y207-T221 PolarHBondContact N-O 2.72Å; Y207-T221 PolarHBondContact O-N 3.34Å; Y207-T221 WeakPolarHBondContact OH-CG2 3.45Å; Y207-E263 WeakPolarHBondContact CB-O 3.27Å; Y207-N264 HydrophobicContact CD2-CB 4.19Å; Y207-N264 WeakPolarHBondContact CE2-ND2 3.36Å; Y207-P265 VanDerWaalsContact CD1-CD 3.49Å; Y207-P265 HydrophobicContact CD1-CG 3.86Å; Y207-P265 HydrophobicContact CE1-CG 3.86Å; Y207-P265 HydrophobicContact CG-CG 4.25Å; Y207-Y266 HydrophobicContact CE1-CE2 4.48Å; Y207-Y266 HydrophobicContact CE2-CE2 4.5Å; Y207-Y266 AromaticContact CZ-CE2 3.87Å; Y207-Y266 WeakPolarHBondContact OH-CE2 3.37Å
208	R	93.4	Very high	89.2	Confident	51 Å²	51	56.9 Å²	56.9	19%	0.192	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	141.3	179.3	67	-163.3	79.3	155.1	-12	111.8	V261 T262 E263	R208-V261 HydrophobicContact CB-CG2 4Å; R208-V261 PolarHBondContact NH2-O 2.93Å; R208-T262 WeakPolarHBondContact CG-O 3.41Å; R208-T262 PolarHBondContact N-O 2.78Å; R208-T262 PolarHBondContact NE-O 2.73Å; R208-E263 VanDerWaalsContact CD-OE1 3.31Å; R208-E263 WeakPolarHBondContact CD-OE1 3.13Å; R208-E263 IonicContact CZ-OE1 2.66Å; R208-E263 IonicContact NE-OE1 2.77Å; R208-E263 IonicContact NH1-OE1 2.7Å; R208-E263 PolarHBondContact NH1-OE1 3.34Å
209	N	92.1	Very high	89.3	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.277	C	S	.	.	S	Bend	trans	-95.7	11.6	178.4	-69	-38.6	0	0	0	114.2	K189 Y207 Q218 H219 T221	K189-N209 HydrophobicContact CB-CB 4.06Å; K189-N209 HydrophobicContact CD-CB 4.05Å; K189-N209 WeakPolarHBondContact CE-O 3.43Å; K189-N209 HydrophobicContact CG-CB 3.94Å; K189-N209 PolarHBondContact NZ-O 2.84Å; Y207-N209 WeakPolarHBondContact CE2-OD1 3.45Å; N209-Q218 HydrophobicContact CB-CB 4.36Å; N209-Q218 PolarHBondContact O-OE1 3.11Å; N209-H219 WeakPolarHBondContact CB-O 3.48Å; N209-H219 PolarHBondContact N-O 2.86Å; N209-H219 PolarHBondContact ND2-CD2 3.47Å; N209-H219 PolarHBondContact ND2-NE2 2.82Å; N209-H219 PolarHBondContact ND2-O 2.93Å; N209-T221 PolarHBondContact ND2-OG1 3.38Å; N209-T221 PolarHBondContact OD1-OG1 3.06Å
210	H	88.4	Confident	89.5	Confident	11 Å²	11	48.3 Å²	48.3	5%	0.051	25%	0.254	C	S	.	.	S	Bend	trans	-134.3	156.6	-178.7	66.4	-81.6	0	0	0	111.8	E215 S216 Q218 R267	H210-E215 VanDerWaalsContact C-OE2 3.28Å; H210-E215 WeakPolarHBondContact CA-OE2 3.47Å; H210-E215 HydrophobicContact CB-CB 4.11Å; H210-S216 VanDerWaalsContact CB-O 3.3Å; H210-S216 WeakPolarHBondContact CB-O 3.4Å; H210-Q218 HydrophobicContact CB-CB 4.08Å; H210-Q218 HydrophobicContact CB-CG 4.34Å; H210-Q218 PolarHBondContact ND1-N 3.3Å; H210-Q218 VanDerWaalsContact ND1-N 3.15Å; H210-Q218 PolarHBondContact ND1-O 3.5Å; H210-Q218 VanDerWaalsContact ND1-O 3.09Å; H210-R267 PolarHBondContact O-NH1 3.42Å; H210-R267 PolarHBondContact O-NH2 2.7Å
211	V	85.9	Confident	89.7	Confident	35 Å²	35	47.8 Å²	47.8	21%	0.212	25%	0.251	C	S	.	.			trans	-82.6	122.4	169.8	-175.3	0	0	0	0	108.7	L213 Q214 E215 R267	V211-L213 PolarHBondContact O-N 2.95Å; V211-Q214 HydrophobicContact CB-CB 3.97Å; V211-Q214 HydrophobicContact CG1-CB 3.76Å; V211-Q214 HydrophobicContact CG1-CG 3.82Å; V211-Q214 PolarHBondContact O-N 2.83Å; V211-E215 HydrophobicContact CB-CB 4.36Å; V211-E215 HydrophobicContact CB-CG 4.04Å; V211-E215 HydrophobicContact CG2-CG 4.13Å; V211-E215 PolarHBondContact N-OE2 2.96Å; V211-E215 PolarHBondContact O-N 3.03Å; V211-R267 VanDerWaalsContact CG2-CZ 3.5Å
212	V	82.3	Confident	89.9	Confident	71 Å²	71	49.7 Å²	49.7	43%	0.43	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	131.6	175.9	179	0	0	0	0	109.8	Q214	V212-Q214 PolarHBondContact O-N 2.73Å
213	L	79.4	Confident	90	Very high	179 Å²	179	49.3 Å²	49.3	94%	0.937	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	-2	-175.1	-56.9	171.9	0	0	0	117.4	V211	V211-L213 PolarHBondContact O-N 2.95Å
214	Q	81.8	Confident	90.2	Very high	162 Å²	162	46.2 Å²	46.2	76%	0.757	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.7	-31.3	177.4	-55.9	179.6	3.9	0	0	114	V211 V212	V211-Q214 HydrophobicContact CB-CB 3.97Å; V211-Q214 HydrophobicContact CG1-CB 3.76Å; V211-Q214 HydrophobicContact CG1-CG 3.82Å; V211-Q214 PolarHBondContact O-N 2.83Å; V212-Q214 PolarHBondContact O-N 2.73Å
215	E	85.5	Confident	90.3	Very high	84 Å²	84	46 Å²	46	39%	0.393	24%	0.24	S	C	.	.	S	Bend	trans	-115.7	156.4	177.9	-67.1	179.8	143.1	0	0	110.5	H210 V211 R267	H210-E215 VanDerWaalsContact C-OE2 3.28Å; H210-E215 WeakPolarHBondContact CA-OE2 3.47Å; H210-E215 HydrophobicContact CB-CB 4.11Å; V211-E215 HydrophobicContact CB-CB 4.36Å; V211-E215 HydrophobicContact CB-CG 4.04Å; V211-E215 HydrophobicContact CG2-CG 4.13Å; V211-E215 PolarHBondContact N-OE2 2.96Å; V211-E215 PolarHBondContact O-N 3.03Å; E215-R267 IonicContact OE2-NH2 3.81Å; E215-R267 PolarHBondContact OE2-NH2 3.45Å
216	S	84.3	Confident	90.4	Very high	92 Å²	92	43 Å²	43	64%	0.643	23%	0.225	S	C	*	.			trans	-62.5	139.9	171.4	52.3	0	0	0	0	111.2	H210 Q218	H210-S216 VanDerWaalsContact CB-O 3.3Å; H210-S216 WeakPolarHBondContact CB-O 3.4Å; S216-Q218 PolarHBondContact O-N 3.33Å; S216-Q218 PolarHBondContact O-NE2 3.13Å
217	T	85.5	Confident	90.4	Very high	76 Å²	76	43 Å²	43	47%	0.466	23%	0.225	S	C	.	.			trans	-56.9	125.3	-178.5	-42.7	0	0	0	0	110.6	V255	T217-V255 HydrophobicContact CG2-CB 3.95Å; T217-V255 WeakPolarHBondContact O-CG1 3.25Å
218	Q	88.6	Confident	90.4	Very high	34 Å²	34	43.8 Å²	43.8	16%	0.159	23%	0.229	C	C	.	.			trans	-123.7	157.8	176.8	-69	149.7	70.7	0	0	109.6	N209 H210 S216 Q257	N209-Q218 HydrophobicContact CB-CB 4.36Å; N209-Q218 PolarHBondContact O-OE1 3.11Å; H210-Q218 HydrophobicContact CB-CB 4.08Å; H210-Q218 HydrophobicContact CB-CG 4.34Å; H210-Q218 PolarHBondContact ND1-N 3.3Å; H210-Q218 VanDerWaalsContact ND1-N 3.15Å; H210-Q218 PolarHBondContact ND1-O 3.5Å; H210-Q218 VanDerWaalsContact ND1-O 3.09Å; S216-Q218 PolarHBondContact O-N 3.33Å; S216-Q218 PolarHBondContact O-NE2 3.13Å; Q218-Q257 PolarHBondContact O-NE2 3.4Å
219	H	92.4	Very high	90.4	Very high	6 Å²	6	41.3 Å²	41.3	3%	0.028	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-54.9	157.2	179.8	61.2	-80.3	0	0	0	112.9	K147 K189 R191 N209 L254	K147-H219 PolarHBondContact O-CE1 3.22Å; K189-H219 PolarHBondContact O-CE1 2.93Å; K189-H219 PolarHBondContact O-NE2 2.98Å; R191-H219 HydrophobicContact CG-CB 4.43Å; R191-H219 WeakPolarHBondContact CG-CD2 3.38Å; N209-H219 WeakPolarHBondContact CB-O 3.48Å; N209-H219 PolarHBondContact N-O 2.86Å; N209-H219 PolarHBondContact ND2-CD2 3.47Å; N209-H219 PolarHBondContact ND2-NE2 2.82Å; N209-H219 PolarHBondContact ND2-O 2.93Å; H219-L254 WeakPolarHBondContact CA-O 3.49Å; H219-L254 HydrophobicContact CB-CD1 3.8Å; H219-L254 HydrophobicContact CB-CG 4.16Å; H219-L254 WeakPolarHBondContact CB-O 3.48Å
220	A	93.9	Very high	90.2	Very high	15 Å²	15	43.5 Å²	43.5	12%	0.124	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	149.9	171.8	0	0	0	0	0	111.8	P206 Y207 P258 V261	P206-A220 HydrophobicContact CB-CB 4.16Å; Y207-A220 CarbonylContact O-C 3.38Å; Y207-A220 WeakPolarHBondContact O-CA 3.48Å; Y207-A220 WeakPolarHBondContact O-CB 3.33Å; A220-P258 HydrophobicContact CB-CG 4.36Å; A220-V261 HydrophobicContact CB-CG2 3.97Å
221	T	96.1	Very high	90.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	138.6	168.1	-47.2	0	0	0	0	110.2	P190 R191 H193 P206 Y207 N209	P190-T221 HydrophobicContact CG-CG2 3.92Å; P190-T221 WeakPolarHBondContact O-CA 3.2Å; P190-T221 WeakPolarHBondContact O-CB 3.46Å; P190-T221 WeakPolarHBondContact O-CG2 3.12Å; P190-T221 PolarHBondContact O-OG1 3.07Å; R191-T221 CarbonylContact O-C 3.45Å; H193-T221 HydrophobicContact CB-CG2 4.42Å; P206-T221 CarbonylContact C-O 3.44Å; P206-T221 WeakPolarHBondContact CA-O 3.45Å; Y207-T221 HydrophobicContact CE1-CG2 3.84Å; Y207-T221 VanDerWaalsContact CE2-CB 3.46Å; Y207-T221 HydrophobicContact CE2-CG2 4.17Å; Y207-T221 WeakPolarHBondContact CE2-OG1 3.43Å; Y207-T221 PolarHBondContact N-O 2.72Å; Y207-T221 PolarHBondContact O-N 3.34Å; Y207-T221 WeakPolarHBondContact OH-CG2 3.45Å; N209-T221 PolarHBondContact ND2-OG1 3.38Å; N209-T221 PolarHBondContact OD1-OG1 3.06Å
222	R	96.2	Very high	90.4	Very high	85 Å²	85	47.4 Å²	47.4	32%	0.321	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	125.5	164.4	-65.3	179.1	174.4	-83.4	-5.1	109.1	R191 Y192 H193 P206 I224	R191-R222 PolarHBondContact O-N 2.77Å; Y192-R222 CarbonylContact C-O 3.59Å; Y192-R222 WeakPolarHBondContact CA-O 3.31Å; Y192-R222 HydrophobicContact CD1-CB 4.07Å; Y192-R222 HydrophobicContact CE1-CB 4.21Å; H193-R222 PolarHBondContact N-O 3.22Å; P206-R222 HydrophobicContact CB-CG 4.4Å; P206-R222 HydrophobicContact CG-CG 4.28Å; R222-I224 HydrophobicContact CB-CD1 3.98Å
223	F	96.7	Very high	90.6	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127.8	174	176.2	-92.6	0	0	0	110.1	W157 P158 V161 H193 A195 Y202 R204 A225	W157-F223 HydrophobicContact CB-CZ 4.38Å; W157-F223 HydrophobicContact CD2-CE1 4.41Å; W157-F223 HydrophobicContact CD2-CZ 4.19Å; W157-F223 HydrophobicContact CE3-CE1 4.37Å; W157-F223 HydrophobicContact CG-CZ 4.09Å; P158-F223 HydrophobicContact CG-CD2 4.04Å; P158-F223 HydrophobicContact CG-CE2 3.67Å; P158-F223 HydrophobicContact CG-CZ 4.29Å; V161-F223 HydrophobicContact CG1-CE1 4.25Å; V161-F223 HydrophobicContact CG2-CB 4.21Å; V161-F223 HydrophobicContact CG2-CD1 3.58Å; V161-F223 HydrophobicContact CG2-CD2 4.08Å; V161-F223 HydrophobicContact CG2-CE1 3.92Å; V161-F223 HydrophobicContact CG2-CE2 4.41Å; V161-F223 HydrophobicContact CG2-CG 3.66Å; V161-F223 HydrophobicContact CG2-CZ 4.32Å; H193-F223 HydrophobicContact CB-CD2 3.98Å; H193-F223 AromaticContact CG-CD2 3.82Å; H193-F223 AromaticContact ND1-CD2 3.85Å; H193-F223 WeakPolarHBondContact O-CA 3.44Å; A195-F223 HydrophobicContact CB-CE2 3.94Å; A195-F223 HydrophobicContact CB-CZ 3.95Å; Y202-F223 HydrophobicContact CD1-CD1 4.17Å; Y202-F223 AromaticContact CD1-CE1 3.97Å; Y202-F223 HydrophobicContact CD1-CE1 3.97Å; Y202-F223 HydrophobicContact CE1-CD1 4.44Å; R204-F223 HydrophobicContact CB-CB 4.05Å; R204-F223 HydrophobicContact CB-CD1 4.19Å; R204-F223 PolarHBondContact N-O 3.1Å; F223-A225 HydrophobicContact CE1-CB 3.83Å; F223-A225 HydrophobicContact CZ-CB 4Å
224	I	96.9	Very high	91	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	111.3	178.8	-53.6	90.6	0	0	0	109.3	Y192 H193 F194 A195 Y201 Y202 E203 R222 L226 Y239	Y192-I224 HydrophobicContact CD1-CD1 3.93Å; Y192-I224 HydrophobicContact CE1-CD1 4.47Å; H193-I224 PolarHBondContact O-N 3.21Å; F194-I224 WeakPolarHBondContact CA-O 3.34Å; F194-I224 HydrophobicContact CD1-CB 3.89Å; F194-I224 HydrophobicContact CD1-CD1 4.47Å; F194-I224 HydrophobicContact CD1-CG2 4.45Å; F194-I224 HydrophobicContact CE1-CB 3.86Å; F194-I224 HydrophobicContact CE1-CD1 3.88Å; F194-I224 HydrophobicContact CE1-CG1 4.23Å; F194-I224 HydrophobicContact CE1-CG2 4.38Å; F194-I224 HydrophobicContact CZ-CD1 4.26Å; A195-I224 PolarHBondContact N-O 3.05Å; Y201-I224 HydrophobicContact CE2-CG2 3.85Å; Y202-I224 WeakPolarHBondContact O-CA 3.38Å; E203-I224 HydrophobicContact CG-CG1 4.37Å; R222-I224 HydrophobicContact CB-CD1 3.98Å; I224-L226 HydrophobicContact CG2-CD2 3.76Å; I224-L226 HydrophobicContact CG2-CG 4.44Å; I224-Y239 HydrophobicContact CD1-CE1 4.27Å; I224-Y239 HydrophobicContact CG1-CE1 4.23Å; I224-Y239 HydrophobicContact CG1-CE2 4.31Å; I224-Y239 HydrophobicContact CG2-CD2 4.07Å; I224-Y239 HydrophobicContact CG2-CE2 4.3Å; I224-Y239 HydrophobicContact CG2-CG 4.27Å
225	A	95.3	Very high	91.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	144.5	166.9	0	0	0	0	0	111.7	W157 A195 Y201 Y202 F223	W157-A225 HydrophobicContact CD2-CB 3.99Å; W157-A225 HydrophobicContact CH2-CB 3.97Å; W157-A225 HydrophobicContact CZ2-CB 3.21Å; A195-A225 VanDerWaalsContact O-CA 3.3Å; A195-A225 WeakPolarHBondContact O-CA 3.26Å; Y201-A225 WeakPolarHBondContact CA-O 3.31Å; Y201-A225 WeakPolarHBondContact CD2-O 3.48Å; Y202-A225 PolarHBondContact N-O 3.23Å; Y202-A225 VanDerWaalsContact N-O 3.12Å; Y202-A225 PolarHBondContact O-N 3.2Å; F223-A225 HydrophobicContact CE1-CB 3.83Å; F223-A225 HydrophobicContact CZ-CB 4Å
226	L	95.8	Very high	91.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.254	C	S	.	.			trans	-123.2	136.5	-172.2	-58.5	176.4	0	0	0	111.6	A10 C11 F194 A195 S200 Y201 I224	A10-L226 VanDerWaalsContact C-CD1 3.44Å; A10-L226 HydrophobicContact CB-CD1 3.93Å; A10-L226 VanDerWaalsContact O-CD1 3.32Å; A10-L226 WeakPolarHBondContact O-CD1 3.32Å; C11-L226 VanDerWaalsContact C-CD1 3.48Å; F194-L226 HydrophobicContact CD1-CD1 4.48Å; A195-L226 PolarHBondContact O-N 2.9Å; S200-L226 CarbonylContact O-C 3.53Å; Y201-L226 HydrophobicContact CD2-CD2 4.01Å; Y201-L226 HydrophobicContact CE2-CD2 3.9Å; I224-L226 HydrophobicContact CG2-CD2 3.76Å; I224-L226 HydrophobicContact CG2-CG 4.44Å
227	A	94.9	Very high	92.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.231	C	C	.	.			trans	-77.8	175.1	177.2	0	0	0	0	0	112.7	K199 K235 K236 Y237	K199-A227 WeakPolarHBondContact O-CB 3.5Å; A227-K235 HydrophobicContact CB-CB 3.66Å; A227-K236 PolarHBondContact N-O 2.88Å; A227-K236 VanDerWaalsContact N-O 3.16Å; A227-Y237 VanDerWaalsContact O-CA 3.28Å; A227-Y237 WeakPolarHBondContact O-CA 3.44Å; A227-Y237 WeakPolarHBondContact O-CB 3.31Å
228	N	94	Very high	92.7	Very high	16 Å²	16	41.1 Å²	41.1	9%	0.086	22%	0.216	C	C	.	.			trans	-69.3	146.1	179.3	-43	67.4	0	0	0	112.7	D13 D15 K199 G230 N231 Y237	D13-N228 HydrophobicContact CB-CB 4.17Å; D13-N228 WeakPolarHBondContact CB-ND2 3.32Å; D13-N228 CarbonylContact O-C 3.36Å; D13-N228 VanDerWaalsContact O-CA 3.23Å; D13-N228 WeakPolarHBondContact O-CA 3.44Å; D15-N228 PolarHBondContact OD2-ND2 2.91Å; K199-N228 WeakPolarHBondContact CA-OD1 3.29Å; K199-N228 WeakPolarHBondContact CB-OD1 3.47Å; K199-N228 WeakPolarHBondContact CG-OD1 3.44Å; N228-G230 PolarHBondContact O-N 2.78Å; N228-N231 WeakPolarHBondContact O-CB 3.44Å; N228-N231 PolarHBondContact O-N 3.38Å; N228-N231 PolarHBondContact O-ND2 2.94Å; N228-Y237 WeakPolarHBondContact O-CB 3.47Å
229	V	93.1	Very high	93	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	130.3	168.9	174.7	0	0	0	0	109.4	D13 V14 K17 V20 L21 N231 Y237	D13-V229 WeakPolarHBondContact O-CG2 3.16Å; D13-V229 PolarHBondContact O-N 3.4Å; V14-V229 HydrophobicContact CB-CG2 4.38Å; V14-V229 HydrophobicContact CG1-CG2 4.41Å; V14-V229 HydrophobicContact CG2-CG2 4.31Å; K17-V229 HydrophobicContact CB-CG1 4.04Å; K17-V229 HydrophobicContact CD-CG1 4.45Å; K17-V229 VanDerWaalsContact CD-O 3.28Å; K17-V229 WeakPolarHBondContact CD-O 3.43Å; K17-V229 PolarHBondContact NZ-O 2.72Å; V20-V229 HydrophobicContact CB-CG1 3.86Å; V20-V229 HydrophobicContact CG1-CG1 3.66Å; L21-V229 HydrophobicContact CB-CG1 4.38Å; L21-V229 HydrophobicContact CB-CG2 4.36Å; L21-V229 HydrophobicContact CD1-CG2 4.46Å; V229-N231 VanDerWaalsContact C-N 3.3Å; V229-N231 PolarHBondContact O-N 3.44Å; V229-Y237 HydrophobicContact CB-CD2 4.31Å; V229-Y237 HydrophobicContact CG1-CE2 4.37Å; V229-Y237 HydrophobicContact CG2-CD2 3.76Å; V229-Y237 HydrophobicContact CG2-CE2 4.19Å; V229-Y237 HydrophobicContact CG2-CG 4.4Å
230	G	87.4	Confident	93.1	Very high	46 Å²	46	43.7 Å²	43.7	47%	0.474	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	30.1	178.6	0	0	0	0	0	114.6	N228	N228-G230 PolarHBondContact O-N 2.78Å
231	N	89.5	Confident	93.1	Very high	28 Å²	28	43.7 Å²	43.7	15%	0.15	23%	0.234	C	C	.	.			trans	-63.9	144.8	171.4	70.5	83.4	0	0	0	111.8	N228 V229 E233 K234 K235	N228-N231 WeakPolarHBondContact O-CB 3.44Å; N228-N231 PolarHBondContact O-N 3.38Å; N228-N231 PolarHBondContact O-ND2 2.94Å; V229-N231 VanDerWaalsContact C-N 3.3Å; V229-N231 PolarHBondContact O-N 3.44Å; N231-E233 VanDerWaalsContact C-N 3.3Å; N231-E233 PolarHBondContact O-N 3.23Å; N231-E233 PolarHBondContact OD1-N 3.24Å; N231-K234 PolarHBondContact O-N 3.06Å; N231-K234 WeakPolarHBondContact OD1-CA 3.44Å; N231-K234 PolarHBondContact OD1-N 3.21Å; N231-K235 PolarHBondContact ND2-O 2.85Å; N231-K235 PolarHBondContact OD1-N 2.93Å
232	A	88.5	Confident	93	Very high	100 Å²	100	46.4 Å²	46.4	83%	0.826	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-33.1	-174	0	0	0	0	0	113.4	K234	A232-K234 PolarHBondContact O-N 3.4Å
233	E	86.9	Confident	92.7	Very high	126 Å²	126	42.5 Å²	42.5	59%	0.589	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-6.6	-177.5	-59.7	177.9	-103.9	0	0	113.6	N231 K235	N231-E233 VanDerWaalsContact C-N 3.3Å; N231-E233 PolarHBondContact O-N 3.23Å; N231-E233 PolarHBondContact OD1-N 3.24Å; E233-K235 HydrophobicContact CB-CD 4.21Å; E233-K235 HydrophobicContact CB-CG 4.07Å; E233-K235 PolarHBondContact O-N 2.97Å; E233-K235 IonicContact OE1-NZ 2.67Å; E233-K235 PolarHBondContact OE1-NZ 3.13Å; E233-K235 WeakPolarHBondContact OE2-CE 3.44Å; E233-K235 IonicContact OE2-NZ 2.7Å; E233-K235 PolarHBondContact OE2-NZ 2.8Å
234	K	88.6	Confident	92.5	Very high	189 Å²	189	44.7 Å²	44.7	82%	0.822	25%	0.252	S	S	*	.			trans	59.6	23.8	-176.5	-53.7	168.2	-173.2	168.6	0	113.4	N231 A232	N231-K234 PolarHBondContact O-N 3.06Å; N231-K234 WeakPolarHBondContact OD1-CA 3.44Å; N231-K234 PolarHBondContact OD1-N 3.21Å; A232-K234 PolarHBondContact O-N 3.4Å
235	K	90.8	Very high	92.2	Very high	40 Å²	40	44.8 Å²	44.8	17%	0.174	25%	0.253	C	S	.	.			trans	-53.5	141.4	168.1	-73.4	168.8	170.9	158.1	0	109.3	E170 A227 N231 E233 Y237	E170-K235 IonicContact OE1-NZ 2.82Å; E170-K235 PolarHBondContact OE1-NZ 3.29Å; E170-K235 WeakPolarHBondContact OE2-CE 3.43Å; E170-K235 IonicContact OE2-NZ 3.48Å; E170-K235 PolarHBondContact OE2-NZ 2.89Å; A227-K235 HydrophobicContact CB-CB 3.66Å; N231-K235 PolarHBondContact ND2-O 2.85Å; N231-K235 PolarHBondContact OD1-N 2.93Å; E233-K235 HydrophobicContact CB-CD 4.21Å; E233-K235 HydrophobicContact CB-CG 4.07Å; E233-K235 PolarHBondContact O-N 2.97Å; E233-K235 IonicContact OE1-NZ 2.67Å; E233-K235 PolarHBondContact OE1-NZ 3.13Å; E233-K235 WeakPolarHBondContact OE2-CE 3.44Å; E233-K235 IonicContact OE2-NZ 2.7Å; E233-K235 PolarHBondContact OE2-NZ 2.8Å; K235-Y237 PolarHBondContact O-N 3.5Å
236	K	92.6	Very high	91.8	Very high	108 Å²	108	45.8 Å²	45.8	47%	0.47	26%	0.257	S	S	.	.			trans	-63.7	118.2	-177.7	-67.9	173.1	-175	176.2	0	110.2	Y201 E203 A227	Y201-K236 HydrophobicContact CD1-CB 4.38Å; Y201-K236 HydrophobicContact CD1-CD 4.13Å; Y201-K236 HydrophobicContact CD2-CB 3.56Å; Y201-K236 HydrophobicContact CD2-CD 4.21Å; Y201-K236 WeakPolarHBondContact CD2-O 3.21Å; Y201-K236 HydrophobicContact CE1-CD 3.61Å; Y201-K236 HydrophobicContact CE2-CB 3.77Å; Y201-K236 HydrophobicContact CE2-CD 3.71Å; Y201-K236 HydrophobicContact CE2-CG 4.44Å; Y201-K236 HydrophobicContact CG-CB 3.85Å; Y201-K236 HydrophobicContact CG-CD 4.36Å; Y201-K236 WeakPolarHBondContact OH-CD 3.39Å; Y201-K236 PolarHBondContact OH-NZ 2.85Å; E203-K236 IonicContact OE2-NZ 3.67Å; A227-K236 PolarHBondContact N-O 2.88Å; A227-K236 VanDerWaalsContact N-O 3.16Å
237	Y	93.9	Very high	91.3	Very high	42 Å²	42	51.9 Å²	51.9	17%	0.165	28%	0.284	C	S	.	.			trans	-104.9	-10.7	175.8	61.6	-98.4	0	0	0	113.8	C11 G12 R24 A227 N228 V229 K235	C11-Y237 WeakPolarHBondContact CA-O 3.29Å; G12-Y237 PolarHBondContact N-O 2.73Å; R24-Y237 HydrophobicContact CG-CE2 4.45Å; R24-Y237 WeakPolarHBondContact CG-OH 3.41Å; A227-Y237 VanDerWaalsContact O-CA 3.28Å; A227-Y237 WeakPolarHBondContact O-CA 3.44Å; A227-Y237 WeakPolarHBondContact O-CB 3.31Å; N228-Y237 WeakPolarHBondContact O-CB 3.47Å; V229-Y237 HydrophobicContact CB-CD2 4.31Å; V229-Y237 HydrophobicContact CG1-CE2 4.37Å; V229-Y237 HydrophobicContact CG2-CD2 3.76Å; V229-Y237 HydrophobicContact CG2-CE2 4.19Å; V229-Y237 HydrophobicContact CG2-CG 4.4Å; K235-Y237 PolarHBondContact O-N 3.5Å
238	L	94.4	Very high	90.9	Very high	28 Å²	28	55.8 Å²	55.8	15%	0.147	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	128.9	-175	-169.1	73.7	0	0	0	109.2	L9 A10 C11 L21 R24 V25 I28 L38	L9-L238 HydrophobicContact CB-CD1 4.37Å; A10-L238 CarbonylContact O-C 3.55Å; A10-L238 WeakPolarHBondContact O-CA 3.38Å; C11-L238 HydrophobicContact CB-CD1 3.77Å; L21-L238 HydrophobicContact CD1-CD1 4.07Å; R24-L238 HydrophobicContact CG-CD2 4.06Å; V25-L238 HydrophobicContact CG2-CD2 4.39Å; I28-L238 HydrophobicContact CD1-CD2 3.44Å; I28-L238 VanDerWaalsContact CD1-CD2 3.44Å; L38-L238 HydrophobicContact CD1-CD1 3.87Å
239	Y	96	Very high	90.5	Very high	36 Å²	36	57.2 Å²	57.2	14%	0.141	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.3	-176.9	-170.7	-99.2	0	0	0	110	L9 A10 F194 E203 I224 F241	L9-Y239 CarbonylContact C-O 3.5Å; L9-Y239 WeakPolarHBondContact CA-O 3.31Å; A10-Y239 PolarHBondContact N-O 3.13Å; A10-Y239 PolarHBondContact O-N 3Å; F194-Y239 AromaticContact CE1-CD1 3.78Å; F194-Y239 HydrophobicContact CE1-CD1 3.78Å; F194-Y239 HydrophobicContact CE1-CE1 4.29Å; F194-Y239 HydrophobicContact CE1-CG 4.43Å; F194-Y239 HydrophobicContact CZ-CD1 4.13Å; F194-Y239 HydrophobicContact CZ-CE1 4.45Å; E203-Y239 VanDerWaalsContact OE1-CE2 3.24Å; E203-Y239 WeakPolarHBondContact OE1-CE2 3.27Å; E203-Y239 PolarHBondContact OE1-OH 3.14Å; I224-Y239 HydrophobicContact CD1-CE1 4.27Å; I224-Y239 HydrophobicContact CG1-CE1 4.23Å; I224-Y239 HydrophobicContact CG1-CE2 4.31Å; I224-Y239 HydrophobicContact CG2-CD2 4.07Å; I224-Y239 HydrophobicContact CG2-CE2 4.3Å; I224-Y239 HydrophobicContact CG2-CG 4.27Å; Y239-F241 HydrophobicContact CD1-CB 4.12Å; Y239-F241 AromaticContact CD1-CD1 3.95Å; Y239-F241 HydrophobicContact CD1-CD1 3.95Å; Y239-F241 HydrophobicContact CD1-CG 4.32Å; Y239-F241 HydrophobicContact CE1-CB 3.83Å; Y239-F241 HydrophobicContact CE1-CD1 4.35Å; Y239-F241 HydrophobicContact CE1-CG 4.27Å
240	A	94.1	Very high	90.1	Very high	58 Å²	58	60.2 Å²	60.2	48%	0.479	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.4	-179.5	0	0	0	0	0	109.5	L9 F35	L9-A240 HydrophobicContact CD2-CB 3.57Å; F35-A240 HydrophobicContact CE1-CB 3.86Å; F35-A240 HydrophobicContact CZ-CB 3.99Å
241	F	94.1	Very high	89.9	Confident	14 Å²	14	61.4 Å²	61.4	6%	0.061	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	168.5	-177.3	70.9	-72.4	0	0	0	112	L8 A10 I151 Y192 F194 Y239 I243	L8-F241 HydrophobicContact CB-CD1 4.01Å; L8-F241 HydrophobicContact CB-CE1 3.49Å; L8-F241 VanDerWaalsContact CB-CE1 3.49Å; L8-F241 HydrophobicContact CB-CE2 4.22Å; L8-F241 HydrophobicContact CB-CZ 3.6Å; L8-F241 HydrophobicContact CD1-CE1 4.34Å; L8-F241 HydrophobicContact CD1-CE2 3.81Å; L8-F241 HydrophobicContact CD1-CZ 3.57Å; L8-F241 HydrophobicContact CG-CZ 4.23Å; L8-F241 PolarHBondContact N-O 2.86Å; L8-F241 WeakPolarHBondContact O-CD1 3.28Å; L8-F241 PolarHBondContact O-N 3.49Å; A10-F241 HydrophobicContact CB-CE1 4.33Å; I151-F241 HydrophobicContact CD1-CE2 4.3Å; I151-F241 HydrophobicContact CD1-CZ 3.99Å; Y192-F241 HydrophobicContact CD1-CD2 4.19Å; Y192-F241 HydrophobicContact CD1-CE2 4.22Å; Y192-F241 HydrophobicContact CD2-CD2 4.45Å; Y192-F241 HydrophobicContact CD2-CE2 4.14Å; Y192-F241 AromaticContact CE1-CD2 3.88Å; Y192-F241 HydrophobicContact CE1-CD2 3.88Å; Y192-F241 HydrophobicContact CE1-CE2 4.34Å; Y192-F241 HydrophobicContact CE1-CG 4.46Å; Y192-F241 HydrophobicContact CE2-CD2 4.16Å; Y192-F241 HydrophobicContact CE2-CE2 4.27Å; Y192-F241 HydrophobicContact CG-CD2 4.46Å; Y192-F241 HydrophobicContact CG-CE2 4.11Å; Y192-F241 AromaticContact CZ-CD2 3.86Å; F194-F241 HydrophobicContact CE1-CE1 4.41Å; F194-F241 AromaticContact CE2-CE1 3.68Å; F194-F241 HydrophobicContact CE2-CE1 3.68Å; F194-F241 HydrophobicContact CE2-CE2 4.2Å; F194-F241 AromaticContact CE2-CZ 3.47Å; F194-F241 HydrophobicContact CE2-CZ 3.47Å; F194-F241 VanDerWaalsContact CE2-CZ 3.47Å; F194-F241 AromaticContact CZ-CD1 3.87Å; F194-F241 HydrophobicContact CZ-CD1 3.87Å; F194-F241 AromaticContact CZ-CE1 3.4Å; F194-F241 HydrophobicContact CZ-CE1 3.4Å; F194-F241 VanDerWaalsContact CZ-CE1 3.4Å; F194-F241 HydrophobicContact CZ-CE2 4.21Å; F194-F241 HydrophobicContact CZ-CG 4.45Å; F194-F241 AromaticContact CZ-CZ 3.6Å; F194-F241 HydrophobicContact CZ-CZ 3.6Å; Y239-F241 HydrophobicContact CD1-CB 4.12Å; Y239-F241 AromaticContact CD1-CD1 3.95Å; Y239-F241 HydrophobicContact CD1-CD1 3.95Å; Y239-F241 HydrophobicContact CD1-CG 4.32Å; Y239-F241 HydrophobicContact CE1-CB 3.83Å; Y239-F241 HydrophobicContact CE1-CD1 4.35Å; Y239-F241 HydrophobicContact CE1-CG 4.27Å; F241-I243 HydrophobicContact CD2-CB 4.49Å; F241-I243 HydrophobicContact CE2-CB 4.31Å; F241-I243 HydrophobicContact CE2-CG2 4.4Å
242	S	92.9	Very high	89.7	Confident	58 Å²	58	63.3 Å²	63.3	41%	0.406	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143	174.5	-56.9	0	0	0	0	110.9	L6	L6-S242 CarbonylContact O-C 3.44Å; L6-S242 WeakPolarHBondContact O-CA 3.39Å; L6-S242 WeakPolarHBondContact O-CB 3.31Å
243	I	91.6	Very high	89.6	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.015	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	136.7	-175.5	-165.4	170.6	0	0	0	111.3	L6 L8 L108 D150 I151 Y192 F241	L6-I243 HydrophobicContact CB-CG2 4.17Å; L6-I243 PolarHBondContact N-O 2.67Å; L6-I243 PolarHBondContact O-N 2.59Å; L8-I243 HydrophobicContact CD1-CG2 3.48Å; L8-I243 VanDerWaalsContact CD1-CG2 3.48Å; L8-I243 HydrophobicContact CG-CG2 4.33Å; L108-I243 HydrophobicContact CD1-CD1 4.16Å; L108-I243 HydrophobicContact CD1-CG2 3.84Å; D150-I243 HydrophobicContact CB-CD1 3.93Å; I151-I243 HydrophobicContact CG1-CD1 4.24Å; Y192-I243 HydrophobicContact CD2-CD1 3.72Å; Y192-I243 HydrophobicContact CE2-CD1 3.88Å; Y192-I243 HydrophobicContact CE2-CG1 4.28Å; F241-I243 HydrophobicContact CD2-CB 4.49Å; F241-I243 HydrophobicContact CE2-CB 4.31Å; F241-I243 HydrophobicContact CE2-CG2 4.4Å
244	V	91.3	Very high	89.6	Confident	45 Å²	45	58.1 Å²	58.1	27%	0.273	32%	0.32	S	S	.	.			trans	-98.4	124.6	162.3	-179.4	0	0	0	0	106.9	P5 R191 L248 M249	P5-V244 HydrophobicContact CB-CG2 3.87Å; R191-V244 PolarHBondContact NH1-O 3.48Å; V244-L248 HydrophobicContact CG1-CB 4.17Å; V244-M249 HydrophobicContact CB-CG 4.06Å; V244-M249 HydrophobicContact CG1-CG 3.84Å
245	P	90.6	Very high	89.6	Confident	4 Å²	4	51.6 Å²	51.6	3%	0.026	30%	0.296	C	S	.	.			trans	-55.6	144.5	-179.6	-32	39.4	0	0	0	114.6	L6 L108 D150 K247 L248 M249	L6-P245 HydrophobicContact CD1-CG 3.81Å; L108-P245 HydrophobicContact CB-CG 3.89Å; L108-P245 HydrophobicContact CD1-CG 4.18Å; D150-P245 WeakPolarHBondContact OD1-CA 3.31Å; D150-P245 WeakPolarHBondContact OD2-CA 3.47Å; P245-K247 PolarHBondContact O-N 3.4Å; P245-K247 VanDerWaalsContact O-N 3.13Å; P245-L248 HydrophobicContact CB-CD1 4.28Å; P245-L248 HydrophobicContact CB-CG 4.45Å; P245-L248 HydrophobicContact CG-CD1 4.25Å; P245-L248 PolarHBondContact O-N 2.86Å; P245-M249 PolarHBondContact O-N 2.83Å
246	M	88	Confident	89.5	Confident	21 Å²	21	55.4 Å²	55.4	10%	0.103	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-55.8	-33.4	-176.7	-83.3	174.9	77.5	0	0	113.9	K147 V149 D150 R191 L248 M249 L254	K147-M246 HydrophobicContact CB-CE 4.17Å; V149-M246 VanDerWaalsContact O-SD 3.41Å; D150-M246 VanDerWaalsContact CG-N 3.34Å; D150-M246 WeakPolarHBondContact OD1-CG 3.11Å; D150-M246 PolarHBondContact OD1-N 3.43Å; D150-M246 PolarHBondContact OD2-N 2.79Å; R191-M246 VanDerWaalsContact CD-SD 3.52Å; R191-M246 HydrophobicContact CG-CG 4.29Å; R191-M246 HydrophobicContact CG-SD 3.88Å; M246-L248 PolarHBondContact O-N 3.43Å; M246-M249 PolarHBondContact O-N 2.82Å; M246-L254 HydrophobicContact CE-CD1 4.22Å; M246-L254 HydrophobicContact CE-CD2 4.05Å; M246-L254 HydrophobicContact CG-CD1 3.87Å
247	K	85.3	Confident	89.2	Confident	128 Å²	128	53.2 Å²	53.2	56%	0.557	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-67.1	-22	177.3	-68	178.5	178.9	169.3	0	113.5	P245	P245-K247 PolarHBondContact O-N 3.4Å; P245-K247 VanDerWaalsContact O-N 3.13Å
248	L	85.2	Confident	88.9	Confident	81 Å²	81	52.3 Å²	52.3	42%	0.424	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-105.9	-3.5	-175.6	-56.8	175.7	0	0	0	112.5	S106 V244 P245 M246	S106-L248 WeakPolarHBondContact O-CD1 3.38Å; V244-L248 HydrophobicContact CG1-CB 4.17Å; P245-L248 HydrophobicContact CB-CD1 4.28Å; P245-L248 HydrophobicContact CB-CG 4.45Å; P245-L248 HydrophobicContact CG-CD1 4.25Å; P245-L248 PolarHBondContact O-N 2.86Å; M246-L248 PolarHBondContact O-N 3.43Å
249	M	85.5	Confident	88.3	Confident	46 Å²	46	57.7 Å²	57.7	23%	0.227	34%	0.34	C	S	.	.	S	Bend	trans	-88.8	135.9	177.2	-71.5	-170.9	69.6	0	0	112.3	R191 V244 P245 M246 E253 L254	R191-M249 PolarHBondContact NH2-SD 2.86Å; V244-M249 HydrophobicContact CB-CG 4.06Å; V244-M249 HydrophobicContact CG1-CG 3.84Å; P245-M249 PolarHBondContact O-N 2.83Å; M246-M249 PolarHBondContact O-N 2.82Å; M249-E253 HydrophobicContact CE-CB 3.88Å; M249-L254 HydrophobicContact CB-CB 4.42Å; M249-L254 HydrophobicContact CE-CB 4.47Å; M249-L254 HydrophobicContact SD-CD1 4.2Å
250	A	85.4	Confident	88	Confident	64 Å²	64	59.1 Å²	59.1	53%	0.529	35%	0.35	S	S	.	.			trans	-60	138.9	166.4	0	0	0	0	0	110.6	A252 E253 L254	A250-A252 VanDerWaalsContact C-N 3.25Å; A250-A252 PolarHBondContact O-N 2.87Å; A250-E253 HydrophobicContact CB-CG 4.32Å; A250-E253 WeakPolarHBondContact O-CB 3.46Å; A250-E253 PolarHBondContact O-N 2.76Å; A250-L254 PolarHBondContact O-N 3.02Å
251	A	83.9	Confident	87.8	Confident	70 Å²	70	57.5 Å²	57.5	58%	0.579	33%	0.334	S	S	*	.	H	α-helix	trans	-56.5	-38.5	-175.2	0	0	0	0	0	113	E253 L254 V255	A251-E253 VanDerWaalsContact C-N 3.34Å; A251-E253 PolarHBondContact O-N 3.31Å; A251-L254 PolarHBondContact O-N 3.12Å; A251-V255 WeakPolarHBondContact O-CG1 3.38Å; A251-V255 WeakPolarHBondContact O-CG2 3.42Å; A251-V255 PolarHBondContact O-N 3.38Å
252	A	84.7	Confident	87.7	Confident	69 Å²	69	57.6 Å²	57.6	57%	0.57	34%	0.336	S	S	*	.	H	α-helix	trans	-64	-34.2	176.9	0	0	0	0	0	113.4	A250 K256	A250-A252 VanDerWaalsContact C-N 3.25Å; A250-A252 PolarHBondContact O-N 2.87Å; A252-K256 WeakPolarHBondContact O-CG 3.45Å
253	E	86.1	Confident	87.6	Confident	97 Å²	97	57.5 Å²	57.5	45%	0.453	33%	0.329	S	S	.	.	H	α-helix	trans	-74.3	-39.6	174.8	-65.7	-57.1	129.3	0	0	111.5	M249 A250 A251 V255 K256	M249-E253 HydrophobicContact CE-CB 3.88Å; A250-E253 HydrophobicContact CB-CG 4.32Å; A250-E253 WeakPolarHBondContact O-CB 3.46Å; A250-E253 PolarHBondContact O-N 2.76Å; A251-E253 VanDerWaalsContact C-N 3.34Å; A251-E253 PolarHBondContact O-N 3.31Å; E253-V255 VanDerWaalsContact C-N 3.32Å; E253-V255 PolarHBondContact O-N 3.05Å; E253-K256 WeakPolarHBondContact O-CB 3.4Å; E253-K256 PolarHBondContact O-N 3.41Å; E253-K256 VanDerWaalsContact OE1-CE 3.27Å; E253-K256 WeakPolarHBondContact OE1-CE 3.45Å; E253-K256 IonicContact OE1-NZ 2.72Å; E253-K256 PolarHBondContact OE1-NZ 2.89Å; E253-K256 VanDerWaalsContact OE2-CE 3.31Å; E253-K256 WeakPolarHBondContact OE2-CE 3.09Å; E253-K256 IonicContact OE2-NZ 3.52Å; E253-K256 PolarHBondContact OE2-NZ 2.8Å
254	L	86.1	Confident	87.6	Confident	20 Å²	20	57.8 Å²	57.8	11%	0.105	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-36.7	-178.5	-178.7	59.5	0	0	0	112.3	H219 M246 M249 A250 A251 K256	H219-L254 WeakPolarHBondContact CA-O 3.49Å; H219-L254 HydrophobicContact CB-CD1 3.8Å; H219-L254 HydrophobicContact CB-CG 4.16Å; H219-L254 WeakPolarHBondContact CB-O 3.48Å; M246-L254 HydrophobicContact CE-CD1 4.22Å; M246-L254 HydrophobicContact CE-CD2 4.05Å; M246-L254 HydrophobicContact CG-CD1 3.87Å; M249-L254 HydrophobicContact CB-CB 4.42Å; M249-L254 HydrophobicContact CE-CB 4.47Å; M249-L254 HydrophobicContact SD-CD1 4.2Å; A250-L254 PolarHBondContact O-N 3.02Å; A251-L254 PolarHBondContact O-N 3.12Å; L254-K256 VanDerWaalsContact C-N 3.34Å
255	V	90.1	Very high	87.5	Confident	51 Å²	51	55.7 Å²	55.7	31%	0.309	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-1.8	-179.1	-56.7	0	0	0	0	114.4	T217 A251 E253 Q257	T217-V255 HydrophobicContact CG2-CB 3.95Å; T217-V255 WeakPolarHBondContact O-CG1 3.25Å; A251-V255 WeakPolarHBondContact O-CG1 3.38Å; A251-V255 WeakPolarHBondContact O-CG2 3.42Å; A251-V255 PolarHBondContact O-N 3.38Å; E253-V255 VanDerWaalsContact C-N 3.32Å; E253-V255 PolarHBondContact O-N 3.05Å; V255-Q257 PolarHBondContact O-N 3.11Å; V255-Q257 PolarHBondContact O-NE2 3.47Å
256	K	87.4	Confident	87.5	Confident	121 Å²	121	57 Å²	57	53%	0.526	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-61.2	127.3	177.3	-74.6	-177.4	-178.3	170.6	0	110.9	A252 E253 L254	A252-K256 WeakPolarHBondContact O-CG 3.45Å; E253-K256 WeakPolarHBondContact O-CB 3.4Å; E253-K256 PolarHBondContact O-N 3.41Å; E253-K256 VanDerWaalsContact OE1-CE 3.27Å; E253-K256 WeakPolarHBondContact OE1-CE 3.45Å; E253-K256 IonicContact OE1-NZ 2.72Å; E253-K256 PolarHBondContact OE1-NZ 2.89Å; E253-K256 VanDerWaalsContact OE2-CE 3.31Å; E253-K256 WeakPolarHBondContact OE2-CE 3.09Å; E253-K256 IonicContact OE2-NZ 3.52Å; E253-K256 PolarHBondContact OE2-NZ 2.8Å; L254-K256 VanDerWaalsContact C-N 3.34Å
257	Q	85.9	Confident	87.2	Confident	62 Å²	62	59.2 Å²	59.2	29%	0.29	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-91.5	135.2	176.9	-59.8	-53	-68.3	0	0	110.5	Q218 V255 V261	Q218-Q257 PolarHBondContact O-NE2 3.4Å; V255-Q257 PolarHBondContact O-N 3.11Å; V255-Q257 PolarHBondContact O-NE2 3.47Å; Q257-V261 HydrophobicContact CB-CG1 3.96Å; Q257-V261 HydrophobicContact CG-CG1 4.47Å
258	P	88.6	Confident	86	Confident	22 Å²	22	60.9 Å²	60.9	14%	0.143	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-59.8	149	164	-24.6	36.7	0	0	0	111.6	P206 A220 D260 V261	P206-P258 HydrophobicContact CB-CB 4.3Å; P206-P258 HydrophobicContact CB-CG 3.89Å; P206-P258 HydrophobicContact CG-CB 3.89Å; P206-P258 HydrophobicContact CG-CG 3.81Å; A220-P258 HydrophobicContact CB-CG 4.36Å; P258-D260 WeakPolarHBondContact CB-OD1 3.49Å; P258-D260 PolarHBondContact O-N 2.95Å; P258-V261 WeakPolarHBondContact O-CB 3.27Å; P258-V261 WeakPolarHBondContact O-CG1 3.5Å; P258-V261 PolarHBondContact O-N 3.25Å
259	P	82.1	Confident	84	Confident	142 Å²	142	61.4 Å²	61.4	92%	0.922	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.1	-178.7	29.5	-36.1	0	0	0	113
260	D	88.6	Confident	81.8	Confident	65 Å²	65	62.8 Å²	62.8	35%	0.348	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	13	-179.9	60.3	-38.7	0	0	0	113.5	L205 P206 P258 T262	L205-D260 HydrophobicContact CD2-CB 4.27Å; P206-D260 WeakPolarHBondContact CD-OD2 3.36Å; P258-D260 WeakPolarHBondContact CB-OD1 3.49Å; P258-D260 PolarHBondContact O-N 2.95Å; D260-T262 PolarHBondContact O-N 3.46Å
261	V	90.5	Very high	79.3	Confident	25 Å²	25	68.6 Å²	68.6	15%	0.152	39%	0.389	C	S	.	.			trans	-69.6	125.6	-173.3	76	0	0	0	0	113.3	P206 R208 A220 Q257 P258	P206-V261 HydrophobicContact CB-CG2 4.32Å; P206-V261 WeakPolarHBondContact O-CA 3.38Å; R208-V261 HydrophobicContact CB-CG2 4Å; R208-V261 PolarHBondContact NH2-O 2.93Å; A220-V261 HydrophobicContact CB-CG2 3.97Å; Q257-V261 HydrophobicContact CB-CG1 3.96Å; Q257-V261 HydrophobicContact CG-CG1 4.47Å; P258-V261 WeakPolarHBondContact O-CB 3.27Å; P258-V261 WeakPolarHBondContact O-CG1 3.5Å; P258-V261 PolarHBondContact O-N 3.25Å
262	T	92	Very high	76.8	Confident	16 Å²	16	69.4 Å²	69.4	10%	0.098	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-91.2	174.4	177.9	79.6	0	0	0	0	111.9	F164 R204 L205 P206 R208 D260	F164-T262 VanDerWaalsContact O-CB 3.32Å; F164-T262 WeakPolarHBondContact O-CB 3.4Å; F164-T262 WeakPolarHBondContact O-CG2 3.35Å; R204-T262 VanDerWaalsContact CZ-OG1 3.32Å; R204-T262 PolarHBondContact NH1-OG1 2.84Å; R204-T262 PolarHBondContact NH2-OG1 2.7Å; L205-T262 HydrophobicContact CB-CG2 3.8Å; L205-T262 HydrophobicContact CD1-CG2 4.07Å; P206-T262 PolarHBondContact O-N 2.66Å; P206-T262 PolarHBondContact O-OG1 2.8Å; R208-T262 WeakPolarHBondContact CG-O 3.41Å; R208-T262 PolarHBondContact N-O 2.78Å; R208-T262 PolarHBondContact NE-O 2.73Å; D260-T262 PolarHBondContact O-N 3.46Å
263	E	90.4	Very high	74.4	Confident	55 Å²	55	71 Å²	71	26%	0.257	41%	0.409	S	S	.	.			trans	-65.2	161.9	159.6	-85.8	-57.2	143.8	0	0	112.2	F164 R204 Y207 R208 R267	F164-E263 HydrophobicContact CB-CB 4.47Å; F164-E263 HydrophobicContact CD2-CB 4.04Å; F164-E263 HydrophobicContact CG-CB 4.19Å; R204-E263 PolarHBondContact NH2-O 2.88Å; Y207-E263 WeakPolarHBondContact CB-O 3.27Å; R208-E263 VanDerWaalsContact CD-OE1 3.31Å; R208-E263 WeakPolarHBondContact CD-OE1 3.13Å; R208-E263 IonicContact CZ-OE1 2.66Å; R208-E263 IonicContact NE-OE1 2.77Å; R208-E263 IonicContact NH1-OE1 2.7Å; R208-E263 PolarHBondContact NH1-OE1 3.34Å; E263-R267 IonicContact OE2-CZ 3.26Å; E263-R267 IonicContact OE2-NH1 3.62Å; E263-R267 PolarHBondContact OE2-NH1 3.01Å
264	N	91.8	Very high	71.8	Confident	9 Å²	9	69.6 Å²	69.6	5%	0.048	41%	0.414	C	S	.	.			trans	-68.3	124.5	179.5	-170.9	-57.2	0	0	0	111.2	Y207 Y266 R267	Y207-N264 HydrophobicContact CD2-CB 4.19Å; Y207-N264 WeakPolarHBondContact CE2-ND2 3.36Å; N264-Y266 PolarHBondContact O-N 2.91Å; N264-Y266 PolarHBondContact OD1-N 3.08Å; N264-R267 HydrophobicContact CB-CG 4.04Å; N264-R267 PolarHBondContact O-N 2.91Å
265	P	90	Very high	68.9	Low	1 Å²	1	77.5 Å²	77.5	1%	0.006	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.7	-175.4	24.3	-33.5	0	0	0	114.4	Y160 V161 N163 Y207	Y160-P265 WeakPolarHBondContact O-CB 3.39Å; V161-P265 WeakPolarHBondContact O-CB 3.26Å; N163-P265 HydrophobicContact CB-CB 3.97Å; N163-P265 WeakPolarHBondContact CB-O 3.39Å; N163-P265 PolarHBondContact ND2-O 3.36Å; N163-P265 VanDerWaalsContact ND2-O 3.12Å; Y207-P265 VanDerWaalsContact CD1-CD 3.49Å; Y207-P265 HydrophobicContact CD1-CG 3.86Å; Y207-P265 HydrophobicContact CE1-CG 3.86Å; Y207-P265 HydrophobicContact CG-CG 4.25Å
266	Y	90.1	Very high	65.9	Low	32 Å²	32	78.6 Å²	78.6	13%	0.125	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	3.3	-175	-39.2	-50.4	0	0	0	113.4	P158 V161 S182 A185 A186 Y207 N264 E268	P158-Y266 HydrophobicContact CB-CE1 3.71Å; P158-Y266 VanDerWaalsContact CB-OH 3.31Å; P158-Y266 WeakPolarHBondContact CB-OH 3.32Å; P158-Y266 HydrophobicContact CG-CE1 4.32Å; P158-Y266 WeakPolarHBondContact CG-OH 3.35Å; V161-Y266 HydrophobicContact CB-CE1 4.26Å; S182-Y266 WeakPolarHBondContact O-CD2 3.28Å; A185-Y266 HydrophobicContact CB-CD2 4.31Å; A185-Y266 HydrophobicContact CB-CE2 3.58Å; A186-Y266 HydrophobicContact CB-CD2 3.98Å; A186-Y266 HydrophobicContact CB-CG 4.47Å; Y207-Y266 HydrophobicContact CE1-CE2 4.48Å; Y207-Y266 HydrophobicContact CE2-CE2 4.5Å; Y207-Y266 AromaticContact CZ-CE2 3.87Å; Y207-Y266 WeakPolarHBondContact OH-CE2 3.37Å; N264-Y266 PolarHBondContact O-N 2.91Å; N264-Y266 PolarHBondContact OD1-N 3.08Å; Y266-E268 PolarHBondContact O-N 3.44Å
267	R	80.8	Confident	63.1	Low	67 Å²	67	82.7 Å²	82.7	25%	0.253	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-70.8	124.3	169.5	-83.8	178.5	171.2	149	3.9	109.7	H210 V211 E215 E263 N264 S269	H210-R267 PolarHBondContact O-NH1 3.42Å; H210-R267 PolarHBondContact O-NH2 2.7Å; V211-R267 VanDerWaalsContact CG2-CZ 3.5Å; E215-R267 IonicContact OE2-NH2 3.81Å; E215-R267 PolarHBondContact OE2-NH2 3.45Å; E263-R267 IonicContact OE2-CZ 3.26Å; E263-R267 IonicContact OE2-NH1 3.62Å; E263-R267 PolarHBondContact OE2-NH1 3.01Å; N264-R267 HydrophobicContact CB-CG 4.04Å; N264-R267 PolarHBondContact O-N 2.91Å; R267-S269 PolarHBondContact O-N 2.92Å
268	E	61.5	Low	60.1	Low	164 Å²	164	88.5 Å²	88.5	77%	0.766	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-62.8	126	165	-64.2	-167.9	165.5	0	0	109.3	Y266 G270	Y266-E268 PolarHBondContact O-N 3.44Å; E268-G270 PolarHBondContact O-N 2.82Å
269	S	43.4	Very low	57.1	Low	92 Å²	92	93.2 Å²	93.2	64%	0.643	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-63.5	121.3	168.8	54.1	0	0	0	0	108.6	R267 K271	R267-S269 PolarHBondContact O-N 2.92Å; S269-K271 VanDerWaalsContact C-N 3.3Å; S269-K271 PolarHBondContact O-N 2.85Å
270	G	38.2	Very low	54.5	Low	75 Å²	75	91.9 Å²	91.9	77%	0.773	54%	0.54	S	S	*	.	S	Bend	trans	-61.3	75.6	-167.1	0	0	0	0	0	116	E268	E268-G270 PolarHBondContact O-N 2.82Å
271	K	33	Very low	51.3	Low	185 Å²	185	93.3 Å²	93.3	80%	0.804	56%	0.561	S	S	*	*			trans	-132.4	3.9	175.1	-70.8	-166.9	173.4	-173	0	113.8	S269	S269-K271 VanDerWaalsContact C-N 3.3Å; S269-K271 PolarHBondContact O-N 2.85Å
272	A	32.4	Very low	48.2	Very low	87 Å²	87	97.5 Å²	97.5	72%	0.719	59%	0.589	S	S	*	*	S	Bend	trans	-98.4	-5.6	169.3	0	0	0	0	0	113.4
273	A	33.4	Very low	44.9	Very low	103 Å²	103	105.8 Å²	105.8	85%	0.851	63%	0.627	S	S	*	*	S	Bend	trans	-105.6	14.4	-178.6	0	0	0	0	0	113.7
274	A	30.9	Very low	41.7	Very low	68 Å²	68	112 Å²	112	56%	0.562	66%	0.656	S	S	*	*	S	Bend	trans	-145.7	155.6	177.6	0	0	0	0	0	110.2
275	I	27.1	Very low	38.4	Very low	185 Å²	185	120.1 Å²	120.1	95%	0.949	69%	0.693	S	S	*	*	S	Bend	trans	67.2	80.6	-171.7	-47.1	176.2	0	0	0	111.9
276	G	26.3	Very low	35.6	Very low	75 Å²	75	125.1 Å²	125.1	77%	0.773	73%	0.726	S	S	*	*	S	Bend	trans	-152	-20.2	175.8	0	0	0	0	0	115.4
277	K	27.7	Very low	32.4	Very low	206 Å²	206	127.7 Å²	127.7	90%	0.896	75%	0.754	S	S	*	*			trans	-141.7	114.8	168.2	-72.7	-167	176.8	-176.6	0	112.3
278	H	23.7	Very low	29.6	Very low	185 Å²	185	129.5 Å²	129.5	86%	0.856	78%	0.776	S	S	*	*			trans	-130.2	145	155.3	-111.3	-81.9	0	0	0	103.4
279	V	25.6	Very low	27.8	Very low	121 Å²	121	129.5 Å²	129.5	73%	0.733	78%	0.775	S	S	*	*	S	Bend	cis	-128.4	-157.5	12.8	-155.2	0	0	0	0	109.4
280	P	26.3	Very low	26.8	Very low	113 Å²	113	132.9 Å²	132.9	73%	0.734	78%	0.779	S	S	*	*				-96	173.5	-118.7	41.2	-29.2	0	0	0	115.6
281	A	22.1	Very low	26	Very low	95 Å²	95	137.2 Å²	137.2	79%	0.785	78%	0.777	S	S	*	*			trans	-83.4	154.3	165.6	0	0	0	0	0	112.3
282	P	25.1	Very low	25.5	Very low	113 Å²	113	136 Å²	136	73%	0.734	77%	0.772	S	S	*	*			trans	-119.1	117.6	152.5	33.4	-20.9	0	0	0	112.4
283	Q	23.6	Very low	25.2	Very low	191 Å²	191	138 Å²	138	89%	0.893	77%	0.771	S	S	*	*			trans	68.3	144.9	146.2	-64.3	174.9	-34.8	0	0	121.4
284	E	22.3	Very low	24.8	Very low	186 Å²	186	139.5 Å²	139.5	87%	0.869	76%	0.763	S	S	*	*			trans	-87.3	164.5	167.7	-52.3	154.8	135.9	0	0	108.4
285	E	23.3	Very low	24.5	Very low	178 Å²	178	141.8 Å²	141.8	83%	0.832	77%	0.766	S	S	*	*			cis	-128	-122.2	4.9	-84.5	-160.1	126.6	0	0	112
286	P	31.4	Very low	24.5	Very low	107 Å²	107	139.6 Å²	139.6	70%	0.695	75%	0.752	S	S	*	*				-129	-178.1	-108.1	39.4	-22.4	0	0	0	116.9
287	A	21.8	Very low	24.6	Very low	86 Å²	86	142.9 Å²	142.9	71%	0.711	75%	0.745	S	S	*	*			trans	83.1	134.4	144.1	0	0	0	0	0	121.2
288	C	23	Very low	24.6	Very low	105 Å²	105	142 Å²	142	71%	0.709	74%	0.744	S	S	*	*			trans	68.8	113.3	141.2	-70	0	0	0	0	122.9
289	Q	22.9	Very low	24.8	Very low	163 Å²	163	136.2 Å²	136.2	76%	0.762	73%	0.734	S	S	*	*				78	123.3	118.4	-65.7	-177.8	4.5	0	0	122
290	F	22.2	Very low	24.9	Very low	164 Å²	164	141.6 Å²	141.6	72%	0.719	74%	0.741	S	S	*	*			trans	65.5	115.7	134.2	-81.9	-99.3	0	0	0	123
291	F	22	Very low	24.9	Very low	166 Å²	166	144.9 Å²	144.9	73%	0.728	74%	0.744	S	S	*	*				84.1	148.5	125.9	-93.6	-144.9	0	0	0	123.1
292	F	21.8	Very low	25.3	Very low	160 Å²	160	151.6 Å²	151.6	70%	0.702	75%	0.749	S	S	*	*			trans	54.9	106	166.2	-84.3	-106.2	0	0	0	118.5
293	D	27.2	Very low	25.4	Very low	129 Å²	129	150.5 Å²	150.5	69%	0.69	74%	0.744	S	S	*	*				56.1	111.7	70	-168.8	25.8	0	0	0	114.2
294	L	24.2	Very low	25.6	Very low	133 Å²	133	146.4 Å²	146.4	70%	0.696	74%	0.737	S	S	*	*				178.5	154.7	126.1	-97.9	167.1	0	0	0	113.9
295	N	25	Very low	25.9	Very low	117 Å²	117	144.1 Å²	144.1	63%	0.626	74%	0.735	S	S	*	*			trans	68.6	113	158.2	-68.3	-23.5	0	0	0	118.8
296	E	26.8	Very low	26.1	Very low	139 Å²	139	139.5 Å²	139.5	65%	0.65	74%	0.735	S	S	*	*				82.7	144.4	70	-77.9	-164.6	154.2	0	0	113.1
297	K	28.5	Very low	25.9	Very low	144 Å²	144	145.1 Å²	145.1	63%	0.626	74%	0.743	S	S	*	*			cis	-163.1	168.6	11.2	-132.8	167	-168.7	141.3	0	112
298	Q	27.9	Very low	26.2	Very low	188 Å²	188	147.8 Å²	147.8	88%	0.879	75%	0.745	S	S	*	*			trans	72.5	146	160.7	-61.2	165.4	87	0	0	117.7
299	G	27	Very low	26.6	Very low	62 Å²	62	148.8 Å²	148.8	64%	0.639	75%	0.753	S	S	*	*			cis	-160.4	151.9	-4.2	0	0	0	0	0	111.8
300	R	27.8	Very low	27	Very low	234 Å²	234	150.5 Å²	150.5	88%	0.883	76%	0.758	S	S	*	*				53.4	130.8	97.3	-72.2	179.2	170.4	-175.4	-1.2	113.5
301	K	27.1	Very low	27.3	Very low	182 Å²	182	148.1 Å²	148.1	79%	0.791	76%	0.762	S	S	*	*			cis	-167.2	164.6	17.9	-102.6	169.7	-176.5	178.7	0	106.8
302	R	29.5	Very low	27.9	Very low	236 Å²	236	146 Å²	146	89%	0.891	76%	0.764	S	S	*	*			cis	-155	-167.3	-7.1	-147.5	-162.5	176	166.8	1.8	109.6
303	S	27.1	Very low	28.4	Very low	91 Å²	91	147.5 Å²	147.5	64%	0.636	77%	0.774	S	S	*	*			trans	-99.9	160.4	-171.4	53.5	0	0	0	0	118.2
304	S	28.6	Very low	28.7	Very low	105 Å²	105	146 Å²	146	73%	0.734	78%	0.779	S	S	*	*			trans	-154	116.4	131.1	72.6	0	0	0	0	110.9
305	T	28.4	Very low	29.3	Very low	138 Å²	138	149.3 Å²	149.3	85%	0.847	79%	0.788	S	S	*	*				70.6	115.8	102.1	61.4	0	0	0	0	117.5
306	G	26.9	Very low	29.7	Very low	80 Å²	80	152.3 Å²	152.3	83%	0.825	80%	0.799	S	S	*	*			trans	-177.5	32.1	179	0	0	0	0	0	121.6
307	R	27.9	Very low	30.1	Very low	226 Å²	226	151.5 Å²	151.5	85%	0.853	81%	0.805	S	S	*	*			trans	45.3	130.7	161.2	-79.4	-172.7	178.5	153.7	2.1	123.4
308	D	29.1	Very low	30.7	Very low	141 Å²	141	156.4 Å²	156.4	75%	0.754	82%	0.82	S	S	*	*			trans	58.9	99.8	132.4	-50.7	-33.4	0	0	0	122.4
309	S	30.6	Very low	30.8	Very low	127 Å²	127	158.8 Å²	158.8	89%	0.888	82%	0.821	S	S	*	*			trans	-154.9	148.4	133.6	-172.3	0	0	0	0	110.9
310	K	30.9	Very low	31.1	Very low	198 Å²	198	161 Å²	161	86%	0.861	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-86.3	130.7	-176.2	-67.3	176.5	-179.8	174.9	0	111.1	P312	K310-P312 WeakPolarHBondContact O-CD 3.21Å
311	S	28.6	Very low	31.4	Very low	115 Å²	115	155.9 Å²	155.9	80%	0.804	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-79.6	122.2	172.5	40.9	0	0	0	0	112
312	P	35.5	Very low	31.5	Very low	120 Å²	120	155.8 Å²	155.8	78%	0.779	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-71	145.2	166.4	-14.6	30.8	0	0	0	110.4	K310 A314	K310-P312 WeakPolarHBondContact O-CD 3.21Å; P312-A314 PolarHBondContact O-N 2.88Å
313	Q	32.5	Very low	31.9	Very low	192 Å²	192	149.3 Å²	149.3	90%	0.897	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-61.6	131.2	177.4	-70.7	171	-34.6	0	0	111.5	K315	Q313-K315 PolarHBondContact O-N 2.77Å; Q313-K315 VanDerWaalsContact O-N 3.09Å
314	A	32.5	Very low	32.9	Very low	98 Å²	98	149.7 Å²	149.7	81%	0.81	81%	0.812	S	S	*	*			trans	-66.2	108.8	174.4	0	0	0	0	0	110.2	P312 Q316	P312-A314 PolarHBondContact O-N 2.88Å; A314-Q316 PolarHBondContact O-N 3.26Å
315	K	37.9	Very low	34.2	Very low	202 Å²	202	147.3 Å²	147.3	88%	0.878	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-62.3	120	169.8	-70.4	-178.5	177.9	178	0	108.4	Q313	Q313-K315 PolarHBondContact O-N 2.77Å; Q313-K315 VanDerWaalsContact O-N 3.09Å
316	Q	33.2	Very low	35.8	Very low	181 Å²	181	143.5 Å²	143.5	85%	0.846	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-58.6	136	177.2	-68.2	-175	-5	0	0	110.2	A314 R318	A314-Q316 PolarHBondContact O-N 3.26Å; Q316-R318 PolarHBondContact O-N 3.28Å
317	P	34.2	Very low	37.7	Very low	122 Å²	122	140.9 Å²	140.9	79%	0.792	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-64.6	136.9	177.6	26.6	-33.5	0	0	0	110.4	R319	P317-R319 PolarHBondContact O-N 2.98Å
318	R	41.6	Very low	39.6	Very low	246 Å²	246	137 Å²	137	93%	0.928	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-58.9	135.9	173.1	-75.4	178.6	168.9	167.3	-5.2	109.4	Q316	Q316-R318 PolarHBondContact O-N 3.28Å
319	R	29.5	Very low	41.8	Very low	239 Å²	239	133 Å²	133	90%	0.902	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-58.3	142.4	175.7	-67	-179.4	178.6	177.8	-1	109.9	P317	P317-R319 PolarHBondContact O-N 2.98Å
320	P	33.3	Very low	43.8	Very low	108 Å²	108	128.1 Å²	128.1	70%	0.701	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-63.1	155	176.7	27.9	-35.2	0	0	0	111	Q322	P320-Q322 PolarHBondContact O-N 3.34Å
321	P	34.4	Very low	45.7	Very low	127 Å²	127	120.7 Å²	120.7	83%	0.825	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-59.9	132.6	171.7	27.2	-33.9	0	0	0	109.5
322	Q	30	Very low	47.4	Very low	180 Å²	180	120.1 Å²	120.1	84%	0.841	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-71.6	151.4	175.5	-71.5	-177.1	-22.2	0	0	110.2	P320	P320-Q322 PolarHBondContact O-N 3.34Å
323	P	37.9	Very low	49.1	Very low	100 Å²	100	114.9 Å²	114.9	65%	0.649	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-60.1	151.8	170.1	28.4	-35.4	0	0	0	110.1	G325	P323-G325 PolarHBondContact O-N 2.91Å
324	P	47.7	Very low	50.6	Low	99 Å²	99	111.5 Å²	111.5	64%	0.643	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-59.1	123.3	166.2	26.9	-32.7	0	0	0	108.2
325	G	55.1	Low	52.3	Low	54 Å²	54	111.3 Å²	111.3	56%	0.557	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-63.7	169.2	174.5	0	0	0	0	0	111.7	P323 C327	P323-G325 PolarHBondContact O-N 2.91Å; G325-C327 PolarHBondContact O-N 3Å
326	P	62.4	Low	54.1	Low	58 Å²	58	102.4 Å²	102.4	38%	0.377	55%	0.554	S	S	.	*	S	Bend	trans	-59.3	137.4	172.3	30.6	-35.6	0	0	0	109	W328 E335	P326-W328 PolarHBondContact O-N 3Å; P326-W328 VanDerWaalsContact O-N 3.11Å; P326-E335 HydrophobicContact CG-CB 4.3Å; P326-E335 HydrophobicContact CG-CG 3.89Å; P326-E335 WeakPolarHBondContact CG-OE1 3.31Å
327	C	66.5	Low	56.4	Low	25 Å²	25	97.3 Å²	97.3	17%	0.169	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-60	120.3	-172.8	-176.9	0	0	0	0	111.4	G325 F329 C330 S333 H413	G325-C327 PolarHBondContact O-N 3Å; C327-F329 PolarHBondContact O-N 3.1Å; C327-F329 PolarHBondContact SG-N 2.8Å; C327-C330 HydrophobicContact CB-CB 4.04Å; C327-C330 PolarHBondContact O-N 3.33Å; C327-S333 WeakPolarHBondContact O-CB 3.32Å; C327-S333 PolarHBondContact O-OG 3.11Å; C327-H413 PolarHBondContact SG-ND1 3.09Å; C327-H413 VanDerWaalsContact SG-ND1 3.38Å
328	W	67.6	Low	58.8	Low	146 Å²	146	98.2 Å²	98.2	55%	0.553	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.8	175.8	-69.4	5.6	0	0	0	113.4	P326 E335 V336 W507	P326-W328 PolarHBondContact O-N 3Å; P326-W328 VanDerWaalsContact O-N 3.11Å; W328-E335 PolarHBondContact NE1-OE2 3.07Å; W328-V336 WeakPolarHBondContact O-CG2 3.27Å; W328-W507 HydrophobicContact CZ3-CH2 4.33Å
329	F	75.9	Confident	60.8	Low	57 Å²	57	87.5 Å²	87.5	25%	0.25	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	0.8	-179.2	-59.6	-63.8	0	0	0	113.9	C327 Y349 L363 L365 H413	C327-F329 PolarHBondContact O-N 3.1Å; C327-F329 PolarHBondContact SG-N 2.8Å; F329-Y349 PolarHBondContact O-OH 3.18Å; F329-L363 HydrophobicContact CE1-CD1 3.99Å; F329-L365 HydrophobicContact CB-CD2 3.95Å; F329-L365 HydrophobicContact CD1-CD1 4.39Å; F329-L365 HydrophobicContact CD1-CD2 3.56Å; F329-L365 HydrophobicContact CE1-CD2 4.29Å; F329-L365 HydrophobicContact CG-CD2 3.9Å; F329-H413 HydrophobicContact CB-CB 3.87Å; F329-H413 HydrophobicContact CD2-CB 4.17Å; F329-H413 HydrophobicContact CG-CB 4.45Å; F329-H413 PolarHBondContact O-CE1 3.23Å; F329-H413 VanDerWaalsContact O-CE1 3.22Å; F329-H413 PolarHBondContact O-NE2 3.13Å
330	C	73.6	Confident	63.6	Low	23 Å²	23	76.7 Å²	76.7	16%	0.155	44%	0.443	C	S	.	.			trans	-85.1	120.4	169.7	-84.9	0	0	0	0	110	C327 A332 S333 V336 H369	C327-C330 HydrophobicContact CB-CB 4.04Å; C327-C330 PolarHBondContact O-N 3.33Å; C330-A332 PolarHBondContact O-N 3.18Å; C330-A332 VanDerWaalsContact O-N 3.08Å; C330-S333 WeakPolarHBondContact O-CB 3.31Å; C330-S333 PolarHBondContact O-N 3.28Å; C330-V336 WeakPolarHBondContact O-CB 3.1Å; C330-H369 VanDerWaalsContact SG-CD2 3.56Å
331	L	70.8	Confident	66.3	Low	43 Å²	43	72.4 Å²	72.4	23%	0.225	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.3	172.8	-67.3	-177.5	0	0	0	113.6	S333 V336 V341 Y349 I367	L331-S333 VanDerWaalsContact C-N 3.33Å; L331-V336 HydrophobicContact CD2-CG2 4.36Å; L331-V341 HydrophobicContact CD2-CG2 4Å; L331-Y349 HydrophobicContact CD1-CD1 3.73Å; L331-Y349 HydrophobicContact CD1-CE1 4.06Å; L331-Y349 HydrophobicContact CD1-CG 3.98Å; L331-Y349 HydrophobicContact CD2-CD1 4.22Å; L331-Y349 HydrophobicContact CD2-CD2 4.07Å; L331-Y349 HydrophobicContact CD2-CE1 3.89Å; L331-Y349 HydrophobicContact CD2-CE2 3.73Å; L331-Y349 HydrophobicContact CD2-CG 4.29Å; L331-Y349 HydrophobicContact CG-CD1 3.85Å; L331-Y349 HydrophobicContact CG-CE1 3.63Å; L331-Y349 HydrophobicContact CG-CE2 4.38Å; L331-Y349 HydrophobicContact CG-CG 4.31Å; L331-I367 HydrophobicContact CD1-CG1 4.04Å; L331-I367 HydrophobicContact CD1-CG2 4.33Å
332	A	64.2	Low	69	Low	102 Å²	102	67 Å²	67	84%	0.843	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.2	174	0	0	0	0	0	114.5	C330	C330-A332 PolarHBondContact O-N 3.18Å; C330-A332 VanDerWaalsContact O-N 3.08Å
333	S	70.8	Confident	72	Confident	10 Å²	10	59 Å²	59	7%	0.07	34%	0.342	C	S	.	.	S	Bend	trans	-77.6	144.7	177.2	-173.5	0	0	0	0	111.3	C327 C330 L331 E335 V336	C327-S333 WeakPolarHBondContact O-CB 3.32Å; C327-S333 PolarHBondContact O-OG 3.11Å; C330-S333 WeakPolarHBondContact O-CB 3.31Å; C330-S333 PolarHBondContact O-N 3.28Å; L331-S333 VanDerWaalsContact C-N 3.33Å; S333-E335 VanDerWaalsContact C-N 3.26Å; S333-E335 PolarHBondContact OG-N 2.7Å; S333-V336 VanDerWaalsContact O-CG1 3.25Å; S333-V336 WeakPolarHBondContact O-CG1 3.31Å
334	P	64.6	Low	74.5	Confident	121 Å²	121	58.6 Å²	58.6	79%	0.786	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-18.9	169.1	31	-35	0	0	0	112.9
335	E	66.8	Low	76.4	Confident	95 Å²	95	54.7 Å²	54.7	44%	0.444	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	8.1	-179	-68.7	-176.8	-154.4	0	0	113.6	P326 W328 S333	P326-E335 HydrophobicContact CG-CB 4.3Å; P326-E335 HydrophobicContact CG-CG 3.89Å; P326-E335 WeakPolarHBondContact CG-OE1 3.31Å; W328-E335 PolarHBondContact NE1-OE2 3.07Å; S333-E335 VanDerWaalsContact C-N 3.26Å; S333-E335 PolarHBondContact OG-N 2.7Å
336	V	76.3	Confident	77.9	Confident	14 Å²	14	56.9 Å²	56.9	9%	0.085	31%	0.314	C	S	.	.			trans	-77.7	129.3	177.3	69.7	0	0	0	0	111.4	W328 C330 L331 S333 K338	W328-V336 WeakPolarHBondContact O-CG2 3.27Å; C330-V336 WeakPolarHBondContact O-CB 3.1Å; L331-V336 HydrophobicContact CD2-CG2 4.36Å; S333-V336 VanDerWaalsContact O-CG1 3.25Å; S333-V336 WeakPolarHBondContact O-CG1 3.31Å; V336-K338 VanDerWaalsContact C-N 3.27Å; V336-K338 HydrophobicContact CG1-CD 4.38Å; V336-K338 HydrophobicContact CG1-CG 3.75Å; V336-K338 PolarHBondContact O-N 3.15Å
337	E	80.8	Confident	79.2	Confident	74 Å²	74	57.4 Å²	57.4	35%	0.346	31%	0.311	S	S	.	.			trans	-77	72.5	-178.4	-66.1	-80.2	-132.9	0	0	111.1	H339 L340 K354	E337-H339 PolarHBondContact O-N 3.18Å; E337-H339 IonicContact OE2-CE1 3.6Å; E337-H339 PolarHBondContact OE2-CE1 2.82Å; E337-H339 VanDerWaalsContact OE2-CE1 3.26Å; E337-H339 IonicContact OE2-ND1 2.64Å; E337-L340 HydrophobicContact CB-CD1 3.83Å; E337-L340 HydrophobicContact CB-CG 4.22Å; E337-L340 WeakPolarHBondContact O-CB 3.5Å; E337-L340 PolarHBondContact O-N 3.44Å; E337-K354 IonicContact OE1-NZ 3.91Å; E337-K354 PolarHBondContact OE1-NZ 3.26Å
338	K	84.3	Confident	80.4	Confident	142 Å²	142	56.2 Å²	56.2	62%	0.617	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-54.2	-25.5	-169.7	-65.7	-178.7	-176.4	-179.3	0	114.8	V336 L340 V341	V336-K338 VanDerWaalsContact C-N 3.27Å; V336-K338 HydrophobicContact CG1-CD 4.38Å; V336-K338 HydrophobicContact CG1-CG 3.75Å; V336-K338 PolarHBondContact O-N 3.15Å; K338-L340 VanDerWaalsContact C-N 3.28Å; K338-L340 PolarHBondContact O-N 3.35Å; K338-V341 PolarHBondContact O-N 2.6Å
339	H	84.4	Confident	81.5	Confident	20 Å²	20	49.4 Å²	49.4	9%	0.093	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-68.7	-24.5	178.6	59.8	-79.9	0	0	0	113.7	E337 K514 E517 E518 A521 R525	E337-H339 PolarHBondContact O-N 3.18Å; E337-H339 IonicContact OE2-CE1 3.6Å; E337-H339 PolarHBondContact OE2-CE1 2.82Å; E337-H339 VanDerWaalsContact OE2-CE1 3.26Å; E337-H339 IonicContact OE2-ND1 2.64Å; H339-K514 WeakPolarHBondContact ND1-CE 3.46Å; H339-K514 PolarHBondContact ND1-NZ 3.29Å; H339-E517 IonicContact CD2-OE2 2.73Å; H339-E517 IonicContact CE1-OE2 2.66Å; H339-E517 IonicContact NE2-OE2 3.16Å; H339-E517 PolarHBondContact NE2-OE2 2.84Å; H339-E518 HydrophobicContact CB-CG 3.63Å; H339-A521 VanDerWaalsContact O-CB 3.26Å; H339-A521 WeakPolarHBondContact O-CB 3.43Å; H339-R525 PolarHBondContact O-NH2 3Å
340	L	89.1	Confident	82.3	Confident	13 Å²	13	46.7 Å²	46.7	7%	0.068	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-77.8	-15.2	177.4	-64.1	176.9	0	0	0	113.8	E337 K338 V342 A351 L352 K354 E517	E337-L340 HydrophobicContact CB-CD1 3.83Å; E337-L340 HydrophobicContact CB-CG 4.22Å; E337-L340 WeakPolarHBondContact O-CB 3.5Å; E337-L340 PolarHBondContact O-N 3.44Å; K338-L340 VanDerWaalsContact C-N 3.28Å; K338-L340 PolarHBondContact O-N 3.35Å; L340-V342 PolarHBondContact O-N 3.15Å; L340-A351 CarbonylContact O-C 3.51Å; L340-A351 VanDerWaalsContact O-CA 3.25Å; L340-A351 WeakPolarHBondContact O-CA 3.33Å; L340-L352 HydrophobicContact CD2-CB 4.12Å; L340-L352 PolarHBondContact O-N 3.24Å; L340-K354 HydrophobicContact CD1-CB 4.07Å; L340-K354 HydrophobicContact CD1-CD 4.43Å; L340-E517 HydrophobicContact CD2-CB 3.79Å; L340-E517 HydrophobicContact CD2-CG 4.09Å
341	V	90.3	Very high	83.2	Confident	18 Å²	18	45.9 Å²	45.9	11%	0.109	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	111.9	-178.1	178.9	0	0	0	0	109.9	L331 K338 I344 Y349 A351 R525	L331-V341 HydrophobicContact CD2-CG2 4Å; K338-V341 PolarHBondContact O-N 2.6Å; V341-I344 HydrophobicContact CG1-CD1 3.85Å; V341-I344 HydrophobicContact CG1-CG1 3.58Å; V341-Y349 HydrophobicContact CG1-CD2 3.96Å; V341-Y349 HydrophobicContact CG2-CD2 4.15Å; V341-Y349 HydrophobicContact CG2-CE2 3.96Å; V341-A351 HydrophobicContact CG2-CB 4.44Å; V341-R525 VanDerWaalsContact O-CZ 3.28Å; V341-R525 PolarHBondContact O-NE 2.9Å; V341-R525 VanDerWaalsContact O-NE 3.09Å; V341-R525 PolarHBondContact O-NH2 3Å
342	V	90.7	Very high	84.3	Confident	14 Å²	14	44.3 Å²	44.3	9%	0.085	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-44.1	-175	-66.7	0	0	0	0	112.5	L340 L350 L352 A521 F524 R525	L340-V342 PolarHBondContact O-N 3.15Å; V342-L350 HydrophobicContact CG2-CB 3.83Å; V342-L350 HydrophobicContact CG2-CD2 3.67Å; V342-L350 HydrophobicContact CG2-CG 3.56Å; V342-L350 VanDerWaalsContact CG2-O 3.29Å; V342-L350 WeakPolarHBondContact CG2-O 3.28Å; V342-L350 PolarHBondContact N-O 3.01Å; V342-L352 HydrophobicContact CG1-CG 4.28Å; V342-A521 HydrophobicContact CG1-CB 4.34Å; V342-F524 HydrophobicContact CB-CD1 4.02Å; V342-F524 HydrophobicContact CG1-CB 4.18Å; V342-F524 HydrophobicContact CG1-CD1 3.98Å; V342-F524 HydrophobicContact CG1-CG 4.37Å; V342-F524 HydrophobicContact CG2-CD1 3.87Å; V342-F524 HydrophobicContact CG2-CE1 4.07Å; V342-R525 HydrophobicContact CB-CG 3.81Å; V342-R525 HydrophobicContact CG1-CG 4.05Å; V342-R525 WeakPolarHBondContact O-CD 3.42Å; V342-R525 VanDerWaalsContact O-CG 3.28Å; V342-R525 WeakPolarHBondContact O-CG 3.43Å
343	N	92.1	Very high	85.5	Confident	10 Å²	10	40.1 Å²	40.1	5%	0.053	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	155.2	178.2	166.8	-91.2	0	0	0	110.4	Y349 L350 Y387 F528 D532 T534	N343-Y349 WeakPolarHBondContact O-CB 3.43Å; N343-L350 HydrophobicContact CB-CB 4.29Å; N343-L350 PolarHBondContact N-O 2.8Å; N343-L350 PolarHBondContact O-N 2.95Å; N343-Y387 VanDerWaalsContact OD1-CE1 3.25Å; N343-Y387 WeakPolarHBondContact OD1-CE1 3.38Å; N343-Y387 PolarHBondContact OD1-OH 2.92Å; N343-F528 HydrophobicContact CB-CE1 4.31Å; N343-D532 PolarHBondContact ND2-OD1 2.98Å; N343-D532 PolarHBondContact ND2-OD2 2.95Å; N343-T534 PolarHBondContact ND2-OG1 3.25Å
344	I	90.3	Very high	86.1	Confident	92 Å²	92	42.7 Å²	42.7	47%	0.472	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	120.2	-179.1	-52.6	177.8	0	0	0	109.1	V341 I367	V341-I344 HydrophobicContact CG1-CD1 3.85Å; V341-I344 HydrophobicContact CG1-CG1 3.58Å; I344-I367 HydrophobicContact CG2-CD1 4.12Å
345	G	88.2	Confident	87	Confident	17 Å²	17	37.2 Å²	37.2	18%	0.175	19%	0.192	C	C	.	.			trans	-98.2	-154.2	173.3	0	0	0	0	0	113	C348 Y387	G345-C348 WeakPolarHBondContact CA-O 3.45Å; G345-C348 PolarHBondContact N-O 3.38Å; G345-Y387 PolarHBondContact N-OH 2.87Å
346	T	86.9	Confident	87.8	Confident	101 Å²	101	33.4 Å²	33.4	62%	0.62	18%	0.179	S	C	*	.	S	Bend	trans	-80.7	-37.2	-173.4	-52.8	0	0	0	0	112.5	E383	T346-E383 PolarHBondContact N-OE1 2.87Å
347	H	88.6	Confident	88.2	Confident	68 Å²	68	32.9 Å²	32.9	32%	0.315	18%	0.175	S	C	.	.	S	Bend	trans	-131	-22.3	-176.5	-53.6	-50.5	0	0	0	113.6	I367 V380 E383	H347-I367 WeakPolarHBondContact O-CB 3.39Å; H347-I367 WeakPolarHBondContact O-CG1 3.44Å; H347-I367 PolarHBondContact O-N 3.12Å; H347-V380 HydrophobicContact CB-CB 4.28Å; H347-V380 HydrophobicContact CB-CG1 3.99Å; H347-V380 HydrophobicContact CB-CG2 3.76Å; H347-E383 VanDerWaalsContact CA-OE2 3.29Å; H347-E383 WeakPolarHBondContact CA-OE2 3.48Å; H347-E383 WeakPolarHBondContact CB-OE2 3.36Å; H347-E383 PolarHBondContact N-OE2 3.34Å
348	C	92	Very high	88.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	161.6	178.9	-86.1	0	0	0	0	111.8	G345 L365 E383 V384 Y387	G345-C348 WeakPolarHBondContact CA-O 3.45Å; G345-C348 PolarHBondContact N-O 3.38Å; C348-L365 CarbonylContact C-O 3.53Å; C348-L365 VanDerWaalsContact CA-O 3.32Å; C348-L365 WeakPolarHBondContact CA-O 3.04Å; C348-E383 HydrophobicContact CB-CG 4.44Å; C348-E383 PolarHBondContact N-OE2 3.22Å; C348-V384 VanDerWaalsContact SG-CG2 3.55Å; C348-Y387 HydrophobicContact CB-CD2 3.91Å; C348-Y387 HydrophobicContact CB-CE2 3.58Å
349	Y	91.5	Very high	88.6	Confident	4 Å²	4	28 Å²	28	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	158.3	172.9	76.2	-85.8	0	0	0	110.3	F329 L331 V341 N343 A351 L365 I367	F329-Y349 PolarHBondContact O-OH 3.18Å; L331-Y349 HydrophobicContact CD1-CD1 3.73Å; L331-Y349 HydrophobicContact CD1-CE1 4.06Å; L331-Y349 HydrophobicContact CD1-CG 3.98Å; L331-Y349 HydrophobicContact CD2-CD1 4.22Å; L331-Y349 HydrophobicContact CD2-CD2 4.07Å; L331-Y349 HydrophobicContact CD2-CE1 3.89Å; L331-Y349 HydrophobicContact CD2-CE2 3.73Å; L331-Y349 HydrophobicContact CD2-CG 4.29Å; L331-Y349 HydrophobicContact CG-CD1 3.85Å; L331-Y349 HydrophobicContact CG-CE1 3.63Å; L331-Y349 HydrophobicContact CG-CE2 4.38Å; L331-Y349 HydrophobicContact CG-CG 4.31Å; V341-Y349 HydrophobicContact CG1-CD2 3.96Å; V341-Y349 HydrophobicContact CG2-CD2 4.15Å; V341-Y349 HydrophobicContact CG2-CE2 3.96Å; N343-Y349 WeakPolarHBondContact O-CB 3.43Å; Y349-A351 HydrophobicContact CD2-CB 4.27Å; Y349-A351 HydrophobicContact CE2-CB 3.93Å; Y349-L365 HydrophobicContact CD1-CB 3.89Å; Y349-L365 WeakPolarHBondContact CD1-O 3.43Å; Y349-L365 HydrophobicContact CD2-CB 4.45Å; Y349-L365 HydrophobicContact CD2-CD1 4.38Å; Y349-L365 HydrophobicContact CE1-CB 3.46Å; Y349-L365 VanDerWaalsContact CE1-CB 3.46Å; Y349-L365 HydrophobicContact CE1-CD1 4.42Å; Y349-L365 HydrophobicContact CE2-CB 4.09Å; Y349-L365 HydrophobicContact CE2-CD1 3.62Å; Y349-L365 HydrophobicContact CE2-CG 4.49Å; Y349-L365 HydrophobicContact CG-CB 4.37Å; Y349-L365 PolarHBondContact N-O 2.88Å; Y349-L365 PolarHBondContact O-N 3.05Å; Y349-I367 HydrophobicContact CD1-CG1 3.98Å
350	L	92.6	Very high	88.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.5	-179.8	-170.4	69	0	0	0	109.2	V342 N343 V362 I364 Y387 L391 F524 F528	V342-L350 HydrophobicContact CG2-CB 3.83Å; V342-L350 HydrophobicContact CG2-CD2 3.67Å; V342-L350 HydrophobicContact CG2-CG 3.56Å; V342-L350 VanDerWaalsContact CG2-O 3.29Å; V342-L350 WeakPolarHBondContact CG2-O 3.28Å; V342-L350 PolarHBondContact N-O 3.01Å; N343-L350 HydrophobicContact CB-CB 4.29Å; N343-L350 PolarHBondContact N-O 2.8Å; N343-L350 PolarHBondContact O-N 2.95Å; L350-V362 HydrophobicContact CD1-CB 3.83Å; L350-V362 HydrophobicContact CD1-CG2 3.86Å; L350-V362 HydrophobicContact CG-CB 4.24Å; L350-V362 HydrophobicContact CG-CG1 4.45Å; L350-I364 HydrophobicContact CD1-CG1 4.04Å; L350-Y387 HydrophobicContact CB-CE1 4.2Å; L350-L391 HydrophobicContact CD1-CD1 3.81Å; L350-L391 HydrophobicContact CD2-CD2 4.08Å; L350-F524 HydrophobicContact CD2-CE1 3.95Å; L350-F528 HydrophobicContact CD2-CE1 4.41Å; L350-F528 HydrophobicContact CD2-CE2 4.28Å; L350-F528 HydrophobicContact CD2-CZ 4.17Å
351	A	93	Very high	89	Confident	6 Å²	6	27 Å²	27	5%	0.05	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	152.8	175.9	0	0	0	0	0	112.2	L340 V341 Y349 V362 L363 L365	L340-A351 CarbonylContact O-C 3.51Å; L340-A351 VanDerWaalsContact O-CA 3.25Å; L340-A351 WeakPolarHBondContact O-CA 3.33Å; V341-A351 HydrophobicContact CG2-CB 4.44Å; Y349-A351 HydrophobicContact CD2-CB 4.27Å; Y349-A351 HydrophobicContact CE2-CB 3.93Å; A351-V362 CarbonylContact O-C 3.54Å; A351-V362 VanDerWaalsContact O-CA 3.29Å; A351-V362 WeakPolarHBondContact O-CA 2.97Å; A351-L363 PolarHBondContact N-O 3.35Å; A351-L363 VanDerWaalsContact N-O 3.15Å; A351-L363 PolarHBondContact O-N 3.13Å; A351-L365 HydrophobicContact CB-CD1 3.96Å
352	L	92.5	Very high	89.2	Confident	10 Å²	10	26.2 Å²	26.2	5%	0.052	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	143.4	170.6	-81.2	172.9	0	0	0	111.4	L340 V342 K354 D359 H361 V362 L520 A521 F524	L340-L352 HydrophobicContact CD2-CB 4.12Å; L340-L352 PolarHBondContact O-N 3.24Å; V342-L352 HydrophobicContact CG1-CG 4.28Å; L352-K354 PolarHBondContact O-N 2.81Å; L352-D359 WeakPolarHBondContact CD2-O 3.36Å; L352-H361 WeakPolarHBondContact CD2-O 3.32Å; L352-V362 HydrophobicContact CD2-CG1 3.78Å; L352-V362 HydrophobicContact CG-CG1 4.39Å; L352-L520 HydrophobicContact CD1-CB 3.86Å; L352-A521 HydrophobicContact CD1-CB 4Å; L352-F524 HydrophobicContact CD2-CD2 4.26Å
353	A	89.8	Confident	89.4	Confident	13 Å²	13	25.9 Å²	25.9	11%	0.107	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-76.5	118.2	176.4	0	0	0	0	0	111	G355 G356 H361 L363	A353-G355 PolarHBondContact O-N 2.87Å; A353-G355 VanDerWaalsContact O-N 3.13Å; A353-G356 PolarHBondContact O-N 2.68Å; A353-H361 HydrophobicContact CB-CB 4.23Å; A353-H361 WeakPolarHBondContact CB-ND1 3.28Å; A353-H361 WeakPolarHBondContact CB-O 3.34Å; A353-H361 PolarHBondContact N-O 3.25Å; A353-L363 HydrophobicContact CB-CD1 4.25Å; A353-L363 HydrophobicContact CB-CD2 3.92Å; A353-L363 HydrophobicContact CB-CG 3.94Å
354	K	84.3	Confident	89.5	Confident	65 Å²	65	25.5 Å²	25.5	28%	0.283	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	116.3	173.4	-173	144.2	-167.6	140.2	0	110.3	E337 L340 L352 E517	E337-K354 IonicContact OE1-NZ 3.91Å; E337-K354 PolarHBondContact OE1-NZ 3.26Å; L340-K354 HydrophobicContact CD1-CB 4.07Å; L340-K354 HydrophobicContact CD1-CD 4.43Å; L352-K354 PolarHBondContact O-N 2.81Å; K354-E517 WeakPolarHBondContact CD-OE1 3.48Å; K354-E517 WeakPolarHBondContact CE-OE1 3.31Å; K354-E517 WeakPolarHBondContact CG-OE1 3.35Å; K354-E517 IonicContact NZ-OE1 3.72Å; K354-E517 PolarHBondContact NZ-OE1 2.84Å; K354-E517 VanDerWaalsContact NZ-OE1 3.15Å; K354-E517 IonicContact NZ-OE2 2.75Å; K354-E517 PolarHBondContact NZ-OE2 3.19Å; K354-E517 VanDerWaalsContact NZ-OE2 3.07Å
355	G	82.9	Confident	89.5	Confident	5 Å²	5	21.2 Å²	21.2	5%	0.052	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	48.2	-171.2	0	0	0	0	0	113.8	A353 R490 C510	A353-G355 PolarHBondContact O-N 2.87Å; A353-G355 VanDerWaalsContact O-N 3.13Å; G355-R490 VanDerWaalsContact O-CZ 3.31Å; G355-R490 PolarHBondContact O-NH1 3.46Å; G355-R490 PolarHBondContact O-NH2 3.43Å; G355-C510 VanDerWaalsContact CA-CB 3.48Å; G355-C510 WeakPolarHBondContact CA-O 3.36Å; G355-C510 WeakPolarHBondContact O-CB 3.41Å
356	G	84	Confident	89.6	Confident	15 Å²	15	20.4 Å²	20.4	16%	0.155	12%	0.117	C	C	.	.			trans	-61.5	159.8	176.6	0	0	0	0	0	114.4	A353 H361	A353-G356 PolarHBondContact O-N 2.68Å; G356-H361 WeakPolarHBondContact CA-ND1 3.44Å
357	L	84.8	Confident	89.6	Confident	3 Å²	3	18.6 Å²	18.6	2%	0.016	10%	0.102	C	C	.	.	S	Bend	trans	-69	-44.2	173.2	-69	176.7	0	0	0	110.4	I419 R490 L493 A494 L499 I501 K504	L357-I419 HydrophobicContact CD1-CD1 4.03Å; L357-I419 HydrophobicContact CD1-CG2 4.48Å; L357-R490 HydrophobicContact CD1-CB 4.36Å; L357-R490 HydrophobicContact CD1-CG 4.36Å; L357-L493 HydrophobicContact CD1-CB 3.92Å; L357-A494 HydrophobicContact CD2-CB 4Å; L357-L499 HydrophobicContact CB-CD1 4.31Å; L357-I501 HydrophobicContact CB-CD1 4.04Å; L357-I501 HydrophobicContact CD2-CD1 4.12Å; L357-K504 HydrophobicContact CD2-CB 3.79Å; L357-K504 VanDerWaalsContact CD2-O 3.26Å; L357-K504 WeakPolarHBondContact CD2-O 3Å; L357-K504 WeakPolarHBondContact O-CD 3.43Å; L357-K504 PolarHBondContact O-NZ 3.47Å
358	S	85.4	Confident	89.1	Confident	26 Å²	26	16.7 Å²	16.7	18%	0.182	10%	0.101	C	C	.	.	S	Bend	trans	-120.9	155.4	173.4	58.3	0	0	0	0	111.4	D360 H361	S358-D360 PolarHBondContact O-N 2.65Å; S358-D360 VanDerWaalsContact O-N 3.09Å; S358-H361 WeakPolarHBondContact O-CB 3.48Å; S358-H361 PolarHBondContact O-N 3.06Å
359	D	86.8	Confident	88.6	Confident	88 Å²	88	22 Å²	22	47%	0.471	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-30.8	178.1	-54.2	13.6	0	0	0	114	L352 L520	L352-D359 WeakPolarHBondContact CD2-O 3.36Å; D359-L520 HydrophobicContact CB-CD2 4.08Å
360	D	90.1	Very high	88.2	Confident	12 Å²	12	25.3 Å²	25.3	6%	0.064	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	9.7	-179.5	-66.1	-47.9	0	0	0	113.4	S358 V362 F395 K400 P420 F524	S358-D360 PolarHBondContact O-N 2.65Å; S358-D360 VanDerWaalsContact O-N 3.09Å; D360-V362 PolarHBondContact O-N 2.73Å; D360-V362 VanDerWaalsContact O-N 3.16Å; D360-F395 HydrophobicContact CB-CE1 3.9Å; D360-F395 HydrophobicContact CB-CZ 4.45Å; D360-K400 IonicContact OD2-NZ 2.65Å; D360-K400 PolarHBondContact OD2-NZ 3.17Å; D360-P420 HydrophobicContact CB-CG 3.55Å; D360-F524 HydrophobicContact CB-CD2 4.5Å; D360-F524 HydrophobicContact CB-CE2 4.27Å
361	H	92.5	Very high	87.8	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.154	C	C	.	.			trans	-70	110.8	-180	179.9	-170.5	0	0	0	110.3	L352 A353 G356 S358 Q417 V418 I419	L352-H361 WeakPolarHBondContact CD2-O 3.32Å; A353-H361 HydrophobicContact CB-CB 4.23Å; A353-H361 WeakPolarHBondContact CB-ND1 3.28Å; A353-H361 WeakPolarHBondContact CB-O 3.34Å; A353-H361 PolarHBondContact N-O 3.25Å; G356-H361 WeakPolarHBondContact CA-ND1 3.44Å; S358-H361 WeakPolarHBondContact O-CB 3.48Å; S358-H361 PolarHBondContact O-N 3.06Å; H361-Q417 PolarHBondContact CE1-OE1 3.48Å; H361-Q417 VanDerWaalsContact CE1-OE1 3.29Å; H361-Q417 PolarHBondContact NE2-OE1 3.3Å; H361-V418 PolarHBondContact CD2-O 2.62Å; H361-V418 VanDerWaalsContact CD2-O 3.28Å; H361-I419 VanDerWaalsContact CD2-CG1 3.47Å; H361-I419 WeakPolarHBondContact CD2-CG1 3.32Å; H361-I419 WeakPolarHBondContact NE2-CG1 3.48Å
362	V	94.2	Very high	87.6	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	161.1	179.4	-69.7	0	0	0	0	112.8	L350 A351 L352 D360 L391 F395 V418 F524	L350-V362 HydrophobicContact CD1-CB 3.83Å; L350-V362 HydrophobicContact CD1-CG2 3.86Å; L350-V362 HydrophobicContact CG-CB 4.24Å; L350-V362 HydrophobicContact CG-CG1 4.45Å; A351-V362 CarbonylContact O-C 3.54Å; A351-V362 VanDerWaalsContact O-CA 3.29Å; A351-V362 WeakPolarHBondContact O-CA 2.97Å; L352-V362 HydrophobicContact CD2-CG1 3.78Å; L352-V362 HydrophobicContact CG-CG1 4.39Å; D360-V362 PolarHBondContact O-N 2.73Å; D360-V362 VanDerWaalsContact O-N 3.16Å; V362-L391 HydrophobicContact CG2-CD1 4.02Å; V362-L391 HydrophobicContact CG2-CD2 3.98Å; V362-F395 HydrophobicContact CG2-CE2 4.46Å; V362-F395 HydrophobicContact CG2-CZ 4.25Å; V362-V418 HydrophobicContact CG2-CB 4.04Å; V362-V418 HydrophobicContact CG2-CG1 4.4Å; V362-V418 PolarHBondContact N-O 2.81Å; V362-V418 WeakPolarHBondContact O-CB 3.48Å; V362-V418 PolarHBondContact O-N 3.14Å; V362-F524 HydrophobicContact CG1-CD1 4.38Å; V362-F524 HydrophobicContact CG1-CD2 4.14Å; V362-F524 HydrophobicContact CG1-CE1 3.91Å; V362-F524 HydrophobicContact CG1-CE2 3.61Å; V362-F524 HydrophobicContact CG1-CZ 3.5Å; V362-F524 VanDerWaalsContact CG1-CZ 3.5Å; V362-F524 HydrophobicContact CG2-CZ 4.25Å
363	L	94.1	Very high	87.2	Confident	8 Å²	8	28.3 Å²	28.3	4%	0.042	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	123.9	179.8	-54.4	-179.1	0	0	0	108.5	F329 A351 A353 L365 L416 Q417	F329-L363 HydrophobicContact CE1-CD1 3.99Å; A351-L363 PolarHBondContact N-O 3.35Å; A351-L363 VanDerWaalsContact N-O 3.15Å; A351-L363 PolarHBondContact O-N 3.13Å; A353-L363 HydrophobicContact CB-CD1 4.25Å; A353-L363 HydrophobicContact CB-CD2 3.92Å; A353-L363 HydrophobicContact CB-CG 3.94Å; L363-L365 HydrophobicContact CB-CD1 3.64Å; L363-L365 HydrophobicContact CB-CG 3.93Å; L363-L365 HydrophobicContact CD1-CD1 4.34Å; L363-L416 WeakPolarHBondContact CA-O 3.35Å; L363-Q417 HydrophobicContact CD2-CB 3.98Å; L363-Q417 VanDerWaalsContact CD2-CD 3.46Å; L363-Q417 HydrophobicContact CD2-CG 3.64Å
364	I	94.6	Very high	87.1	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.5	165.5	-57.1	165.2	0	0	0	107	L350 V384 Y387 K388 L391 L416 V418	L350-I364 HydrophobicContact CD1-CG1 4.04Å; I364-V384 HydrophobicContact CG2-CG2 4.2Å; I364-Y387 HydrophobicContact CG2-CD2 4.36Å; I364-Y387 HydrophobicContact CG2-CG 4.49Å; I364-K388 HydrophobicContact CD1-CG 4.11Å; I364-L391 HydrophobicContact CD1-CD1 3.97Å; I364-L391 HydrophobicContact CG1-CD1 3.98Å; I364-L416 HydrophobicContact CB-CB 4.3Å; I364-L416 HydrophobicContact CB-CD2 4.32Å; I364-L416 HydrophobicContact CD1-CD2 3.9Å; I364-L416 PolarHBondContact N-O 3.05Å; I364-L416 PolarHBondContact O-N 2.89Å; I364-V418 HydrophobicContact CD1-CG2 3.98Å; I364-V418 HydrophobicContact CG1-CG2 4.1Å
365	L	91.7	Very high	87.1	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.7	-170.2	-67.7	148.4	0	0	0	109.1	F329 C348 Y349 A351 L363 Q415	F329-L365 HydrophobicContact CB-CD2 3.95Å; F329-L365 HydrophobicContact CD1-CD1 4.39Å; F329-L365 HydrophobicContact CD1-CD2 3.56Å; F329-L365 HydrophobicContact CE1-CD2 4.29Å; F329-L365 HydrophobicContact CG-CD2 3.9Å; C348-L365 CarbonylContact C-O 3.53Å; C348-L365 VanDerWaalsContact CA-O 3.32Å; C348-L365 WeakPolarHBondContact CA-O 3.04Å; Y349-L365 HydrophobicContact CD1-CB 3.89Å; Y349-L365 WeakPolarHBondContact CD1-O 3.43Å; Y349-L365 HydrophobicContact CD2-CB 4.45Å; Y349-L365 HydrophobicContact CD2-CD1 4.38Å; Y349-L365 HydrophobicContact CE1-CB 3.46Å; Y349-L365 VanDerWaalsContact CE1-CB 3.46Å; Y349-L365 HydrophobicContact CE1-CD1 4.42Å; Y349-L365 HydrophobicContact CE2-CB 4.09Å; Y349-L365 HydrophobicContact CE2-CD1 3.62Å; Y349-L365 HydrophobicContact CE2-CG 4.49Å; Y349-L365 HydrophobicContact CG-CB 4.37Å; Y349-L365 PolarHBondContact N-O 2.88Å; Y349-L365 PolarHBondContact O-N 3.05Å; A351-L365 HydrophobicContact CB-CD1 3.96Å; L363-L365 HydrophobicContact CB-CD1 3.64Å; L363-L365 HydrophobicContact CB-CG 3.93Å; L363-L365 HydrophobicContact CD1-CD1 4.34Å; L365-Q415 HydrophobicContact CD2-CB 4.22Å
366	P	90	Very high	87.2	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	144.2	169.6	30.2	-32.8	0	0	0	110.5	G368 Y370 L376 V380 H413 L414	P366-G368 VanDerWaalsContact C-N 3.28Å; P366-G368 WeakPolarHBondContact CG-O 3.28Å; P366-Y370 HydrophobicContact CB-CD2 3.79Å; P366-Y370 HydrophobicContact CB-CE2 4.28Å; P366-Y370 HydrophobicContact CG-CD2 3.99Å; P366-L376 HydrophobicContact CB-CD2 4.44Å; P366-V380 HydrophobicContact CB-CG1 4.43Å; P366-H413 PolarHBondContact O-NE2 3.43Å; P366-L414 WeakPolarHBondContact CD-O 3.22Å; P366-L414 HydrophobicContact CG-CB 3.94Å; P366-L414 HydrophobicContact CG-CD2 4.13Å; P366-L414 HydrophobicContact CG-CG 4.33Å
367	I	86.1	Confident	87.4	Confident	62 Å²	62	29.6 Å²	29.6	32%	0.318	16%	0.158	S	C	.	.	S	Bend	trans	-67.1	-34.9	172.9	-60.4	172.4	0	0	0	109.8	L331 I344 H347 Y349	L331-I367 HydrophobicContact CD1-CG1 4.04Å; L331-I367 HydrophobicContact CD1-CG2 4.33Å; I344-I367 HydrophobicContact CG2-CD1 4.12Å; H347-I367 WeakPolarHBondContact O-CB 3.39Å; H347-I367 WeakPolarHBondContact O-CG1 3.44Å; H347-I367 PolarHBondContact O-N 3.12Å; Y349-I367 HydrophobicContact CD1-CG1 3.98Å
368	G	78.7	Confident	87.5	Confident	28 Å²	28	32.5 Å²	32.5	29%	0.289	18%	0.182	S	C	.	.	S	Bend	trans	-77.8	151.4	170.1	0	0	0	0	0	112.9	P366 Y370 H413	P366-G368 VanDerWaalsContact C-N 3.28Å; P366-G368 WeakPolarHBondContact CG-O 3.28Å; G368-Y370 WeakPolarHBondContact O-CD2 3.48Å; G368-Y370 PolarHBondContact O-N 3.27Å; G368-Y370 VanDerWaalsContact O-N 3.11Å; G368-H413 PolarHBondContact O-NE2 3.03Å
369	H	81.4	Confident	87.7	Confident	112 Å²	112	37.2 Å²	37.2	52%	0.519	20%	0.201	S	C	.	.			trans	-84.9	81.8	-179.5	-174.9	-84.9	0	0	0	111.6	C330 H412 H413	C330-H369 VanDerWaalsContact SG-CD2 3.56Å; H369-H412 PolarHBondContact CE1-O 2.84Å; H369-H412 PolarHBondContact NE2-O 2.93Å; H369-H413 AromaticContact CD2-ND1 3.55Å
370	Y	83.6	Confident	87.8	Confident	73 Å²	73	33.2 Å²	33.2	29%	0.286	18%	0.18	S	C	.	.			trans	-102.3	146	170.5	-54.3	-89.4	0	0	0	109.4	P366 G368 E375 L376 H413 L414	P366-Y370 HydrophobicContact CB-CD2 3.79Å; P366-Y370 HydrophobicContact CB-CE2 4.28Å; P366-Y370 HydrophobicContact CG-CD2 3.99Å; G368-Y370 WeakPolarHBondContact O-CD2 3.48Å; G368-Y370 PolarHBondContact O-N 3.27Å; G368-Y370 VanDerWaalsContact O-N 3.11Å; Y370-E375 HydrophobicContact CD1-CB 4.44Å; Y370-L376 HydrophobicContact CD1-CD2 4.13Å; Y370-L376 HydrophobicContact CD2-CD2 3.68Å; Y370-L376 HydrophobicContact CE2-CD2 4.23Å; Y370-L376 HydrophobicContact CG-CD2 3.63Å; Y370-H413 CarbonylContact O-C 3.58Å; Y370-H413 WeakPolarHBondContact O-CA 3.48Å; Y370-L414 PolarHBondContact O-N 2.82Å
371	Q	84.3	Confident	87.8	Confident	68 Å²	68	34.3 Å²	34.3	32%	0.318	19%	0.187	S	C	.	.	S	Bend	trans	-84.3	-31	-179.4	-162.6	-174.7	-75.3	0	0	112.4	E375 N408 S411 L414	Q371-E375 WeakPolarHBondContact CA-OE2 3.35Å; Q371-E375 VanDerWaalsContact CB-OE2 3.26Å; Q371-E375 WeakPolarHBondContact CB-OE2 3.4Å; Q371-E375 PolarHBondContact N-OE2 2.91Å; Q371-N408 PolarHBondContact NE2-OD1 3.39Å; Q371-S411 WeakPolarHBondContact CG-O 3.49Å; Q371-L414 PolarHBondContact O-N 2.86Å
372	S	87.3	Confident	87.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-148.1	162.4	-171.2	67.1	0	0	0	0	114.3	V374 E375 E406 N408	S372-V374 PolarHBondContact O-N 2.74Å; S372-E375 PolarHBondContact O-N 3.37Å; S372-E375 VanDerWaalsContact O-N 3.16Å; S372-E375 VanDerWaalsContact OG-CD 3.28Å; S372-E375 PolarHBondContact OG-OE1 3.4Å; S372-E406 WeakPolarHBondContact CA-OE1 3.22Å; S372-E406 WeakPolarHBondContact CB-OE1 3.44Å; S372-N408 WeakPolarHBondContact CB-ND2 3.48Å
373	V	85.5	Confident	87.7	Confident	12 Å²	12	41.2 Å²	41.2	7%	0.073	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-59.3	-32.7	174.5	172.5	0	0	0	0	111.7	E375 L376 E406 L414 I455 Y465	V373-E375 PolarHBondContact O-N 2.79Å; V373-L376 HydrophobicContact CG1-CD1 4.39Å; V373-L376 WeakPolarHBondContact O-CB 3.35Å; V373-L376 WeakPolarHBondContact O-CG 3.13Å; V373-L376 PolarHBondContact O-N 3.4Å; V373-E406 WeakPolarHBondContact CB-OE2 3.33Å; V373-E406 VanDerWaalsContact CG2-OE2 3.23Å; V373-E406 WeakPolarHBondContact CG2-OE2 3.25Å; V373-E406 PolarHBondContact N-OE1 3.19Å; V373-L414 HydrophobicContact CG2-CD1 3.71Å; V373-L414 HydrophobicContact CG2-CD2 3.87Å; V373-L414 HydrophobicContact CG2-CG 4.47Å; V373-I455 HydrophobicContact CG1-CD1 4.45Å; V373-Y465 PolarHBondContact N-OH 3.3Å
374	V	86.1	Confident	87.6	Confident	10 Å²	10	41 Å²	41	6%	0.061	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-63.2	-26.5	179.2	172.7	0	0	0	0	112.7	S372 I455 K456 A459 P461 Y465	S372-V374 PolarHBondContact O-N 2.74Å; V374-I455 HydrophobicContact CG2-CG2 3.89Å; V374-K456 HydrophobicContact CB-CG 4.37Å; V374-K456 HydrophobicContact CG1-CG 4.28Å; V374-K456 HydrophobicContact CG2-CG 4.37Å; V374-K456 WeakPolarHBondContact O-CE 3.48Å; V374-A459 WeakPolarHBondContact CG1-O 3.24Å; V374-A459 HydrophobicContact CG2-CB 3.9Å; V374-P461 HydrophobicContact CG1-CB 4.34Å; V374-P461 HydrophobicContact CG1-CG 3.88Å; V374-Y465 HydrophobicContact CB-CE1 4.46Å; V374-Y465 HydrophobicContact CG2-CE1 3.75Å
375	E	84.2	Confident	87.5	Confident	64 Å²	64	44.8 Å²	44.8	30%	0.299	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-86.9	-7.4	-178.9	-72.3	154.2	-137	0	0	114.6	Y370 Q371 S372 V373	Y370-E375 HydrophobicContact CD1-CB 4.44Å; Q371-E375 WeakPolarHBondContact CA-OE2 3.35Å; Q371-E375 VanDerWaalsContact CB-OE2 3.26Å; Q371-E375 WeakPolarHBondContact CB-OE2 3.4Å; Q371-E375 PolarHBondContact N-OE2 2.91Å; S372-E375 PolarHBondContact O-N 3.37Å; S372-E375 VanDerWaalsContact O-N 3.16Å; S372-E375 VanDerWaalsContact OG-CD 3.28Å; S372-E375 PolarHBondContact OG-OE1 3.4Å; V373-E375 PolarHBondContact O-N 2.79Å
376	L	86.4	Confident	87.5	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	25%	0.254	C	S	.	.			trans	-72.7	143.6	-176.3	-60.6	-179.6	0	0	0	112.8	P366 Y370 V373 V380 V381 V384 L414 K456	P366-L376 HydrophobicContact CB-CD2 4.44Å; Y370-L376 HydrophobicContact CD1-CD2 4.13Å; Y370-L376 HydrophobicContact CD2-CD2 3.68Å; Y370-L376 HydrophobicContact CE2-CD2 4.23Å; Y370-L376 HydrophobicContact CG-CD2 3.63Å; V373-L376 HydrophobicContact CG1-CD1 4.39Å; V373-L376 WeakPolarHBondContact O-CB 3.35Å; V373-L376 WeakPolarHBondContact O-CG 3.13Å; V373-L376 PolarHBondContact O-N 3.4Å; L376-V380 HydrophobicContact CB-CB 4.31Å; L376-V380 HydrophobicContact CD1-CG1 4.32Å; L376-V380 HydrophobicContact CD2-CB 4.36Å; L376-V380 HydrophobicContact CD2-CG1 3.93Å; L376-V381 HydrophobicContact CB-CG2 3.66Å; L376-V381 HydrophobicContact CD1-CG2 4.16Å; L376-V384 HydrophobicContact CD1-CG2 4.06Å; L376-L414 HydrophobicContact CD1-CD2 3.75Å; L376-L414 HydrophobicContact CD2-CD2 4.02Å; L376-L414 HydrophobicContact CG-CD2 4.14Å; L376-K456 PolarHBondContact O-NZ 3.46Å
377	S	87.3	Confident	87.7	Confident	45 Å²	45	49 Å²	49	32%	0.315	25%	0.254	S	S	.	.			trans	-68.8	166	166.1	73	0	0	0	0	111.2	E379 V380 V381	S377-E379 VanDerWaalsContact C-N 3.32Å; S377-E379 PolarHBondContact O-N 3.05Å; S377-E379 PolarHBondContact OG-OE2 2.74Å; S377-V380 PolarHBondContact O-N 3.16Å; S377-V381 WeakPolarHBondContact O-CG2 3.39Å; S377-V381 PolarHBondContact O-N 2.79Å
378	A	87.6	Confident	88	Confident	64 Å²	64	46.5 Å²	46.5	53%	0.529	24%	0.241	S	C	.	.	H	α-helix	trans	-56.3	-46.4	179.3	0	0	0	0	0	112	V380 V381 E382	A378-V380 VanDerWaalsContact C-N 3.28Å; A378-V380 PolarHBondContact O-N 2.81Å; A378-V381 PolarHBondContact O-N 3.25Å; A378-E382 WeakPolarHBondContact O-CG 3.22Å; A378-E382 PolarHBondContact O-N 3.18Å
379	E	89.3	Confident	88.7	Confident	125 Å²	125	47.9 Å²	47.9	58%	0.584	25%	0.25	S	C	*	.	H	α-helix	trans	-53.5	-42.2	178.5	-56.7	149.7	149.1	0	0	112.4	S377 E383	S377-E379 VanDerWaalsContact C-N 3.32Å; S377-E379 PolarHBondContact O-N 3.05Å; S377-E379 PolarHBondContact OG-OE2 2.74Å; E379-E383 PolarHBondContact O-N 2.99Å
380	V	89.7	Confident	89.2	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-78.9	-31.3	179.7	-165.6	0	0	0	0	111.8	H347 P366 L376 S377 A378 V384	H347-V380 HydrophobicContact CB-CB 4.28Å; H347-V380 HydrophobicContact CB-CG1 3.99Å; H347-V380 HydrophobicContact CB-CG2 3.76Å; P366-V380 HydrophobicContact CB-CG1 4.43Å; L376-V380 HydrophobicContact CB-CB 4.31Å; L376-V380 HydrophobicContact CD1-CG1 4.32Å; L376-V380 HydrophobicContact CD2-CB 4.36Å; L376-V380 HydrophobicContact CD2-CG1 3.93Å; S377-V380 PolarHBondContact O-N 3.16Å; A378-V380 VanDerWaalsContact C-N 3.28Å; A378-V380 PolarHBondContact O-N 2.81Å; V380-V384 VanDerWaalsContact O-CG2 3.3Å; V380-V384 WeakPolarHBondContact O-CG2 3.34Å; V380-V384 PolarHBondContact O-N 2.82Å
381	V	90.3	Very high	89.7	Confident	35 Å²	35	39.4 Å²	39.4	21%	0.212	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-43.7	172.3	173.4	0	0	0	0	110.9	L376 S377 A378 E383 V384 E385	L376-V381 HydrophobicContact CB-CG2 3.66Å; L376-V381 HydrophobicContact CD1-CG2 4.16Å; S377-V381 WeakPolarHBondContact O-CG2 3.39Å; S377-V381 PolarHBondContact O-N 2.79Å; A378-V381 PolarHBondContact O-N 3.25Å; V381-E383 VanDerWaalsContact C-N 3.3Å; V381-E383 PolarHBondContact O-N 2.85Å; V381-V384 PolarHBondContact O-N 3.09Å; V381-E385 HydrophobicContact CG1-CG 4.35Å; V381-E385 WeakPolarHBondContact O-CG 3.38Å; V381-E385 PolarHBondContact O-N 2.93Å
382	E	90.9	Very high	90.1	Very high	134 Å²	134	38.6 Å²	38.6	63%	0.626	21%	0.209	S	C	*	.	H	α-helix	trans	-58.1	-42	176.9	-73.8	173.3	-149.8	0	0	111.7	A378 E385 K386	A378-E382 WeakPolarHBondContact O-CG 3.22Å; A378-E382 PolarHBondContact O-N 3.18Å; E382-E385 PolarHBondContact O-N 3.23Å; E382-K386 PolarHBondContact O-N 3.31Å
383	E	92.1	Very high	90.3	Very high	12 Å²	12	44.9 Å²	44.9	6%	0.056	23%	0.232	C	C	.	.	H	α-helix	trans	-71.9	-36.6	175.8	-164.1	175.8	-127.3	0	0	113.2	T346 H347 C348 E379 V381 E385 K386 Y387 F533	T346-E383 PolarHBondContact N-OE1 2.87Å; H347-E383 VanDerWaalsContact CA-OE2 3.29Å; H347-E383 WeakPolarHBondContact CA-OE2 3.48Å; H347-E383 WeakPolarHBondContact CB-OE2 3.36Å; H347-E383 PolarHBondContact N-OE2 3.34Å; C348-E383 HydrophobicContact CB-CG 4.44Å; C348-E383 PolarHBondContact N-OE2 3.22Å; E379-E383 PolarHBondContact O-N 2.99Å; V381-E383 VanDerWaalsContact C-N 3.3Å; V381-E383 PolarHBondContact O-N 2.85Å; E383-E385 VanDerWaalsContact C-N 3.31Å; E383-E385 PolarHBondContact O-N 2.96Å; E383-K386 WeakPolarHBondContact O-CB 3.37Å; E383-K386 PolarHBondContact O-N 3.4Å; E383-Y387 HydrophobicContact CG-CD2 4.08Å; E383-Y387 HydrophobicContact CG-CE2 3.91Å; E383-Y387 VanDerWaalsContact O-CD2 3.25Å; E383-Y387 WeakPolarHBondContact O-CD2 3.11Å; E383-Y387 PolarHBondContact O-N 2.86Å; E383-F533 HydrophobicContact CG-CE2 4.37Å; E383-F533 HydrophobicContact CG-CZ 4.36Å
384	V	92.3	Very high	90.7	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-59	-43.7	171	166.4	0	0	0	0	110.7	C348 I364 L376 V380 V381 Y387 K388 L416	C348-V384 VanDerWaalsContact SG-CG2 3.55Å; I364-V384 HydrophobicContact CG2-CG2 4.2Å; L376-V384 HydrophobicContact CD1-CG2 4.06Å; V380-V384 VanDerWaalsContact O-CG2 3.3Å; V380-V384 WeakPolarHBondContact O-CG2 3.34Å; V380-V384 PolarHBondContact O-N 2.82Å; V381-V384 PolarHBondContact O-N 3.09Å; V384-Y387 WeakPolarHBondContact O-CB 3.4Å; V384-Y387 PolarHBondContact O-N 2.81Å; V384-K388 HydrophobicContact CG1-CG 4.45Å; V384-K388 WeakPolarHBondContact O-CG 3.09Å; V384-K388 PolarHBondContact O-N 3.06Å; V384-L416 HydrophobicContact CG1-CD2 3.95Å
385	E	91.8	Very high	91	Very high	82 Å²	82	43.8 Å²	43.8	38%	0.383	23%	0.226	S	C	.	.	H	α-helix	trans	-69.5	-36.5	176.9	-63.9	-56.8	141.1	0	0	112.3	V381 E382 E383 Y387 K388 A389	V381-E385 HydrophobicContact CG1-CG 4.35Å; V381-E385 WeakPolarHBondContact O-CG 3.38Å; V381-E385 PolarHBondContact O-N 2.93Å; E382-E385 PolarHBondContact O-N 3.23Å; E383-E385 VanDerWaalsContact C-N 3.31Å; E383-E385 PolarHBondContact O-N 2.96Å; E385-Y387 VanDerWaalsContact C-N 3.31Å; E385-Y387 PolarHBondContact O-N 3.45Å; E385-K388 PolarHBondContact O-N 2.98Å; E385-K388 WeakPolarHBondContact OE1-CE 3.5Å; E385-K388 IonicContact OE1-NZ 2.68Å; E385-K388 PolarHBondContact OE1-NZ 3.18Å; E385-K388 WeakPolarHBondContact OE2-CD 3.23Å; E385-K388 IonicContact OE2-NZ 3.25Å; E385-A389 WeakPolarHBondContact O-CB 3.38Å; E385-A389 PolarHBondContact O-N 3.19Å
386	K	92.5	Very high	91.3	Very high	91 Å²	91	49 Å²	49	40%	0.396	25%	0.247	S	C	.	.	H	α-helix	trans	-53.7	-48	167.1	-78.2	-174.1	174	-176.5	0	110.5	E382 E383 T390 F533 D537	E382-K386 PolarHBondContact O-N 3.31Å; E383-K386 WeakPolarHBondContact O-CB 3.37Å; E383-K386 PolarHBondContact O-N 3.4Å; K386-T390 VanDerWaalsContact O-CB 3.26Å; K386-T390 WeakPolarHBondContact O-CB 3.35Å; K386-T390 PolarHBondContact O-N 2.96Å; K386-T390 PolarHBondContact O-OG1 3.43Å; K386-F533 HydrophobicContact CB-CD1 4.49Å; K386-F533 HydrophobicContact CB-CE1 3.98Å; K386-F533 HydrophobicContact CB-CE2 4Å; K386-F533 HydrophobicContact CB-CZ 3.71Å; K386-F533 HydrophobicContact CD-CD2 3.85Å; K386-F533 HydrophobicContact CD-CE2 3.66Å; K386-F533 HydrophobicContact CD-CZ 4.26Å; K386-F533 HydrophobicContact CG-CE2 4.48Å; K386-D537 IonicContact NZ-OD1 3.07Å; K386-D537 IonicContact NZ-OD2 2.7Å; K386-D537 PolarHBondContact NZ-OD2 2.7Å
387	Y	93.9	Very high	91.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-46.8	177	-84.3	-64.9	0	0	0	112.8	N343 G345 C348 L350 I364 E383 V384 E385 A389 T390 L391 F533	N343-Y387 VanDerWaalsContact OD1-CE1 3.25Å; N343-Y387 WeakPolarHBondContact OD1-CE1 3.38Å; N343-Y387 PolarHBondContact OD1-OH 2.92Å; G345-Y387 PolarHBondContact N-OH 2.87Å; C348-Y387 HydrophobicContact CB-CD2 3.91Å; C348-Y387 HydrophobicContact CB-CE2 3.58Å; L350-Y387 HydrophobicContact CB-CE1 4.2Å; I364-Y387 HydrophobicContact CG2-CD2 4.36Å; I364-Y387 HydrophobicContact CG2-CG 4.49Å; E383-Y387 HydrophobicContact CG-CD2 4.08Å; E383-Y387 HydrophobicContact CG-CE2 3.91Å; E383-Y387 VanDerWaalsContact O-CD2 3.25Å; E383-Y387 WeakPolarHBondContact O-CD2 3.11Å; E383-Y387 PolarHBondContact O-N 2.86Å; V384-Y387 WeakPolarHBondContact O-CB 3.4Å; V384-Y387 PolarHBondContact O-N 2.81Å; E385-Y387 VanDerWaalsContact C-N 3.31Å; E385-Y387 PolarHBondContact O-N 3.45Å; Y387-A389 PolarHBondContact O-N 2.72Å; Y387-T390 PolarHBondContact O-N 3.28Å; Y387-L391 WeakPolarHBondContact O-CB 3.14Å; Y387-L391 WeakPolarHBondContact O-CG 3.48Å; Y387-L391 PolarHBondContact O-N 2.99Å; Y387-F533 AromaticContact CD1-CE1 3.7Å; Y387-F533 HydrophobicContact CD1-CE1 3.7Å; Y387-F533 AromaticContact CD1-CZ 3.92Å; Y387-F533 HydrophobicContact CD1-CZ 3.92Å; Y387-F533 HydrophobicContact CD2-CE1 4.45Å; Y387-F533 AromaticContact CD2-CZ 3.92Å; Y387-F533 HydrophobicContact CD2-CZ 3.92Å; Y387-F533 AromaticContact CE1-CE1 3.86Å; Y387-F533 HydrophobicContact CE1-CE1 3.86Å; Y387-F533 AromaticContact CE1-CZ 3.85Å; Y387-F533 HydrophobicContact CE1-CZ 3.85Å; Y387-F533 AromaticContact CE2-CZ 3.86Å; Y387-F533 HydrophobicContact CE2-CZ 3.86Å; Y387-F533 HydrophobicContact CG-CE1 4.01Å; Y387-F533 AromaticContact CG-CZ 3.94Å; Y387-F533 HydrophobicContact CG-CZ 3.94Å; Y387-F533 AromaticContact CZ-CZ 3.82Å
388	K	93.1	Very high	91.8	Very high	9 Å²	9	54.4 Å²	54.4	4%	0.039	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-51.3	177.2	-69.7	-167.3	-166.2	164.7	0	111.6	I364 V384 E385 T390 L391 K392 L404 L416 E469	I364-K388 HydrophobicContact CD1-CG 4.11Å; V384-K388 HydrophobicContact CG1-CG 4.45Å; V384-K388 WeakPolarHBondContact O-CG 3.09Å; V384-K388 PolarHBondContact O-N 3.06Å; E385-K388 PolarHBondContact O-N 2.98Å; E385-K388 WeakPolarHBondContact OE1-CE 3.5Å; E385-K388 IonicContact OE1-NZ 2.68Å; E385-K388 PolarHBondContact OE1-NZ 3.18Å; E385-K388 WeakPolarHBondContact OE2-CD 3.23Å; E385-K388 IonicContact OE2-NZ 3.25Å; K388-T390 VanDerWaalsContact C-N 3.28Å; K388-T390 PolarHBondContact O-N 2.89Å; K388-L391 PolarHBondContact O-N 3.48Å; K388-K392 WeakPolarHBondContact O-CB 3.19Å; K388-K392 WeakPolarHBondContact O-CG 3.39Å; K388-K392 PolarHBondContact O-N 3.23Å; K388-L404 HydrophobicContact CB-CD2 4.25Å; K388-L404 HydrophobicContact CD-CD2 3.85Å; K388-L404 HydrophobicContact CG-CD2 3.6Å; K388-L416 HydrophobicContact CG-CD2 4.36Å; K388-E469 IonicContact NZ-OE1 2.81Å; K388-E469 IonicContact NZ-OE2 3.93Å; K388-E469 PolarHBondContact NZ-OE2 2.94Å
389	A	92.4	Very high	91.9	Very high	57 Å²	57	52.8 Å²	52.8	47%	0.471	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-39.7	-179.1	0	0	0	0	0	111.7	E385 Y387 R393	E385-A389 WeakPolarHBondContact O-CB 3.38Å; E385-A389 PolarHBondContact O-N 3.19Å; Y387-A389 PolarHBondContact O-N 2.72Å; A389-R393 WeakPolarHBondContact O-CB 3.48Å; A389-R393 PolarHBondContact O-N 2.83Å
390	T	93.4	Very high	92	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.037	25%	0.245	C	C	.	.	H	α-helix	trans	-67.2	-44.9	178	-60.4	0	0	0	0	112.1	K386 Y387 K388 R393 F394 F528 F531 F533	K386-T390 VanDerWaalsContact O-CB 3.26Å; K386-T390 WeakPolarHBondContact O-CB 3.35Å; K386-T390 PolarHBondContact O-N 2.96Å; K386-T390 PolarHBondContact O-OG1 3.43Å; Y387-T390 PolarHBondContact O-N 3.28Å; K388-T390 VanDerWaalsContact C-N 3.28Å; K388-T390 PolarHBondContact O-N 2.89Å; T390-R393 WeakPolarHBondContact O-CB 3.1Å; T390-R393 PolarHBondContact O-N 3.09Å; T390-F394 WeakPolarHBondContact O-CB 3.49Å; T390-F394 PolarHBondContact O-N 3.36Å; T390-F528 HydrophobicContact CG2-CE2 3.84Å; T390-F528 HydrophobicContact CG2-CZ 3.7Å; T390-F531 HydrophobicContact CG2-CB 3.98Å; T390-F531 WeakPolarHBondContact CG2-O 3.03Å; T390-F533 HydrophobicContact CG2-CD1 4.24Å
391	L	93.2	Very high	92.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.1	-40.8	176	-72.1	168.8	0	0	0	112.4	L350 V362 I364 Y387 K388 R393 F394 F395 V418 F524 F528	L350-L391 HydrophobicContact CD1-CD1 3.81Å; L350-L391 HydrophobicContact CD2-CD2 4.08Å; V362-L391 HydrophobicContact CG2-CD1 4.02Å; V362-L391 HydrophobicContact CG2-CD2 3.98Å; I364-L391 HydrophobicContact CD1-CD1 3.97Å; I364-L391 HydrophobicContact CG1-CD1 3.98Å; Y387-L391 WeakPolarHBondContact O-CB 3.14Å; Y387-L391 WeakPolarHBondContact O-CG 3.48Å; Y387-L391 PolarHBondContact O-N 2.99Å; K388-L391 PolarHBondContact O-N 3.48Å; L391-R393 VanDerWaalsContact C-N 3.29Å; L391-R393 PolarHBondContact O-N 3.28Å; L391-F394 HydrophobicContact CD2-CD1 4.42Å; L391-F394 PolarHBondContact O-N 3.33Å; L391-F395 HydrophobicContact CB-CD2 4.27Å; L391-F395 HydrophobicContact CB-CE2 4.1Å; L391-F395 HydrophobicContact CD2-CE2 3.97Å; L391-F395 HydrophobicContact CD2-CZ 4.26Å; L391-F395 WeakPolarHBondContact O-CB 3.36Å; L391-F395 WeakPolarHBondContact O-CD2 3.37Å; L391-F395 PolarHBondContact O-N 3.16Å; L391-V418 HydrophobicContact CD1-CB 4.49Å; L391-V418 HydrophobicContact CD1-CG1 4.17Å; L391-V418 HydrophobicContact CD1-CG2 4.24Å; L391-F524 HydrophobicContact CD2-CZ 4.25Å; L391-F528 HydrophobicContact CD2-CD2 4.27Å; L391-F528 HydrophobicContact CD2-CE2 3.76Å; L391-F528 HydrophobicContact CG-CE2 4.41Å
392	K	91.9	Very high	92.1	Very high	52 Å²	52	48.7 Å²	48.7	23%	0.226	24%	0.238	C	C	.	.	H	α-helix	trans	-57.3	-43	171.9	-73.4	-176.6	-174.6	-170.9	0	110.9	K388 K396 C402 E469	K388-K392 WeakPolarHBondContact O-CB 3.19Å; K388-K392 WeakPolarHBondContact O-CG 3.39Å; K388-K392 PolarHBondContact O-N 3.23Å; K392-K396 WeakPolarHBondContact O-CB 3.42Å; K392-K396 PolarHBondContact O-N 2.84Å; K392-K396 VanDerWaalsContact O-N 3.08Å; K392-C402 HydrophobicContact CG-CB 3.96Å; K392-E469 WeakPolarHBondContact CE-OE1 3.09Å; K392-E469 IonicContact NZ-OE1 2.7Å; K392-E469 PolarHBondContact NZ-OE1 2.92Å
393	R	92.1	Very high	92.3	Very high	131 Å²	131	42.3 Å²	42.3	49%	0.494	21%	0.209	S	C	.	.	H	α-helix	trans	-65.3	-45.7	175.5	-171.5	174.7	67	-129.2	-2.3	112.5	A389 T390 L391 S397 F531	A389-R393 WeakPolarHBondContact O-CB 3.48Å; A389-R393 PolarHBondContact O-N 2.83Å; T390-R393 WeakPolarHBondContact O-CB 3.1Å; T390-R393 PolarHBondContact O-N 3.09Å; L391-R393 VanDerWaalsContact C-N 3.29Å; L391-R393 PolarHBondContact O-N 3.28Å; R393-S397 PolarHBondContact O-N 3.49Å; R393-S397 VanDerWaalsContact O-N 3.13Å; R393-F531 HydrophobicContact CG-CD1 4.26Å; R393-F531 HydrophobicContact CG-CE1 4.11Å
394	F	93.6	Very high	92.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-52.9	177.9	170.7	-115.1	0	0	0	112.1	T390 L391 K396 S397 R398 F524 D527 F528 F531	T390-F394 WeakPolarHBondContact O-CB 3.49Å; T390-F394 PolarHBondContact O-N 3.36Å; L391-F394 HydrophobicContact CD2-CD1 4.42Å; L391-F394 PolarHBondContact O-N 3.33Å; F394-K396 PolarHBondContact O-N 3Å; F394-S397 WeakPolarHBondContact O-CB 3.45Å; F394-S397 PolarHBondContact O-N 3.35Å; F394-S397 PolarHBondContact O-OG 3.34Å; F394-R398 VanDerWaalsContact CE2-NE 3.27Å; F394-R398 PolarHBondContact O-N 3.18Å; F394-F524 HydrophobicContact CD1-CZ 4.28Å; F394-F524 HydrophobicContact CE1-CE1 4.45Å; F394-F524 AromaticContact CE1-CE2 3.69Å; F394-F524 HydrophobicContact CE1-CE2 3.69Å; F394-F524 AromaticContact CE1-CZ 3.62Å; F394-F524 HydrophobicContact CE1-CZ 3.62Å; F394-F524 HydrophobicContact CZ-CE2 4.31Å; F394-F524 HydrophobicContact CZ-CZ 4.34Å; F394-D527 HydrophobicContact CE2-CB 4.31Å; F394-D527 VanDerWaalsContact CE2-O 3.25Å; F394-D527 WeakPolarHBondContact CE2-O 3.23Å; F394-D527 HydrophobicContact CZ-CB 4.18Å; F394-F528 HydrophobicContact CD1-CD2 4.26Å; F394-F528 HydrophobicContact CD2-CD2 4.49Å; F394-F528 HydrophobicContact CG-CD2 4.2Å; F394-F531 HydrophobicContact CB-CD1 4.2Å; F394-F531 HydrophobicContact CB-CE1 4.49Å; F394-F531 HydrophobicContact CB-CG 4.24Å; F394-F531 AromaticContact CD2-CD2 3.75Å; F394-F531 HydrophobicContact CD2-CD2 3.75Å; F394-F531 AromaticContact CD2-CE2 3.81Å; F394-F531 HydrophobicContact CD2-CE2 3.81Å; F394-F531 HydrophobicContact CD2-CG 4.3Å; F394-F531 HydrophobicContact CD2-CZ 4.39Å
395	F	92.9	Very high	92.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-36.1	-179	-67	-48.2	0	0	0	113.1	D360 V362 L391 S397 R398 G399 K400 C402 V418 P420 F524	D360-F395 HydrophobicContact CB-CE1 3.9Å; D360-F395 HydrophobicContact CB-CZ 4.45Å; V362-F395 HydrophobicContact CG2-CE2 4.46Å; V362-F395 HydrophobicContact CG2-CZ 4.25Å; L391-F395 HydrophobicContact CB-CD2 4.27Å; L391-F395 HydrophobicContact CB-CE2 4.1Å; L391-F395 HydrophobicContact CD2-CE2 3.97Å; L391-F395 HydrophobicContact CD2-CZ 4.26Å; L391-F395 WeakPolarHBondContact O-CB 3.36Å; L391-F395 WeakPolarHBondContact O-CD2 3.37Å; L391-F395 PolarHBondContact O-N 3.16Å; F395-S397 VanDerWaalsContact C-N 3.28Å; F395-S397 PolarHBondContact O-N 2.8Å; F395-R398 CarbonylContact O-C 3.48Å; F395-R398 WeakPolarHBondContact O-CA 3.41Å; F395-R398 PolarHBondContact O-N 2.87Å; F395-G399 PolarHBondContact O-N 2.96Å; F395-K400 CarbonylContact C-O 3.53Å; F395-K400 HydrophobicContact CB-CB 4.24Å; F395-K400 PolarHBondContact O-N 3.3Å; F395-K400 VanDerWaalsContact O-O 3.07Å; F395-C402 HydrophobicContact CB-CB 4.49Å; F395-C402 HydrophobicContact CD2-CB 4.15Å; F395-V418 HydrophobicContact CE2-CG1 3.92Å; F395-P420 HydrophobicContact CB-CB 4.42Å; F395-P420 HydrophobicContact CD1-CB 3.54Å; F395-P420 HydrophobicContact CD1-CG 4.07Å; F395-P420 HydrophobicContact CD2-CB 4.06Å; F395-P420 HydrophobicContact CE1-CB 3.7Å; F395-P420 HydrophobicContact CE1-CG 3.7Å; F395-P420 HydrophobicContact CE2-CB 4.18Å; F395-P420 HydrophobicContact CE2-CG 4.4Å; F395-P420 HydrophobicContact CG-CB 3.75Å; F395-P420 HydrophobicContact CZ-CB 4.02Å; F395-P420 HydrophobicContact CZ-CG 3.87Å; F395-F524 HydrophobicContact CE1-CE2 4.28Å; F395-F524 HydrophobicContact CZ-CE2 4.19Å; F395-F524 HydrophobicContact CZ-CZ 4.32Å
396	K	91.2	Very high	92.5	Very high	173 Å²	173	38 Å²	38	75%	0.752	19%	0.188	S	C	*	.	H	α-helix	trans	-60.2	-37.2	172.4	-172.3	168	-175.1	167.8	0	112.2	K392 F394 R398 G399 K400	K392-K396 WeakPolarHBondContact O-CB 3.42Å; K392-K396 PolarHBondContact O-N 2.84Å; K392-K396 VanDerWaalsContact O-N 3.08Å; F394-K396 PolarHBondContact O-N 3Å; K396-R398 PolarHBondContact O-N 2.82Å; K396-G399 PolarHBondContact O-N 3.48Å; K396-K400 PolarHBondContact N-O 3.41Å
397	S	92.3	Very high	92.5	Very high	76 Å²	76	35.1 Å²	35.1	53%	0.531	18%	0.175	S	C	.	.	H	α-helix	trans	-65.4	-21.1	173.9	82.3	0	0	0	0	113.7	R393 F394 F395	R393-S397 PolarHBondContact O-N 3.49Å; R393-S397 VanDerWaalsContact O-N 3.13Å; F394-S397 WeakPolarHBondContact O-CB 3.45Å; F394-S397 PolarHBondContact O-N 3.35Å; F394-S397 PolarHBondContact O-OG 3.34Å; F395-S397 VanDerWaalsContact C-N 3.28Å; F395-S397 PolarHBondContact O-N 2.8Å
398	R	90.4	Very high	92.3	Very high	88 Å²	88	35.2 Å²	35.2	33%	0.332	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	8.3	-179.9	-65.8	-175.3	164.5	-136.1	-20.8	113.9	F394 F395 K396 K400 D527	F394-R398 VanDerWaalsContact CE2-NE 3.27Å; F394-R398 PolarHBondContact O-N 3.18Å; F395-R398 CarbonylContact O-C 3.48Å; F395-R398 WeakPolarHBondContact O-CA 3.41Å; F395-R398 PolarHBondContact O-N 2.87Å; K396-R398 PolarHBondContact O-N 2.82Å; R398-K400 VanDerWaalsContact C-N 3.35Å; R398-D527 VanDerWaalsContact CZ-CG 3.5Å; R398-D527 IonicContact CZ-OD1 3.15Å; R398-D527 IonicContact CZ-OD2 2.66Å; R398-D527 VanDerWaalsContact NH1-CG 3.31Å; R398-D527 IonicContact NH1-OD1 2.81Å; R398-D527 IonicContact NH1-OD2 3.65Å; R398-D527 PolarHBondContact NH1-OD2 3.07Å; R398-D527 IonicContact NH2-OD1 3.91Å; R398-D527 PolarHBondContact NH2-OD1 2.67Å; R398-D527 IonicContact NH2-OD2 3.78Å; R398-D527 PolarHBondContact NH2-OD2 3.28Å; R398-D527 VanDerWaalsContact NH2-OD2 3.16Å
399	G	90.4	Very high	91.9	Very high	31 Å²	31	36.1 Å²	36.1	32%	0.32	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	33.1	-177.4	0	0	0	0	0	113.7	F395 K396 L423	F395-G399 PolarHBondContact O-N 2.96Å; K396-G399 PolarHBondContact O-N 3.48Å; G399-L423 WeakPolarHBondContact O-CB 3.41Å; G399-L423 VanDerWaalsContact O-CG 3.28Å; G399-L423 WeakPolarHBondContact O-CG 3.34Å; G399-L423 PolarHBondContact O-N 3.19Å
400	K	92.4	Very high	91.3	Very high	51 Å²	51	41.5 Å²	41.5	22%	0.222	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	136.6	176.9	-53.4	-173	-176.5	-175.5	0	110.5	D360 F395 K396 R398 P420 V421	D360-K400 IonicContact OD2-NZ 2.65Å; D360-K400 PolarHBondContact OD2-NZ 3.17Å; F395-K400 CarbonylContact C-O 3.53Å; F395-K400 HydrophobicContact CB-CB 4.24Å; F395-K400 PolarHBondContact O-N 3.3Å; F395-K400 VanDerWaalsContact O-O 3.07Å; K396-K400 PolarHBondContact N-O 3.41Å; R398-K400 VanDerWaalsContact C-N 3.35Å; K400-P420 HydrophobicContact CB-CB 4.01Å; K400-P420 HydrophobicContact CD-CB 3.84Å; K400-P420 HydrophobicContact CD-CG 4.43Å; K400-V421 CarbonylContact C-O 3.58Å; K400-V421 VanDerWaalsContact CA-O 3.3Å; K400-V421 WeakPolarHBondContact CA-O 3.27Å
401	R	90.4	Very high	90.6	Very high	24 Å²	24	41.8 Å²	41.8	9%	0.091	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	157.3	165.2	-56.7	-167.5	-171.4	79.5	5.3	109.4	P420 V421 L423 C426 T428 D471	R401-P420 CarbonylContact O-C 3.55Å; R401-P420 VanDerWaalsContact O-CA 3.23Å; R401-P420 WeakPolarHBondContact O-CA 3.21Å; R401-V421 PolarHBondContact N-O 3.01Å; R401-V421 PolarHBondContact O-N 2.83Å; R401-L423 HydrophobicContact CG-CD2 3.73Å; R401-L423 PolarHBondContact NH2-O 3.34Å; R401-C426 PolarHBondContact NH1-O 3Å; R401-C426 PolarHBondContact NH2-O 3.26Å; R401-T428 WeakPolarHBondContact CD-OG1 3.15Å; R401-T428 PolarHBondContact NE-OG1 3.47Å; R401-D471 HydrophobicContact CB-CB 4.22Å; R401-D471 WeakPolarHBondContact CD-OD2 3.16Å; R401-D471 VanDerWaalsContact CG-OD2 3.26Å; R401-D471 WeakPolarHBondContact CG-OD2 3.38Å
402	C	91.8	Very high	89.9	Confident	2 Å²	2	47 Å²	47	1%	0.014	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	102	-177.6	178.5	0	0	0	0	109.2	K392 F395 V418	K392-C402 HydrophobicContact CG-CB 3.96Å; F395-C402 HydrophobicContact CB-CB 4.49Å; F395-C402 HydrophobicContact CD2-CB 4.15Å; C402-V418 WeakPolarHBondContact SG-CG1 3.47Å
403	V	93.6	Very high	89.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	129.8	172.6	-175.7	0	0	0	0	108.3	I419 V421 I431 F435 V468 L470 L493	V403-I419 PolarHBondContact N-O 3.31Å; V403-I419 VanDerWaalsContact N-O 3.08Å; V403-I419 PolarHBondContact O-N 3.42Å; V403-V421 HydrophobicContact CG2-CG2 4.08Å; V403-I431 HydrophobicContact CG2-CD1 3.97Å; V403-I431 HydrophobicContact CG2-CG2 4.15Å; V403-F435 HydrophobicContact CG1-CE2 4.41Å; V403-V468 HydrophobicContact CG1-CG2 3.74Å; V403-L470 HydrophobicContact CG1-CD2 4.34Å; V403-L493 HydrophobicContact CB-CD1 4.32Å; V403-L493 HydrophobicContact CG1-CD1 4.03Å; V403-L493 HydrophobicContact CG1-CD2 4.3Å; V403-L493 HydrophobicContact CG2-CD2 4.35Å
404	L	94.3	Very high	89.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.3	176.6	-50.6	88.3	0	0	0	109.7	K388 L416 Q417 V418 V468 E469	K388-L404 HydrophobicContact CB-CD2 4.25Å; K388-L404 HydrophobicContact CD-CD2 3.85Å; K388-L404 HydrophobicContact CG-CD2 3.6Å; L404-L416 HydrophobicContact CB-CD1 4.17Å; L404-L416 HydrophobicContact CD2-CD2 4.41Å; L404-Q417 CarbonylContact C-O 3.14Å; L404-Q417 VanDerWaalsContact CA-O 3.25Å; L404-Q417 WeakPolarHBondContact CA-O 3.38Å; L404-V418 HydrophobicContact CD2-CG1 4.48Å; L404-V418 HydrophobicContact CD2-CG2 3.92Å; L404-V418 HydrophobicContact CG-CG1 4.24Å; L404-V418 HydrophobicContact CG-CG2 4.17Å; L404-V468 CarbonylContact O-C 3.58Å; L404-V468 VanDerWaalsContact O-CA 3.32Å; L404-V468 WeakPolarHBondContact O-CA 3.37Å; L404-V468 WeakPolarHBondContact O-CG2 3.43Å; L404-E469 HydrophobicContact CB-CB 4.27Å; L404-E469 HydrophobicContact CD1-CB 4.4Å; L404-E469 PolarHBondContact N-O 2.62Å; L404-E469 PolarHBondContact O-N 2.78Å
405	F	94.4	Very high	89.2	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.018	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.4	170.4	74.2	-110.1	0	0	0	113.8	Q417 I419 F466 Y467 V468 G489 R490 L493	F405-Q417 HydrophobicContact CD1-CB 4.49Å; F405-Q417 HydrophobicContact CD2-CB 4.27Å; F405-Q417 HydrophobicContact CD2-CG 4.41Å; F405-Q417 HydrophobicContact CE1-CB 4.2Å; F405-Q417 HydrophobicContact CE2-CB 3.93Å; F405-Q417 HydrophobicContact CE2-CG 3.82Å; F405-Q417 HydrophobicContact CZ-CB 3.88Å; F405-Q417 HydrophobicContact CZ-CG 4.05Å; F405-Q417 PolarHBondContact N-O 3.45Å; F405-Q417 PolarHBondContact O-N 2.87Å; F405-I419 HydrophobicContact CD1-CD1 4.18Å; F405-I419 HydrophobicContact CE1-CD1 3.5Å; F405-I419 VanDerWaalsContact CE1-CD1 3.5Å; F405-I419 HydrophobicContact CZ-CD1 4.35Å; F405-F466 HydrophobicContact CB-CE2 4.07Å; F405-F466 HydrophobicContact CB-CZ 4.04Å; F405-F466 AromaticContact CD2-CE2 3.83Å; F405-F466 HydrophobicContact CD2-CE2 3.83Å; F405-F466 HydrophobicContact CD2-CZ 4.48Å; F405-F466 HydrophobicContact CG-CE2 4.09Å; F405-F466 HydrophobicContact CG-CZ 4.3Å; F405-Y467 CarbonylContact C-O 3.46Å; F405-Y467 WeakPolarHBondContact CA-O 3.39Å; F405-Y467 VanDerWaalsContact CB-O 3.29Å; F405-Y467 WeakPolarHBondContact CB-O 3.47Å; F405-V468 HydrophobicContact CB-CB 4.07Å; F405-V468 HydrophobicContact CB-CG2 4.28Å; F405-G489 VanDerWaalsContact CE1-C 3.42Å; F405-G489 WeakPolarHBondContact CE1-O 3.26Å; F405-R490 HydrophobicContact CZ-CG 4.12Å; F405-L493 HydrophobicContact CD1-CD1 4.26Å; F405-L493 HydrophobicContact CE1-CD1 4.29Å
406	E	92.9	Very high	89.2	Confident	3 Å²	3	39.5 Å²	39.5	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	135.5	172.8	-169.6	-169.6	175.7	0	0	109.8	S372 V373 L414 L416 Y465 F466 Y467	S372-E406 WeakPolarHBondContact CA-OE1 3.22Å; S372-E406 WeakPolarHBondContact CB-OE1 3.44Å; V373-E406 WeakPolarHBondContact CB-OE2 3.33Å; V373-E406 VanDerWaalsContact CG2-OE2 3.23Å; V373-E406 WeakPolarHBondContact CG2-OE2 3.25Å; V373-E406 PolarHBondContact N-OE1 3.19Å; E406-L414 HydrophobicContact CG-CD1 3.88Å; E406-L414 WeakPolarHBondContact OE1-CD1 3.36Å; E406-L416 HydrophobicContact CB-CD1 4.38Å; E406-Y465 HydrophobicContact CG-CE2 4.33Å; E406-Y465 PolarHBondContact OE1-OH 2.88Å; E406-Y465 WeakPolarHBondContact OE2-CE2 3.4Å; E406-Y465 VanDerWaalsContact OE2-CZ 3.31Å; E406-Y465 PolarHBondContact OE2-OH 3.18Å; E406-F466 WeakPolarHBondContact O-CA 3.14Å; E406-F466 WeakPolarHBondContact O-CD2 3.5Å; E406-Y467 HydrophobicContact CB-CD1 4.36Å; E406-Y467 PolarHBondContact N-O 3.26Å; E406-Y467 PolarHBondContact O-N 2.94Å
407	R	91.8	Very high	89.4	Confident	30 Å²	30	32.1 Å²	32.1	11%	0.113	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	83.7	173	-171.6	-160	67.9	-112.5	-19.9	110	Y409 F466 F484 L486	R407-Y409 PolarHBondContact NE-O 2.7Å; R407-Y409 PolarHBondContact O-N 3.15Å; R407-F466 HydrophobicContact CB-CD2 4.15Å; R407-F466 HydrophobicContact CG-CD2 4.37Å; R407-F484 HydrophobicContact CG-CD1 4.25Å; R407-F484 HydrophobicContact CG-CE1 4.06Å; R407-L486 VanDerWaalsContact CD-O 3.31Å; R407-L486 WeakPolarHBondContact CD-O 3.36Å; R407-L486 PolarHBondContact NH1-O 2.75Å
408	N	89.3	Confident	89.5	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.011	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	66.1	169.5	-175.4	18.4	0	0	0	110.6	Q371 S372 A463 A464 Y465	Q371-N408 PolarHBondContact NE2-OD1 3.39Å; S372-N408 WeakPolarHBondContact CB-ND2 3.48Å; N408-A463 PolarHBondContact ND2-O 2.92Å; N408-A464 CarbonylContact O-C 3.57Å; N408-A464 WeakPolarHBondContact O-CA 3.04Å; N408-A464 WeakPolarHBondContact O-CB 3.06Å; N408-Y465 CarbonylContact C-O 3.56Å; N408-Y465 WeakPolarHBondContact CA-O 3.38Å; N408-Y465 HydrophobicContact CB-CD1 3.91Å; N408-Y465 HydrophobicContact CB-CD2 4.26Å; N408-Y465 HydrophobicContact CB-CE1 3.84Å; N408-Y465 HydrophobicContact CB-CE2 4.19Å; N408-Y465 HydrophobicContact CB-CG 4.13Å; N408-Y465 PolarHBondContact N-O 2.83Å; N408-Y465 WeakPolarHBondContact ND2-CE1 3.13Å; N408-Y465 PolarHBondContact O-N 2.96Å
409	Y	84.4	Confident	89.6	Confident	29 Å²	29	24.3 Å²	24.3	11%	0.114	11%	0.112	C	C	.	.	S	Bend	trans	-151.8	120.9	172.1	179.6	-108.4	0	0	0	110.1	R407 S411 A464 I480 F484 L486	R407-Y409 PolarHBondContact NE-O 2.7Å; R407-Y409 PolarHBondContact O-N 3.15Å; Y409-S411 PolarHBondContact O-N 2.97Å; Y409-S411 VanDerWaalsContact O-N 3.12Å; Y409-A464 HydrophobicContact CD2-CB 4.06Å; Y409-I480 HydrophobicContact CD2-CD1 4.47Å; Y409-I480 HydrophobicContact CD2-CG2 3.68Å; Y409-I480 HydrophobicContact CE2-CG2 3.85Å; Y409-I480 HydrophobicContact CG-CD1 4.06Å; Y409-I480 HydrophobicContact CG-CG2 4.2Å; Y409-F484 HydrophobicContact CD1-CB 3.83Å; Y409-F484 HydrophobicContact CE1-CB 3.95Å; Y409-F484 WeakPolarHBondContact CE1-O 3.13Å; Y409-F484 HydrophobicContact CG-CB 4.26Å; Y409-L486 HydrophobicContact CD1-CD2 3.99Å; Y409-L486 HydrophobicContact CE1-CD2 4.34Å
410	R	79.9	Confident	89.7	Confident	169 Å²	169	22.9 Å²	22.9	64%	0.638	10%	0.097	S	C	*	.	S	Bend	trans	50.6	29.5	-173.9	-57.2	-178.2	-179.2	169.4	3.3	113.5	L486	R410-L486 HydrophobicContact CB-CD2 4.27Å
411	S	78.8	Confident	89.7	Confident	13 Å²	13	20.4 Å²	20.4	9%	0.091	9%	0.087	C	C	.	.			trans	-98.2	153.6	163.8	-157.9	0	0	0	0	109.3	Q371 Y409 H413	Q371-S411 WeakPolarHBondContact CG-O 3.49Å; Y409-S411 PolarHBondContact O-N 2.97Å; Y409-S411 VanDerWaalsContact O-N 3.12Å; S411-H413 PolarHBondContact OG-O 2.88Å
412	H	78.2	Confident	89.7	Confident	109 Å²	109	21.1 Å²	21.1	51%	0.505	9%	0.094	S	C	.	.	S	Bend	trans	-107.5	-17.3	170.9	-64	-53.9	0	0	0	112.6	H369	H369-H412 PolarHBondContact CE1-O 2.84Å; H369-H412 PolarHBondContact NE2-O 2.93Å
413	H	84.2	Confident	89.6	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	12%	0.117	C	C	.	.	S	Bend	trans	-131.2	144.9	179.9	-151.2	112.9	0	0	0	109.3	C327 F329 P366 G368 H369 Y370 S411 Q415	C327-H413 PolarHBondContact SG-ND1 3.09Å; C327-H413 VanDerWaalsContact SG-ND1 3.38Å; F329-H413 HydrophobicContact CB-CB 3.87Å; F329-H413 HydrophobicContact CD2-CB 4.17Å; F329-H413 HydrophobicContact CG-CB 4.45Å; F329-H413 PolarHBondContact O-CE1 3.23Å; F329-H413 VanDerWaalsContact O-CE1 3.22Å; F329-H413 PolarHBondContact O-NE2 3.13Å; P366-H413 PolarHBondContact O-NE2 3.43Å; G368-H413 PolarHBondContact O-NE2 3.03Å; H369-H413 AromaticContact CD2-ND1 3.55Å; Y370-H413 CarbonylContact O-C 3.58Å; Y370-H413 WeakPolarHBondContact O-CA 3.48Å; S411-H413 PolarHBondContact OG-O 2.88Å; H413-Q415 PolarHBondContact O-N 3.39Å
414	L	89	Confident	89.3	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.016	15%	0.154	C	C	.	.			trans	-64	116.2	172.4	166.5	57.7	0	0	0	109.8	P366 Y370 Q371 V373 L376 E406 L416	P366-L414 WeakPolarHBondContact CD-O 3.22Å; P366-L414 HydrophobicContact CG-CB 3.94Å; P366-L414 HydrophobicContact CG-CD2 4.13Å; P366-L414 HydrophobicContact CG-CG 4.33Å; Y370-L414 PolarHBondContact O-N 2.82Å; Q371-L414 PolarHBondContact O-N 2.86Å; V373-L414 HydrophobicContact CG2-CD1 3.71Å; V373-L414 HydrophobicContact CG2-CD2 3.87Å; V373-L414 HydrophobicContact CG2-CG 4.47Å; L376-L414 HydrophobicContact CD1-CD2 3.75Å; L376-L414 HydrophobicContact CD2-CD2 4.02Å; L376-L414 HydrophobicContact CG-CD2 4.14Å; E406-L414 HydrophobicContact CG-CD1 3.88Å; E406-L414 WeakPolarHBondContact OE1-CD1 3.36Å; L414-L416 HydrophobicContact CD1-CB 4.42Å
415	Q	90.2	Very high	88.8	Confident	19 Å²	19	33.8 Å²	33.8	9%	0.089	17%	0.174	C	C	.	.			trans	-124.1	89.1	173.4	44.4	128.6	98.6	0	0	109.2	L365 H413 Q417	L365-Q415 HydrophobicContact CD2-CB 4.22Å; H413-Q415 PolarHBondContact O-N 3.39Å; Q415-Q417 VanDerWaalsContact NE2-NE2 3.16Å; Q415-Q417 PolarHBondContact O-N 3.35Å
416	L	93.6	Very high	88.4	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	105.4	172	177.9	62.6	0	0	0	107.8	L363 I364 V384 K388 L404 E406 L414	L363-L416 WeakPolarHBondContact CA-O 3.35Å; I364-L416 HydrophobicContact CB-CB 4.3Å; I364-L416 HydrophobicContact CB-CD2 4.32Å; I364-L416 HydrophobicContact CD1-CD2 3.9Å; I364-L416 PolarHBondContact N-O 3.05Å; I364-L416 PolarHBondContact O-N 2.89Å; V384-L416 HydrophobicContact CG1-CD2 3.95Å; K388-L416 HydrophobicContact CG-CD2 4.36Å; L404-L416 HydrophobicContact CB-CD1 4.17Å; L404-L416 HydrophobicContact CD2-CD2 4.41Å; E406-L416 HydrophobicContact CB-CD1 4.38Å; L414-L416 HydrophobicContact CD1-CB 4.42Å
417	Q	94.3	Very high	88.1	Confident	18 Å²	18	37.2 Å²	37.2	8%	0.084	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	134	-174.5	-54.7	-129.1	-31.4	0	0	109.4	H361 L363 L404 F405 Q415	H361-Q417 PolarHBondContact CE1-OE1 3.48Å; H361-Q417 VanDerWaalsContact CE1-OE1 3.29Å; H361-Q417 PolarHBondContact NE2-OE1 3.3Å; L363-Q417 HydrophobicContact CD2-CB 3.98Å; L363-Q417 VanDerWaalsContact CD2-CD 3.46Å; L363-Q417 HydrophobicContact CD2-CG 3.64Å; L404-Q417 CarbonylContact C-O 3.14Å; L404-Q417 VanDerWaalsContact CA-O 3.25Å; L404-Q417 WeakPolarHBondContact CA-O 3.38Å; F405-Q417 HydrophobicContact CD1-CB 4.49Å; F405-Q417 HydrophobicContact CD2-CB 4.27Å; F405-Q417 HydrophobicContact CD2-CG 4.41Å; F405-Q417 HydrophobicContact CE1-CB 4.2Å; F405-Q417 HydrophobicContact CE2-CB 3.93Å; F405-Q417 HydrophobicContact CE2-CG 3.82Å; F405-Q417 HydrophobicContact CZ-CB 3.88Å; F405-Q417 HydrophobicContact CZ-CG 4.05Å; F405-Q417 PolarHBondContact N-O 3.45Å; F405-Q417 PolarHBondContact O-N 2.87Å; Q415-Q417 VanDerWaalsContact NE2-NE2 3.16Å; Q415-Q417 PolarHBondContact O-N 3.35Å
418	V	94.9	Very high	87.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	104.2	-173.5	-174.1	0	0	0	0	109.4	H361 V362 I364 L391 F395 C402 L404	H361-V418 PolarHBondContact CD2-O 2.62Å; H361-V418 VanDerWaalsContact CD2-O 3.28Å; V362-V418 HydrophobicContact CG2-CB 4.04Å; V362-V418 HydrophobicContact CG2-CG1 4.4Å; V362-V418 PolarHBondContact N-O 2.81Å; V362-V418 WeakPolarHBondContact O-CB 3.48Å; V362-V418 PolarHBondContact O-N 3.14Å; I364-V418 HydrophobicContact CD1-CG2 3.98Å; I364-V418 HydrophobicContact CG1-CG2 4.1Å; L391-V418 HydrophobicContact CD1-CB 4.49Å; L391-V418 HydrophobicContact CD1-CG1 4.17Å; L391-V418 HydrophobicContact CD1-CG2 4.24Å; F395-V418 HydrophobicContact CE2-CG1 3.92Å; C402-V418 WeakPolarHBondContact SG-CG1 3.47Å; L404-V418 HydrophobicContact CD2-CG1 4.48Å; L404-V418 HydrophobicContact CD2-CG2 3.92Å; L404-V418 HydrophobicContact CG-CG1 4.24Å; L404-V418 HydrophobicContact CG-CG2 4.17Å
419	I	93.9	Very high	87.7	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	116.1	-172	-67.5	155	0	0	0	109.4	L357 H361 V403 F405 V421 L493 L499	L357-I419 HydrophobicContact CD1-CD1 4.03Å; L357-I419 HydrophobicContact CD1-CG2 4.48Å; H361-I419 VanDerWaalsContact CD2-CG1 3.47Å; H361-I419 WeakPolarHBondContact CD2-CG1 3.32Å; H361-I419 WeakPolarHBondContact NE2-CG1 3.48Å; V403-I419 PolarHBondContact N-O 3.31Å; V403-I419 VanDerWaalsContact N-O 3.08Å; V403-I419 PolarHBondContact O-N 3.42Å; F405-I419 HydrophobicContact CD1-CD1 4.18Å; F405-I419 HydrophobicContact CE1-CD1 3.5Å; F405-I419 VanDerWaalsContact CE1-CD1 3.5Å; F405-I419 HydrophobicContact CZ-CD1 4.35Å; I419-V421 HydrophobicContact CG2-CG2 4.33Å; I419-V421 PolarHBondContact O-N 3.23Å; I419-L493 HydrophobicContact CB-CD1 4.08Å; I419-L493 HydrophobicContact CD1-CD1 3.51Å; I419-L493 HydrophobicContact CG1-CD1 4.41Å; I419-L493 HydrophobicContact CG2-CD1 4.14Å; I419-L499 HydrophobicContact CG2-CD1 4.46Å
420	P	92.4	Very high	87.9	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	114.4	176.8	31.5	-32.3	0	0	0	111.7	D360 F395 K400 R401	D360-P420 HydrophobicContact CB-CG 3.55Å; F395-P420 HydrophobicContact CB-CB 4.42Å; F395-P420 HydrophobicContact CD1-CB 3.54Å; F395-P420 HydrophobicContact CD1-CG 4.07Å; F395-P420 HydrophobicContact CD2-CB 4.06Å; F395-P420 HydrophobicContact CE1-CB 3.7Å; F395-P420 HydrophobicContact CE1-CG 3.7Å; F395-P420 HydrophobicContact CE2-CB 4.18Å; F395-P420 HydrophobicContact CE2-CG 4.4Å; F395-P420 HydrophobicContact CG-CB 3.75Å; F395-P420 HydrophobicContact CZ-CB 4.02Å; F395-P420 HydrophobicContact CZ-CG 3.87Å; K400-P420 HydrophobicContact CB-CB 4.01Å; K400-P420 HydrophobicContact CD-CB 3.84Å; K400-P420 HydrophobicContact CD-CG 4.43Å; R401-P420 CarbonylContact O-C 3.55Å; R401-P420 VanDerWaalsContact O-CA 3.23Å; R401-P420 WeakPolarHBondContact O-CA 3.21Å
421	V	91.6	Very high	88.4	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124.9	179.9	179.7	0	0	0	0	109.3	K400 R401 V403 I419 C425 L493 I498 L499	K400-V421 CarbonylContact C-O 3.58Å; K400-V421 VanDerWaalsContact CA-O 3.3Å; K400-V421 WeakPolarHBondContact CA-O 3.27Å; R401-V421 PolarHBondContact N-O 3.01Å; R401-V421 PolarHBondContact O-N 2.83Å; V403-V421 HydrophobicContact CG2-CG2 4.08Å; I419-V421 HydrophobicContact CG2-CG2 4.33Å; I419-V421 PolarHBondContact O-N 3.23Å; V421-C425 HydrophobicContact CG1-CB 4.49Å; V421-L493 HydrophobicContact CG2-CD2 4.48Å; V421-I498 HydrophobicContact CG1-CG2 4.07Å; V421-I498 HydrophobicContact CG2-CG2 4.31Å; V421-L499 HydrophobicContact CB-CD2 4.49Å; V421-L499 HydrophobicContact CG1-CD2 4.01Å; V421-L499 HydrophobicContact CG2-CD2 4.45Å
422	P	91.3	Very high	88.9	Confident	38 Å²	38	35.7 Å²	35.7	25%	0.247	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	140.7	179.8	-22.2	33.1	0	0	0	112.9	S424 C425	P422-S424 PolarHBondContact O-N 3.36Å; P422-C425 PolarHBondContact O-N 3.38Å; P422-C425 VanDerWaalsContact O-N 3.16Å
423	L	88.6	Confident	89.5	Confident	94 Å²	94	35 Å²	35	49%	0.492	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-23.8	178.2	-77.1	171.5	0	0	0	113.5	G399 R401	G399-L423 WeakPolarHBondContact O-CB 3.41Å; G399-L423 VanDerWaalsContact O-CG 3.28Å; G399-L423 WeakPolarHBondContact O-CG 3.34Å; G399-L423 PolarHBondContact O-N 3.19Å; R401-L423 HydrophobicContact CG-CD2 3.73Å; R401-L423 PolarHBondContact NH2-O 3.34Å
424	S	87.3	Confident	89.8	Confident	112 Å²	112	35.7 Å²	35.7	78%	0.783	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.1	-177.5	55.9	0	0	0	0	115.5	P422	P422-S424 PolarHBondContact O-N 3.36Å
425	C	84.6	Confident	90	Very high	62 Å²	62	35.5 Å²	35.5	42%	0.419	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-36	-173	-66.8	0	0	0	0	113.5	V421 P422 I498	V421-C425 HydrophobicContact CG1-CB 4.49Å; P422-C425 PolarHBondContact O-N 3.38Å; P422-C425 VanDerWaalsContact O-N 3.16Å; C425-I498 VanDerWaalsContact CB-O 3.28Å; C425-I498 WeakPolarHBondContact CB-O 3.48Å
426	C	84.6	Confident	90	Very high	11 Å²	11	36.5 Å²	36.5	7%	0.074	21%	0.213	C	C	.	.			trans	-163.7	-179.7	-171.3	55.6	0	0	0	0	109.9	R401 D430 I498	R401-C426 PolarHBondContact NH1-O 3Å; R401-C426 PolarHBondContact NH2-O 3.26Å; C426-D430 WeakPolarHBondContact CA-OD2 3.43Å; C426-D430 HydrophobicContact CB-CB 3.94Å; C426-D430 WeakPolarHBondContact CB-OD2 3.37Å; C426-I498 HydrophobicContact CB-CD1 4.48Å
427	V	87.6	Confident	89.9	Confident	68 Å²	68	40.1 Å²	40.1	41%	0.412	24%	0.235	S	C	.	.			trans	-104	173.8	160.2	-60.6	0	0	0	0	111.7	D429 D430 I431	V427-D429 VanDerWaalsContact C-N 3.31Å; V427-D429 HydrophobicContact CG2-CB 4.12Å; V427-D430 HydrophobicContact CG2-CB 4.41Å; V427-D430 WeakPolarHBondContact CG2-OD1 3.32Å; V427-D430 WeakPolarHBondContact CG2-OD2 3.37Å; V427-D430 PolarHBondContact N-OD2 3.34Å; V427-D430 PolarHBondContact O-N 3.28Å; V427-I431 PolarHBondContact O-N 2.85Å
428	T	85.5	Confident	89.6	Confident	16 Å²	16	41.3 Å²	41.3	10%	0.098	24%	0.241	C	C	.	.	H	α-helix	trans	-68	-33.2	-179.6	-52	0	0	0	0	112	R401 I431 K432 L470 D471 T472	R401-T428 WeakPolarHBondContact CD-OG1 3.15Å; R401-T428 PolarHBondContact NE-OG1 3.47Å; T428-I431 WeakPolarHBondContact O-CB 3.27Å; T428-I431 PolarHBondContact O-N 2.87Å; T428-K432 PolarHBondContact O-N 2.81Å; T428-L470 HydrophobicContact CG2-CB 3.88Å; T428-L470 HydrophobicContact CG2-CD1 3.89Å; T428-L470 HydrophobicContact CG2-CG 4.4Å; T428-D471 VanDerWaalsContact CG2-OD1 3.22Å; T428-D471 WeakPolarHBondContact CG2-OD1 3.33Å; T428-D471 PolarHBondContact OG1-OD1 3.31Å; T428-T472 HydrophobicContact CG2-CG2 3.77Å
429	D	87	Confident	89.4	Confident	97 Å²	97	41.4 Å²	41.4	52%	0.519	24%	0.241	S	C	.	.	H	α-helix	trans	-62.5	-43.1	174.9	-52.3	-44.1	0	0	0	111.4	V427 I431 K432 D433	V427-D429 VanDerWaalsContact C-N 3.31Å; V427-D429 HydrophobicContact CG2-CB 4.12Å; D429-I431 PolarHBondContact O-N 3.09Å; D429-K432 CarbonylContact O-C 3.59Å; D429-K432 WeakPolarHBondContact O-CA 3.39Å; D429-K432 WeakPolarHBondContact O-CB 3.46Å; D429-K432 PolarHBondContact O-N 3.32Å; D429-D433 PolarHBondContact O-N 3.32Å
430	D	88.6	Confident	89.1	Confident	72 Å²	72	48 Å²	48	39%	0.385	27%	0.272	S	S	.	.	H	α-helix	trans	-57.6	-37.4	174.4	-54.4	-25.1	0	0	0	112.1	C426 V427 A434 I498	C426-D430 WeakPolarHBondContact CA-OD2 3.43Å; C426-D430 HydrophobicContact CB-CB 3.94Å; C426-D430 WeakPolarHBondContact CB-OD2 3.37Å; V427-D430 HydrophobicContact CG2-CB 4.41Å; V427-D430 WeakPolarHBondContact CG2-OD1 3.32Å; V427-D430 WeakPolarHBondContact CG2-OD2 3.37Å; V427-D430 PolarHBondContact N-OD2 3.34Å; V427-D430 PolarHBondContact O-N 3.28Å; D430-A434 WeakPolarHBondContact O-CB 3.35Å; D430-A434 PolarHBondContact O-N 3.29Å; D430-I498 HydrophobicContact CB-CD1 4.47Å
431	I	89.7	Confident	88.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-44.1	176.6	-60	166.9	0	0	0	109.7	V403 V427 T428 D429 A434 F435 L470 L493 I498	V403-I431 HydrophobicContact CG2-CD1 3.97Å; V403-I431 HydrophobicContact CG2-CG2 4.15Å; V427-I431 PolarHBondContact O-N 2.85Å; T428-I431 WeakPolarHBondContact O-CB 3.27Å; T428-I431 PolarHBondContact O-N 2.87Å; D429-I431 PolarHBondContact O-N 3.09Å; I431-A434 PolarHBondContact O-N 2.81Å; I431-F435 HydrophobicContact CG2-CD2 3.96Å; I431-F435 HydrophobicContact CG2-CE2 3.98Å; I431-F435 VanDerWaalsContact O-CD2 3.28Å; I431-F435 WeakPolarHBondContact O-CD2 3.3Å; I431-F435 PolarHBondContact O-N 2.92Å; I431-L470 HydrophobicContact CG2-CD2 3.77Å; I431-L493 HydrophobicContact CG2-CD2 4.2Å; I431-I498 HydrophobicContact CB-CD1 4.38Å; I431-I498 HydrophobicContact CG1-CD1 3.94Å; I431-I498 HydrophobicContact CG1-CG2 4.25Å
432	K	90.9	Very high	88.6	Confident	27 Å²	27	58.5 Å²	58.5	12%	0.117	32%	0.322	C	S	.	.	H	α-helix	trans	-61.5	-48.6	177	-168.8	-179.4	-179.1	175.9	0	111.2	T428 D429 F435 I436 E448 L470 E474 L476	T428-K432 PolarHBondContact O-N 2.81Å; D429-K432 CarbonylContact O-C 3.59Å; D429-K432 WeakPolarHBondContact O-CA 3.39Å; D429-K432 WeakPolarHBondContact O-CB 3.46Å; D429-K432 PolarHBondContact O-N 3.32Å; K432-F435 WeakPolarHBondContact O-CB 3.5Å; K432-F435 PolarHBondContact O-N 2.72Å; K432-I436 HydrophobicContact CG-CD1 4Å; K432-I436 WeakPolarHBondContact O-CG1 3.42Å; K432-I436 PolarHBondContact O-N 3.41Å; K432-E448 WeakPolarHBondContact CE-OE1 3.43Å; K432-E448 WeakPolarHBondContact CE-OE2 3.48Å; K432-E448 IonicContact NZ-OE1 3.19Å; K432-E448 PolarHBondContact NZ-OE1 3.05Å; K432-E448 IonicContact NZ-OE2 2.76Å; K432-E448 PolarHBondContact NZ-OE2 3.45Å; K432-L470 HydrophobicContact CB-CD1 3.92Å; K432-L470 HydrophobicContact CG-CD1 4.3Å; K432-E474 IonicContact NZ-OE1 2.72Å; K432-E474 PolarHBondContact NZ-OE1 2.9Å; K432-L476 HydrophobicContact CG-CD1 4.29Å; K432-L476 HydrophobicContact CG-CD2 4.36Å
433	D	89.9	Confident	88.2	Confident	94 Å²	94	65.9 Å²	65.9	50%	0.503	35%	0.352	S	S	.	.	H	α-helix	trans	-67.1	-35.6	179.5	-78.7	-7.2	0	0	0	112.4	D429 I436 T437	D429-D433 PolarHBondContact O-N 3.32Å; D433-I436 PolarHBondContact O-N 2.85Å; D433-T437 VanDerWaalsContact O-CB 3.22Å; D433-T437 WeakPolarHBondContact O-CB 3.4Å; D433-T437 PolarHBondContact O-N 2.95Å; D433-T437 PolarHBondContact O-OG1 2.99Å
434	A	90.9	Very high	88.2	Confident	15 Å²	15	62.1 Å²	62.1	12%	0.124	33%	0.333	C	S	.	.	H	α-helix	trans	-64.5	-43.5	172.1	0	0	0	0	0	111.8	D430 I431 Q438 V492 I498	D430-A434 WeakPolarHBondContact O-CB 3.35Å; D430-A434 PolarHBondContact O-N 3.29Å; I431-A434 PolarHBondContact O-N 2.81Å; A434-Q438 WeakPolarHBondContact O-CB 3.02Å; A434-Q438 PolarHBondContact O-N 3.39Å; A434-V492 HydrophobicContact CB-CG1 4.01Å; A434-I498 HydrophobicContact CB-CD1 3.84Å; A434-I498 HydrophobicContact CB-CG1 4.02Å
435	F	92.5	Very high	88.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.4	-45.6	173.4	-92.2	-69.3	0	0	0	111.9	V403 I431 K432 A439 L446 F466 V468 L476 F488 V492 L493	V403-F435 HydrophobicContact CG1-CE2 4.41Å; I431-F435 HydrophobicContact CG2-CD2 3.96Å; I431-F435 HydrophobicContact CG2-CE2 3.98Å; I431-F435 VanDerWaalsContact O-CD2 3.28Å; I431-F435 WeakPolarHBondContact O-CD2 3.3Å; I431-F435 PolarHBondContact O-N 2.92Å; K432-F435 WeakPolarHBondContact O-CB 3.5Å; K432-F435 PolarHBondContact O-N 2.72Å; F435-A439 WeakPolarHBondContact O-CB 3.49Å; F435-A439 PolarHBondContact O-N 2.95Å; F435-L446 HydrophobicContact CB-CD1 4.08Å; F435-L446 WeakPolarHBondContact O-CD1 3.22Å; F435-F466 HydrophobicContact CD1-CE1 4.34Å; F435-F466 AromaticContact CE1-CE1 4Å; F435-F466 HydrophobicContact CE1-CE1 4Å; F435-F466 AromaticContact CE1-CZ 3.87Å; F435-F466 HydrophobicContact CE1-CZ 3.87Å; F435-V468 HydrophobicContact CD1-CG1 4.24Å; F435-V468 HydrophobicContact CD2-CG1 4.4Å; F435-V468 HydrophobicContact CD2-CG2 4.32Å; F435-V468 HydrophobicContact CE1-CB 4.5Å; F435-V468 HydrophobicContact CE1-CG1 4.31Å; F435-V468 HydrophobicContact CE1-CG2 4.48Å; F435-V468 HydrophobicContact CE2-CG1 4.48Å; F435-V468 HydrophobicContact CE2-CG2 3.76Å; F435-V468 HydrophobicContact CG-CG1 4.32Å; F435-V468 HydrophobicContact CZ-CB 4.33Å; F435-V468 HydrophobicContact CZ-CG1 4.45Å; F435-V468 HydrophobicContact CZ-CG2 3.85Å; F435-L476 HydrophobicContact CB-CD1 3.76Å; F435-L476 HydrophobicContact CG-CD1 4.38Å; F435-F488 AromaticContact CD1-CE1 3.92Å; F435-F488 HydrophobicContact CD1-CE1 3.92Å; F435-F488 HydrophobicContact CD1-CZ 4.43Å; F435-F488 HydrophobicContact CE1-CE1 4.18Å; F435-V492 HydrophobicContact CB-CG1 4.41Å; F435-V492 HydrophobicContact CD1-CB 4.08Å; F435-V492 HydrophobicContact CD1-CG1 3.86Å; F435-V492 HydrophobicContact CD1-CG2 3.72Å; F435-V492 HydrophobicContact CD2-CG1 3.78Å; F435-V492 HydrophobicContact CE1-CB 3.82Å; F435-V492 HydrophobicContact CE1-CG1 3.93Å; F435-V492 HydrophobicContact CE1-CG2 3.76Å; F435-V492 HydrophobicContact CE2-CB 4.45Å; F435-V492 HydrophobicContact CE2-CG1 3.84Å; F435-V492 HydrophobicContact CG-CB 4.49Å; F435-V492 HydrophobicContact CG-CG1 3.76Å; F435-V492 HydrophobicContact CG-CG2 4.39Å; F435-V492 HydrophobicContact CZ-CB 4.01Å; F435-V492 HydrophobicContact CZ-CG1 3.9Å; F435-V492 HydrophobicContact CZ-CG2 4.45Å; F435-L493 HydrophobicContact CE2-CD2 4.08Å; F435-L493 HydrophobicContact CE2-CG 4.36Å; F435-L493 HydrophobicContact CZ-CD2 4.46Å; F435-L493 HydrophobicContact CZ-CG 4.25Å
436	I	90.9	Very high	88.3	Confident	40 Å²	40	60.5 Å²	60.5	21%	0.205	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-47.6	-179.8	-69.4	168	0	0	0	111.2	K432 D433 A439 Q440	K432-I436 HydrophobicContact CG-CD1 4Å; K432-I436 WeakPolarHBondContact O-CG1 3.42Å; K432-I436 PolarHBondContact O-N 3.41Å; D433-I436 PolarHBondContact O-N 2.85Å; I436-A439 PolarHBondContact O-N 2.95Å; I436-Q440 VanDerWaalsContact CG2-NE2 3.33Å; I436-Q440 WeakPolarHBondContact O-CG 3.33Å; I436-Q440 PolarHBondContact O-N 2.91Å
437	T	90.4	Very high	88.4	Confident	77 Å²	77	64.4 Å²	64.4	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-62.6	-52.1	-178.2	-57.4	0	0	0	0	111	D433 A439 Q440 E441	D433-T437 VanDerWaalsContact O-CB 3.22Å; D433-T437 WeakPolarHBondContact O-CB 3.4Å; D433-T437 PolarHBondContact O-N 2.95Å; D433-T437 PolarHBondContact O-OG1 2.99Å; T437-A439 VanDerWaalsContact C-N 3.27Å; T437-A439 PolarHBondContact O-N 2.91Å; T437-Q440 WeakPolarHBondContact O-CB 3.21Å; T437-Q440 PolarHBondContact O-N 2.82Å; T437-Q440 VanDerWaalsContact O-N 3.1Å; T437-E441 PolarHBondContact O-N 3.12Å
438	Q	88.7	Confident	88.4	Confident	44 Å²	44	66.9 Å²	66.9	21%	0.206	33%	0.334	C	S	.	.	H	α-helix	trans	-71.9	-23.7	-177.7	-154.4	173.2	46.2	0	0	112.4	A434 Q442 V492	A434-Q438 WeakPolarHBondContact O-CB 3.02Å; A434-Q438 PolarHBondContact O-N 3.39Å; Q438-Q442 WeakPolarHBondContact O-CG 3.28Å; Q438-Q442 PolarHBondContact O-N 3.47Å; Q438-V492 HydrophobicContact CB-CG2 4.25Å
439	A	89.8	Confident	88.3	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-66.3	-46.8	166.9	0	0	0	0	0	111.6	F435 I436 T437 E441 Q442 Q443 I444 L446 F488	F435-A439 WeakPolarHBondContact O-CB 3.49Å; F435-A439 PolarHBondContact O-N 2.95Å; I436-A439 PolarHBondContact O-N 2.95Å; T437-A439 VanDerWaalsContact C-N 3.27Å; T437-A439 PolarHBondContact O-N 2.91Å; A439-E441 PolarHBondContact O-N 3.46Å; A439-Q442 CarbonylContact O-C 3.54Å; A439-Q442 PolarHBondContact O-N 3.12Å; A439-Q442 VanDerWaalsContact O-N 3.17Å; A439-Q443 PolarHBondContact O-N 2.87Å; A439-I444 CarbonylContact C-O 3.52Å; A439-I444 HydrophobicContact CB-CB 3.89Å; A439-I444 HydrophobicContact CB-CG2 4.06Å; A439-I444 WeakPolarHBondContact CB-O 3.2Å; A439-I444 PolarHBondContact O-N 3.44Å; A439-L446 HydrophobicContact CB-CD1 3.56Å; A439-L446 HydrophobicContact CB-CG 3.87Å; A439-F488 HydrophobicContact CB-CZ 3.92Å
440	Q	88.7	Confident	87.8	Confident	138 Å²	138	66.6 Å²	66.6	65%	0.645	34%	0.337	S	S	*	.	H	α-helix	trans	-60.3	-44	177.7	-71.7	175.1	22.1	0	0	112	I436 T437 Q442 Q443	I436-Q440 VanDerWaalsContact CG2-NE2 3.33Å; I436-Q440 WeakPolarHBondContact O-CG 3.33Å; I436-Q440 PolarHBondContact O-N 2.91Å; T437-Q440 WeakPolarHBondContact O-CB 3.21Å; T437-Q440 PolarHBondContact O-N 2.82Å; T437-Q440 VanDerWaalsContact O-N 3.1Å; Q440-Q442 VanDerWaalsContact C-N 3.27Å; Q440-Q442 PolarHBondContact O-N 2.85Å; Q440-Q443 PolarHBondContact O-N 2.7Å; Q440-Q443 VanDerWaalsContact O-N 3.1Å
441	E	87.1	Confident	87	Confident	144 Å²	144	68.3 Å²	68.3	67%	0.673	34%	0.343	S	S	*	.	H	α-helix	trans	-55.7	-40.3	174.4	-70.8	-177.8	154.4	0	0	112.6	T437 A439	T437-E441 PolarHBondContact O-N 3.12Å; A439-E441 PolarHBondContact O-N 3.46Å
442	Q	85.3	Confident	86.1	Confident	79 Å²	79	76.2 Å²	76.2	37%	0.369	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	11.7	179.9	-59.9	-161.5	39.6	0	0	113.9	Q438 A439 Q440 I444 E491	Q438-Q442 WeakPolarHBondContact O-CG 3.28Å; Q438-Q442 PolarHBondContact O-N 3.47Å; A439-Q442 CarbonylContact O-C 3.54Å; A439-Q442 PolarHBondContact O-N 3.12Å; A439-Q442 VanDerWaalsContact O-N 3.17Å; Q440-Q442 VanDerWaalsContact C-N 3.27Å; Q440-Q442 PolarHBondContact O-N 2.85Å; Q442-I444 VanDerWaalsContact C-N 3.27Å; Q442-I444 HydrophobicContact CB-CD1 3.89Å; Q442-I444 HydrophobicContact CB-CG1 4.23Å; Q442-I444 PolarHBondContact O-N 2.66Å; Q442-E491 PolarHBondContact NE2-OE2 3.47Å
443	Q	83.7	Confident	85.3	Confident	192 Å²	192	76.3 Å²	76.3	90%	0.897	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	31.5	-179.5	-53.3	-172.5	-31.1	0	0	114.5	A439 Q440	A439-Q443 PolarHBondContact O-N 2.87Å; Q440-Q443 PolarHBondContact O-N 2.7Å; Q440-Q443 VanDerWaalsContact O-N 3.1Å
444	I	89	Confident	84.5	Confident	16 Å²	16	75.1 Å²	75.1	8%	0.082	38%	0.377	C	S	.	.			trans	-94.6	124.9	178	-63.3	166.9	0	0	0	109.3	A439 Q442 L446 H478 F484 P485 F488	A439-I444 CarbonylContact C-O 3.52Å; A439-I444 HydrophobicContact CB-CB 3.89Å; A439-I444 HydrophobicContact CB-CG2 4.06Å; A439-I444 WeakPolarHBondContact CB-O 3.2Å; A439-I444 PolarHBondContact O-N 3.44Å; Q442-I444 VanDerWaalsContact C-N 3.27Å; Q442-I444 HydrophobicContact CB-CD1 3.89Å; Q442-I444 HydrophobicContact CB-CG1 4.23Å; Q442-I444 PolarHBondContact O-N 2.66Å; I444-L446 HydrophobicContact CG2-CG 4.46Å; I444-L446 PolarHBondContact O-N 2.87Å; I444-H478 HydrophobicContact CG2-CB 4.05Å; I444-F484 HydrophobicContact CD1-CD2 4.13Å; I444-F484 HydrophobicContact CD1-CE2 3.79Å; I444-F484 HydrophobicContact CG1-CD2 4.48Å; I444-F484 HydrophobicContact CG1-CE2 4.37Å; I444-F484 HydrophobicContact CG2-CE2 4.14Å; I444-P485 HydrophobicContact CD1-CG 4.19Å; I444-F488 HydrophobicContact CD1-CD2 3.83Å; I444-F488 HydrophobicContact CD1-CE2 3.8Å; I444-F488 HydrophobicContact CD1-CG 4.32Å; I444-F488 HydrophobicContact CD1-CZ 4.26Å
445	E	85.7	Confident	84	Confident	107 Å²	107	74.9 Å²	74.9	50%	0.5	37%	0.373	S	S	.	.			trans	-88.8	92.4	178.7	-179.4	-177.6	-154.8	0	0	109.9	L447 H478 K481	E445-L447 HydrophobicContact CG-CD2 4.28Å; E445-H478 PolarHBondContact N-ND1 3.25Å; E445-H478 PolarHBondContact O-ND1 2.88Å; E445-K481 IonicContact OE2-NZ 3.86Å; E445-K481 PolarHBondContact OE2-NZ 2.8Å
446	L	88.6	Confident	83.3	Confident	32 Å²	32	78.1 Å²	78.1	17%	0.168	39%	0.387	C	S	.	.			trans	-82.2	129.6	170.5	-75.9	172.5	0	0	0	110.3	F435 A439 I444 F466 L476 H478	F435-L446 HydrophobicContact CB-CD1 4.08Å; F435-L446 WeakPolarHBondContact O-CD1 3.22Å; A439-L446 HydrophobicContact CB-CD1 3.56Å; A439-L446 HydrophobicContact CB-CG 3.87Å; I444-L446 HydrophobicContact CG2-CG 4.46Å; I444-L446 PolarHBondContact O-N 2.87Å; L446-F466 HydrophobicContact CD2-CD1 4.3Å; L446-L476 HydrophobicContact CD1-CD1 4.26Å; L446-L476 HydrophobicContact CD2-CB 4.11Å; L446-H478 HydrophobicContact CD2-CB 3.98Å
447	L	86.5	Confident	82.6	Confident	93 Å²	93	83.4 Å²	83.4	49%	0.487	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.1	175.2	-58.7	176.2	0	0	0	109.5	E445 L476 F477	E445-L447 HydrophobicContact CG-CD2 4.28Å; L447-L476 WeakPolarHBondContact O-CA 3.46Å; L447-F477 PolarHBondContact N-O 3.4Å; L447-F477 PolarHBondContact O-N 2.69Å
448	E	87.4	Confident	82	Confident	121 Å²	121	82.8 Å²	82.8	57%	0.565	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	136	172.6	-55.5	-162	-166.2	0	0	110.7	K432 L476	K432-E448 WeakPolarHBondContact CE-OE1 3.43Å; K432-E448 WeakPolarHBondContact CE-OE2 3.48Å; K432-E448 IonicContact NZ-OE1 3.19Å; K432-E448 PolarHBondContact NZ-OE1 3.05Å; K432-E448 IonicContact NZ-OE2 2.76Å; K432-E448 PolarHBondContact NZ-OE2 3.45Å; E448-L476 HydrophobicContact CG-CD2 3.81Å
449	I	83.8	Confident	81.6	Confident	15 Å²	15	80.8 Å²	80.8	8%	0.077	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	133.4	178.6	-67.4	178.7	0	0	0	108.6	I458 K475 F477	I449-I458 HydrophobicContact CB-CD1 4.45Å; I449-I458 HydrophobicContact CD1-CD1 3.61Å; I449-I458 HydrophobicContact CD1-CG2 4.12Å; I449-I458 HydrophobicContact CG1-CD1 3.9Å; I449-I458 HydrophobicContact CG2-CD1 3.72Å; I449-K475 HydrophobicContact CB-CB 3.81Å; I449-K475 HydrophobicContact CG2-CB 4.21Å; I449-K475 HydrophobicContact CG2-CD 4.1Å; I449-K475 PolarHBondContact N-O 2.9Å; I449-F477 HydrophobicContact CD1-CB 3.28Å; I449-F477 HydrophobicContact CD1-CD1 4.31Å; I449-F477 HydrophobicContact CD1-CD2 4.25Å; I449-F477 HydrophobicContact CD1-CG 3.73Å; I449-F477 HydrophobicContact CG1-CB 4.05Å
450	P	75.9	Confident	80.9	Confident	91 Å²	91	86.7 Å²	86.7	59%	0.591	42%	0.423	S	S	*	.			trans	-58	142.2	173.8	-24.4	34.3	0	0	0	112.8	H452 S453	P450-H452 PolarHBondContact O-N 3.07Å; P450-S453 WeakPolarHBondContact O-CB 3.36Å; P450-S453 PolarHBondContact O-N 2.95Å
451	E	70.8	Confident	80.4	Confident	109 Å²	109	84.8 Å²	84.8	51%	0.509	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.6	-43.7	-176.1	-177.5	-171.3	172.5	0	0	113.3	S453 K475	E451-S453 PolarHBondContact O-N 2.81Å; E451-K475 WeakPolarHBondContact O-CE 3.5Å; E451-K475 PolarHBondContact O-NZ 3.19Å
452	H	71.9	Confident	79.7	Confident	165 Å²	165	80.7 Å²	80.7	76%	0.764	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	2.6	-174.6	-49.6	-25.8	0	0	0	114.6	P450	P450-H452 PolarHBondContact O-N 3.07Å
453	S	75	Confident	79.6	Confident	29 Å²	29	77.8 Å²	77.8	20%	0.203	41%	0.409	C	S	.	.			trans	-77.5	134.1	175.7	-65.4	0	0	0	0	111.7	P450 E451 K475	P450-S453 WeakPolarHBondContact O-CB 3.36Å; P450-S453 PolarHBondContact O-N 2.95Å; E451-S453 PolarHBondContact O-N 2.81Å; S453-K475 PolarHBondContact O-NZ 3.21Å
454	D	73.1	Confident	79.9	Confident	70 Å²	70	70 Å²	70	37%	0.374	38%	0.377	S	S	.	.			trans	-80.5	132.1	172.1	-178.6	-4.4	0	0	0	110	K456 Q457	D454-K456 PolarHBondContact O-N 2.98Å; D454-K456 WeakPolarHBondContact OD1-CB 3.28Å; D454-K456 WeakPolarHBondContact OD1-CG 3.49Å; D454-K456 PolarHBondContact OD1-N 3.12Å; D454-Q457 HydrophobicContact CB-CG 4.21Å; D454-Q457 WeakPolarHBondContact O-CB 3.49Å; D454-Q457 PolarHBondContact O-N 3.48Å
455	I	78.3	Confident	80	Confident	9 Å²	9	69.3 Å²	69.3	5%	0.046	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-56	-33.1	176.6	-52.4	173.2	0	0	0	110.5	V373 V374 Q457 I458 A459 Y465 Y467 F477	V373-I455 HydrophobicContact CG1-CD1 4.45Å; V374-I455 HydrophobicContact CG2-CG2 3.89Å; I455-Q457 PolarHBondContact O-N 2.99Å; I455-I458 PolarHBondContact O-N 2.94Å; I455-A459 HydrophobicContact CG2-CB 4.24Å; I455-A459 PolarHBondContact O-N 3.43Å; I455-Y465 HydrophobicContact CG2-CE2 4.35Å; I455-Y467 HydrophobicContact CD1-CD1 3.9Å; I455-Y467 HydrophobicContact CD1-CD2 3.82Å; I455-Y467 HydrophobicContact CD1-CE1 3.73Å; I455-Y467 HydrophobicContact CD1-CE2 3.62Å; I455-Y467 HydrophobicContact CD1-CG 3.94Å; I455-Y467 HydrophobicContact CG1-CD2 4.18Å; I455-Y467 HydrophobicContact CG1-CE2 3.89Å; I455-F477 HydrophobicContact CG2-CE2 4.44Å
456	K	78.1	Confident	80.4	Confident	68 Å²	68	64.2 Å²	64.2	30%	0.296	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-62.7	-18.7	177.1	-66.8	169.6	170.7	179.9	0	114.4	V374 L376 D454	V374-K456 HydrophobicContact CB-CG 4.37Å; V374-K456 HydrophobicContact CG1-CG 4.28Å; V374-K456 HydrophobicContact CG2-CG 4.37Å; V374-K456 WeakPolarHBondContact O-CE 3.48Å; L376-K456 PolarHBondContact O-NZ 3.46Å; D454-K456 PolarHBondContact O-N 2.98Å; D454-K456 WeakPolarHBondContact OD1-CB 3.28Å; D454-K456 WeakPolarHBondContact OD1-CG 3.49Å; D454-K456 PolarHBondContact OD1-N 3.12Å
457	Q	77.3	Confident	80.5	Confident	151 Å²	151	62.8 Å²	62.8	71%	0.706	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-83	-16.3	174.8	-61.7	174.5	1.6	0	0	112.4	D454 I455	D454-Q457 HydrophobicContact CB-CG 4.21Å; D454-Q457 WeakPolarHBondContact O-CB 3.49Å; D454-Q457 PolarHBondContact O-N 3.48Å; I455-Q457 PolarHBondContact O-N 2.99Å
458	I	77.6	Confident	80.9	Confident	64 Å²	64	58.4 Å²	58.4	33%	0.328	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-34.7	-167.5	-62.2	168.4	0	0	0	111	I449 I455 F477	I449-I458 HydrophobicContact CB-CD1 4.45Å; I449-I458 HydrophobicContact CD1-CD1 3.61Å; I449-I458 HydrophobicContact CD1-CG2 4.12Å; I449-I458 HydrophobicContact CG1-CD1 3.9Å; I449-I458 HydrophobicContact CG2-CD1 3.72Å; I455-I458 PolarHBondContact O-N 2.94Å; I458-F477 HydrophobicContact CG2-CD1 4.07Å; I458-F477 HydrophobicContact CG2-CE1 3.86Å; I458-F477 HydrophobicContact CG2-CZ 4.23Å
459	A	79.8	Confident	81.1	Confident	3 Å²	3	53 Å²	53	3%	0.025	29%	0.294	C	S	.	.	S	Bend	trans	-111.4	126.5	171.7	0	0	0	0	0	110.7	V374 I455 Y465 F477	V374-A459 WeakPolarHBondContact CG1-O 3.24Å; V374-A459 HydrophobicContact CG2-CB 3.9Å; I455-A459 HydrophobicContact CG2-CB 4.24Å; I455-A459 PolarHBondContact O-N 3.43Å; A459-Y465 HydrophobicContact CB-CD1 3.79Å; A459-Y465 HydrophobicContact CB-CE1 4Å; A459-Y465 HydrophobicContact CB-CG 4.45Å; A459-F477 HydrophobicContact CB-CE2 3.94Å; A459-F477 HydrophobicContact CB-CZ 3.86Å
460	Q	75.5	Confident	81.5	Confident	124 Å²	124	52.3 Å²	52.3	58%	0.579	29%	0.29	S	S	*	.			trans	-79.9	149.9	171.2	-69.3	168.6	-44.6	0	0	110.4	G462 A463	Q460-G462 PolarHBondContact O-N 2.97Å; Q460-A463 VanDerWaalsContact O-CB 3.22Å; Q460-A463 WeakPolarHBondContact O-CB 3.15Å; Q460-A463 PolarHBondContact O-N 3.24Å
461	P	77.1	Confident	81.9	Confident	98 Å²	98	50.9 Å²	50.9	64%	0.636	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	137.1	173	-25.4	32.5	0	0	0	112.2	V374 A463	V374-P461 HydrophobicContact CG1-CB 4.34Å; V374-P461 HydrophobicContact CG1-CG 3.88Å; P461-A463 PolarHBondContact O-N 3.45Å
462	G	73.9	Confident	82.5	Confident	59 Å²	59	49 Å²	49	61%	0.608	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	-8.9	-176.1	0	0	0	0	0	116	Q460	Q460-G462 PolarHBondContact O-N 2.97Å
463	A	83.4	Confident	83	Confident	17 Å²	17	41.5 Å²	41.5	14%	0.14	24%	0.241	C	C	.	.			trans	-73.9	130.4	171.1	0	0	0	0	0	110.6	N408 Q460 P461 Y465	N408-A463 PolarHBondContact ND2-O 2.92Å; Q460-A463 VanDerWaalsContact O-CB 3.22Å; Q460-A463 WeakPolarHBondContact O-CB 3.15Å; Q460-A463 PolarHBondContact O-N 3.24Å; P461-A463 PolarHBondContact O-N 3.45Å; A463-Y465 WeakPolarHBondContact O-CD1 3.1Å
464	A	89.1	Confident	83.6	Confident	29 Å²	29	42.7 Å²	42.7	24%	0.24	24%	0.244	C	C	.	.			trans	-72.8	135.2	176.2	0	0	0	0	0	111.5	N408 Y409 I480	N408-A464 CarbonylContact O-C 3.57Å; N408-A464 WeakPolarHBondContact O-CA 3.04Å; N408-A464 WeakPolarHBondContact O-CB 3.06Å; Y409-A464 HydrophobicContact CD2-CB 4.06Å; A464-I480 HydrophobicContact CB-CB 3.95Å; A464-I480 HydrophobicContact CB-CG2 4.29Å; A464-I480 PolarHBondContact O-N 2.88Å
465	Y	91.6	Very high	84.4	Confident	1 Å²	1	40.7 Å²	40.7	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	160.3	179.7	67.3	-99.5	0	0	0	113.7	V373 V374 E406 N408 I455 A459 A463 F477 H478 I480	V373-Y465 PolarHBondContact N-OH 3.3Å; V374-Y465 HydrophobicContact CB-CE1 4.46Å; V374-Y465 HydrophobicContact CG2-CE1 3.75Å; E406-Y465 HydrophobicContact CG-CE2 4.33Å; E406-Y465 PolarHBondContact OE1-OH 2.88Å; E406-Y465 WeakPolarHBondContact OE2-CE2 3.4Å; E406-Y465 VanDerWaalsContact OE2-CZ 3.31Å; E406-Y465 PolarHBondContact OE2-OH 3.18Å; N408-Y465 CarbonylContact C-O 3.56Å; N408-Y465 WeakPolarHBondContact CA-O 3.38Å; N408-Y465 HydrophobicContact CB-CD1 3.91Å; N408-Y465 HydrophobicContact CB-CD2 4.26Å; N408-Y465 HydrophobicContact CB-CE1 3.84Å; N408-Y465 HydrophobicContact CB-CE2 4.19Å; N408-Y465 HydrophobicContact CB-CG 4.13Å; N408-Y465 PolarHBondContact N-O 2.83Å; N408-Y465 WeakPolarHBondContact ND2-CE1 3.13Å; N408-Y465 PolarHBondContact O-N 2.96Å; I455-Y465 HydrophobicContact CG2-CE2 4.35Å; A459-Y465 HydrophobicContact CB-CD1 3.79Å; A459-Y465 HydrophobicContact CB-CE1 4Å; A459-Y465 HydrophobicContact CB-CG 4.45Å; A463-Y465 WeakPolarHBondContact O-CD1 3.1Å; Y465-F477 VanDerWaalsContact CB-CE2 3.48Å; Y465-F477 HydrophobicContact CD1-CE2 4.36Å; Y465-F477 HydrophobicContact CD2-CD2 4.28Å; Y465-F477 AromaticContact CD2-CE2 3.78Å; Y465-F477 HydrophobicContact CD2-CE2 3.78Å; Y465-F477 AromaticContact CG-CE2 3.65Å; Y465-F477 HydrophobicContact CG-CE2 3.65Å; Y465-F477 HydrophobicContact CG-CZ 4.27Å; Y465-H478 CarbonylContact C-O 3.6Å; Y465-H478 VanDerWaalsContact CA-O 3.27Å; Y465-H478 WeakPolarHBondContact CA-O 3.33Å; Y465-H478 WeakPolarHBondContact CB-O 3.45Å; Y465-I480 VanDerWaalsContact C-CD1 3.43Å
466	F	92.8	Very high	85	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.5	162.3	177.1	-100.3	0	0	0	108.8	F405 E406 R407 F435 L446 V468 F477 H478 I480 F484 F488	F405-F466 HydrophobicContact CB-CE2 4.07Å; F405-F466 HydrophobicContact CB-CZ 4.04Å; F405-F466 AromaticContact CD2-CE2 3.83Å; F405-F466 HydrophobicContact CD2-CE2 3.83Å; F405-F466 HydrophobicContact CD2-CZ 4.48Å; F405-F466 HydrophobicContact CG-CE2 4.09Å; F405-F466 HydrophobicContact CG-CZ 4.3Å; E406-F466 WeakPolarHBondContact O-CA 3.14Å; E406-F466 WeakPolarHBondContact O-CD2 3.5Å; R407-F466 HydrophobicContact CB-CD2 4.15Å; R407-F466 HydrophobicContact CG-CD2 4.37Å; F435-F466 HydrophobicContact CD1-CE1 4.34Å; F435-F466 AromaticContact CE1-CE1 4Å; F435-F466 HydrophobicContact CE1-CE1 4Å; F435-F466 AromaticContact CE1-CZ 3.87Å; F435-F466 HydrophobicContact CE1-CZ 3.87Å; L446-F466 HydrophobicContact CD2-CD1 4.3Å; F466-V468 HydrophobicContact CE1-CB 4.26Å; F466-V468 HydrophobicContact CE1-CG1 4.17Å; F466-V468 HydrophobicContact CZ-CB 4.37Å; F466-F477 WeakPolarHBondContact O-CA 3.35Å; F466-H478 PolarHBondContact N-O 2.8Å; F466-H478 PolarHBondContact O-N 2.83Å; F466-I480 HydrophobicContact CB-CD1 4.21Å; F466-F484 HydrophobicContact CB-CE1 3.97Å; F466-F484 HydrophobicContact CB-CE2 3.88Å; F466-F484 HydrophobicContact CB-CZ 3.43Å; F466-F484 VanDerWaalsContact CB-CZ 3.43Å; F466-F484 HydrophobicContact CD1-CZ 4.02Å; F466-F484 AromaticContact CD2-CE1 3.93Å; F466-F484 HydrophobicContact CD2-CE1 3.93Å; F466-F484 AromaticContact CD2-CZ 3.76Å; F466-F484 HydrophobicContact CD2-CZ 3.76Å; F466-F484 HydrophobicContact CG-CE1 4.04Å; F466-F484 HydrophobicContact CG-CE2 4.25Å; F466-F484 AromaticContact CG-CZ 3.45Å; F466-F484 HydrophobicContact CG-CZ 3.45Å; F466-F484 VanDerWaalsContact CG-CZ 3.45Å; F466-F488 HydrophobicContact CD1-CD1 4.18Å; F466-F488 HydrophobicContact CD1-CE1 4.3Å; F466-F488 AromaticContact CE1-CD1 3.82Å; F466-F488 HydrophobicContact CE1-CD1 3.82Å; F466-F488 AromaticContact CE1-CE1 3.88Å; F466-F488 HydrophobicContact CE1-CE1 3.88Å; F466-F488 HydrophobicContact CE2-CD1 4.4Å; F466-F488 AromaticContact CZ-CD1 3.95Å; F466-F488 HydrophobicContact CZ-CD1 3.95Å; F466-F488 HydrophobicContact CZ-CE1 4.37Å
467	Y	92.5	Very high	85.7	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	138.2	-178.3	165.3	-96.8	0	0	0	109.3	F405 E406 I455 E469 K475 L476	F405-Y467 CarbonylContact C-O 3.46Å; F405-Y467 WeakPolarHBondContact CA-O 3.39Å; F405-Y467 VanDerWaalsContact CB-O 3.29Å; F405-Y467 WeakPolarHBondContact CB-O 3.47Å; E406-Y467 HydrophobicContact CB-CD1 4.36Å; E406-Y467 PolarHBondContact N-O 3.26Å; E406-Y467 PolarHBondContact O-N 2.94Å; I455-Y467 HydrophobicContact CD1-CD1 3.9Å; I455-Y467 HydrophobicContact CD1-CD2 3.82Å; I455-Y467 HydrophobicContact CD1-CE1 3.73Å; I455-Y467 HydrophobicContact CD1-CE2 3.62Å; I455-Y467 HydrophobicContact CD1-CG 3.94Å; I455-Y467 HydrophobicContact CG1-CD2 4.18Å; I455-Y467 HydrophobicContact CG1-CE2 3.89Å; Y467-E469 HydrophobicContact CE1-CB 3.83Å; Y467-E469 WeakPolarHBondContact OH-CG 3.3Å; Y467-E469 PolarHBondContact OH-OE2 2.71Å; Y467-K475 HydrophobicContact CE2-CB 3.9Å; Y467-K475 HydrophobicContact CE2-CD 4.02Å; Y467-K475 HydrophobicContact CE2-CG 3.79Å; Y467-K475 VanDerWaalsContact OH-CE 3.23Å; Y467-K475 WeakPolarHBondContact OH-CE 3.46Å; Y467-K475 WeakPolarHBondContact OH-CG 3.4Å; Y467-L476 WeakPolarHBondContact CA-O 3.2Å
468	V	93.9	Very high	86.4	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142	170.8	55.9	0	0	0	0	110.2	V403 L404 F405 F435 F466 L470 K475 L476	V403-V468 HydrophobicContact CG1-CG2 3.74Å; L404-V468 CarbonylContact O-C 3.58Å; L404-V468 VanDerWaalsContact O-CA 3.32Å; L404-V468 WeakPolarHBondContact O-CA 3.37Å; L404-V468 WeakPolarHBondContact O-CG2 3.43Å; F405-V468 HydrophobicContact CB-CB 4.07Å; F405-V468 HydrophobicContact CB-CG2 4.28Å; F435-V468 HydrophobicContact CD1-CG1 4.24Å; F435-V468 HydrophobicContact CD2-CG1 4.4Å; F435-V468 HydrophobicContact CD2-CG2 4.32Å; F435-V468 HydrophobicContact CE1-CB 4.5Å; F435-V468 HydrophobicContact CE1-CG1 4.31Å; F435-V468 HydrophobicContact CE1-CG2 4.48Å; F435-V468 HydrophobicContact CE2-CG1 4.48Å; F435-V468 HydrophobicContact CE2-CG2 3.76Å; F435-V468 HydrophobicContact CG-CG1 4.32Å; F435-V468 HydrophobicContact CZ-CB 4.33Å; F435-V468 HydrophobicContact CZ-CG1 4.45Å; F435-V468 HydrophobicContact CZ-CG2 3.85Å; F466-V468 HydrophobicContact CE1-CB 4.26Å; F466-V468 HydrophobicContact CE1-CG1 4.17Å; F466-V468 HydrophobicContact CZ-CB 4.37Å; V468-L470 HydrophobicContact CG2-CD2 4.25Å; V468-K475 WeakPolarHBondContact O-CA 3.5Å; V468-L476 HydrophobicContact CG1-CB 3.64Å; V468-L476 HydrophobicContact CG1-CD1 4.07Å; V468-L476 HydrophobicContact CG1-CG 4.06Å; V468-L476 PolarHBondContact N-O 3.39Å; V468-L476 PolarHBondContact O-N 2.83Å
469	E	92.6	Very high	86.9	Confident	8 Å²	8	33.7 Å²	33.7	4%	0.037	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.9	-179	-166.4	-175.2	120.2	0	0	108.8	K388 K392 L404 Y467 E474 K475	K388-E469 IonicContact NZ-OE1 2.81Å; K388-E469 IonicContact NZ-OE2 3.93Å; K388-E469 PolarHBondContact NZ-OE2 2.94Å; K392-E469 WeakPolarHBondContact CE-OE1 3.09Å; K392-E469 IonicContact NZ-OE1 2.7Å; K392-E469 PolarHBondContact NZ-OE1 2.92Å; L404-E469 HydrophobicContact CB-CB 4.27Å; L404-E469 HydrophobicContact CD1-CB 4.4Å; L404-E469 PolarHBondContact N-O 2.62Å; L404-E469 PolarHBondContact O-N 2.78Å; Y467-E469 HydrophobicContact CE1-CB 3.83Å; Y467-E469 WeakPolarHBondContact OH-CG 3.3Å; Y467-E469 PolarHBondContact OH-OE2 2.71Å; E469-E474 WeakPolarHBondContact CA-O 3.43Å; E469-K475 HydrophobicContact CG-CG 4.31Å
470	L	91	Very high	87.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.195	C	C	.	.			trans	-91.7	170	-178.9	-56.1	-176.1	0	0	0	111.4	V403 T428 I431 K432 V468 T472 G473 E474	V403-L470 HydrophobicContact CG1-CD2 4.34Å; T428-L470 HydrophobicContact CG2-CB 3.88Å; T428-L470 HydrophobicContact CG2-CD1 3.89Å; T428-L470 HydrophobicContact CG2-CG 4.4Å; I431-L470 HydrophobicContact CG2-CD2 3.77Å; K432-L470 HydrophobicContact CB-CD1 3.92Å; K432-L470 HydrophobicContact CG-CD1 4.3Å; V468-L470 HydrophobicContact CG2-CD2 4.25Å; L470-T472 PolarHBondContact O-N 2.87Å; L470-G473 PolarHBondContact O-N 3.5Å; L470-G473 VanDerWaalsContact O-N 3.11Å; L470-E474 HydrophobicContact CB-CB 4.45Å; L470-E474 HydrophobicContact CD1-CB 4.29Å; L470-E474 PolarHBondContact N-O 3.45Å
471	D	85.1	Confident	87.5	Confident	61 Å²	61	35.4 Å²	35.4	33%	0.326	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-18.2	178.5	72.2	-45.5	0	0	0	113.1	R401 T428 G473	R401-D471 HydrophobicContact CB-CB 4.22Å; R401-D471 WeakPolarHBondContact CD-OD2 3.16Å; R401-D471 VanDerWaalsContact CG-OD2 3.26Å; R401-D471 WeakPolarHBondContact CG-OD2 3.38Å; T428-D471 VanDerWaalsContact CG2-OD1 3.22Å; T428-D471 WeakPolarHBondContact CG2-OD1 3.33Å; T428-D471 PolarHBondContact OG1-OD1 3.31Å; D471-G473 VanDerWaalsContact C-N 3.25Å; D471-G473 PolarHBondContact O-N 3.03Å
472	T	83.2	Confident	87.6	Confident	69 Å²	69	39.5 Å²	39.5	42%	0.423	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-14.2	166.3	47.5	0	0	0	0	114	T428 L470 E474	T428-T472 HydrophobicContact CG2-CG2 3.77Å; L470-T472 PolarHBondContact O-N 2.87Å; T472-E474 VanDerWaalsContact C-N 3.32Å; T472-E474 WeakPolarHBondContact CB-OE2 3.42Å; T472-E474 PolarHBondContact OG1-OE2 3.35Å
473	G	82.3	Confident	87.7	Confident	8 Å²	8	43.3 Å²	43.3	8%	0.082	21%	0.213	C	C	.	.	S	Bend	trans	88	-5.1	-172	0	0	0	0	0	114.2	L470 D471	L470-G473 PolarHBondContact O-N 3.5Å; L470-G473 VanDerWaalsContact O-N 3.11Å; D471-G473 VanDerWaalsContact C-N 3.25Å; D471-G473 PolarHBondContact O-N 3.03Å
474	E	87	Confident	87.9	Confident	54 Å²	54	43.1 Å²	43.1	25%	0.252	21%	0.209	S	C	.	.			trans	-63.2	148.9	171.2	-69.8	169.6	94.7	0	0	112	K432 E469 L470 T472	K432-E474 IonicContact NZ-OE1 2.72Å; K432-E474 PolarHBondContact NZ-OE1 2.9Å; E469-E474 WeakPolarHBondContact CA-O 3.43Å; L470-E474 HydrophobicContact CB-CB 4.45Å; L470-E474 HydrophobicContact CD1-CB 4.29Å; L470-E474 PolarHBondContact N-O 3.45Å; T472-E474 VanDerWaalsContact C-N 3.32Å; T472-E474 WeakPolarHBondContact CB-OE2 3.42Å; T472-E474 PolarHBondContact OG1-OE2 3.35Å
475	K	90.6	Very high	87.7	Confident	28 Å²	28	43 Å²	43	12%	0.122	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.6	-171.9	-69	169.8	173.6	173.7	0	109.9	I449 E451 S453 Y467 V468 E469	I449-K475 HydrophobicContact CB-CB 3.81Å; I449-K475 HydrophobicContact CG2-CB 4.21Å; I449-K475 HydrophobicContact CG2-CD 4.1Å; I449-K475 PolarHBondContact N-O 2.9Å; E451-K475 WeakPolarHBondContact O-CE 3.5Å; E451-K475 PolarHBondContact O-NZ 3.19Å; S453-K475 PolarHBondContact O-NZ 3.21Å; Y467-K475 HydrophobicContact CE2-CB 3.9Å; Y467-K475 HydrophobicContact CE2-CD 4.02Å; Y467-K475 HydrophobicContact CE2-CG 3.79Å; Y467-K475 VanDerWaalsContact OH-CE 3.23Å; Y467-K475 WeakPolarHBondContact OH-CE 3.46Å; Y467-K475 WeakPolarHBondContact OH-CG 3.4Å; V468-K475 WeakPolarHBondContact O-CA 3.5Å; E469-K475 HydrophobicContact CG-CG 4.31Å
476	L	91.1	Very high	87.4	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.3	170	-43.4	175.1	0	0	0	109.5	K432 F435 L446 L447 E448 Y467 V468	K432-L476 HydrophobicContact CG-CD1 4.29Å; K432-L476 HydrophobicContact CG-CD2 4.36Å; F435-L476 HydrophobicContact CB-CD1 3.76Å; F435-L476 HydrophobicContact CG-CD1 4.38Å; L446-L476 HydrophobicContact CD1-CD1 4.26Å; L446-L476 HydrophobicContact CD2-CB 4.11Å; L447-L476 WeakPolarHBondContact O-CA 3.46Å; E448-L476 HydrophobicContact CG-CD2 3.81Å; Y467-L476 WeakPolarHBondContact CA-O 3.2Å; V468-L476 HydrophobicContact CG1-CB 3.64Å; V468-L476 HydrophobicContact CG1-CD1 4.07Å; V468-L476 HydrophobicContact CG1-CG 4.06Å; V468-L476 PolarHBondContact N-O 3.39Å; V468-L476 PolarHBondContact O-N 2.83Å
477	F	91.8	Very high	87.1	Confident	7 Å²	7	48.3 Å²	48.3	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	139.9	-173.7	173.3	-89.6	0	0	0	112.5	L447 I449 I455 I458 A459 Y465 F466 R479	L447-F477 PolarHBondContact N-O 3.4Å; L447-F477 PolarHBondContact O-N 2.69Å; I449-F477 HydrophobicContact CD1-CB 3.28Å; I449-F477 HydrophobicContact CD1-CD1 4.31Å; I449-F477 HydrophobicContact CD1-CD2 4.25Å; I449-F477 HydrophobicContact CD1-CG 3.73Å; I449-F477 HydrophobicContact CG1-CB 4.05Å; I455-F477 HydrophobicContact CG2-CE2 4.44Å; I458-F477 HydrophobicContact CG2-CD1 4.07Å; I458-F477 HydrophobicContact CG2-CE1 3.86Å; I458-F477 HydrophobicContact CG2-CZ 4.23Å; A459-F477 HydrophobicContact CB-CE2 3.94Å; A459-F477 HydrophobicContact CB-CZ 3.86Å; Y465-F477 VanDerWaalsContact CB-CE2 3.48Å; Y465-F477 HydrophobicContact CD1-CE2 4.36Å; Y465-F477 HydrophobicContact CD2-CD2 4.28Å; Y465-F477 AromaticContact CD2-CE2 3.78Å; Y465-F477 HydrophobicContact CD2-CE2 3.78Å; Y465-F477 AromaticContact CG-CE2 3.65Å; Y465-F477 HydrophobicContact CG-CE2 3.65Å; Y465-F477 HydrophobicContact CG-CZ 4.27Å; F466-F477 WeakPolarHBondContact O-CA 3.35Å; F477-R479 HydrophobicContact CE1-CB 4.02Å; F477-R479 HydrophobicContact CZ-CB 4.41Å
478	H	91.6	Very high	86.9	Confident	16 Å²	16	48.2 Å²	48.2	7%	0.074	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	123.2	174.2	174.9	68.7	0	0	0	110.9	I444 E445 L446 Y465 F466 I480 F484	I444-H478 HydrophobicContact CG2-CB 4.05Å; E445-H478 PolarHBondContact N-ND1 3.25Å; E445-H478 PolarHBondContact O-ND1 2.88Å; L446-H478 HydrophobicContact CD2-CB 3.98Å; Y465-H478 CarbonylContact C-O 3.6Å; Y465-H478 VanDerWaalsContact CA-O 3.27Å; Y465-H478 WeakPolarHBondContact CA-O 3.33Å; Y465-H478 WeakPolarHBondContact CB-O 3.45Å; F466-H478 PolarHBondContact N-O 2.8Å; F466-H478 PolarHBondContact O-N 2.83Å; H478-I480 PolarHBondContact O-N 3.15Å; H478-F484 AromaticContact CD2-CD2 3.9Å; H478-F484 AromaticContact CD2-CE2 3.94Å
479	R	88.9	Confident	86.7	Confident	121 Å²	121	48.3 Å²	48.3	46%	0.457	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	108.4	171.6	-173.5	172	-178.7	154.9	1.6	109.7	F477 K481	F477-R479 HydrophobicContact CE1-CB 4.02Å; F477-R479 HydrophobicContact CZ-CB 4.41Å; R479-K481 PolarHBondContact O-N 2.88Å; R479-K481 VanDerWaalsContact O-N 3.14Å
480	I	87.9	Confident	86.6	Confident	14 Å²	14	48.4 Å²	48.4	7%	0.072	23%	0.233	C	C	.	.			trans	-72.6	108.6	-173.1	-66.6	167	0	0	0	109.8	Y409 A464 Y465 F466 H478 F484	Y409-I480 HydrophobicContact CD2-CD1 4.47Å; Y409-I480 HydrophobicContact CD2-CG2 3.68Å; Y409-I480 HydrophobicContact CE2-CG2 3.85Å; Y409-I480 HydrophobicContact CG-CD1 4.06Å; Y409-I480 HydrophobicContact CG-CG2 4.2Å; A464-I480 HydrophobicContact CB-CB 3.95Å; A464-I480 HydrophobicContact CB-CG2 4.29Å; A464-I480 PolarHBondContact O-N 2.88Å; Y465-I480 VanDerWaalsContact C-CD1 3.43Å; F466-I480 HydrophobicContact CB-CD1 4.21Å; H478-I480 PolarHBondContact O-N 3.15Å; I480-F484 HydrophobicContact CB-CB 4.46Å; I480-F484 HydrophobicContact CD1-CB 3.69Å; I480-F484 HydrophobicContact CD1-CD1 3.75Å; I480-F484 HydrophobicContact CD1-CD2 3.8Å; I480-F484 HydrophobicContact CD1-CE1 4.33Å; I480-F484 HydrophobicContact CD1-CE2 4.35Å; I480-F484 HydrophobicContact CD1-CG 3.47Å; I480-F484 VanDerWaalsContact CD1-CG 3.47Å; I480-F484 HydrophobicContact CG1-CB 3.91Å; I480-F484 HydrophobicContact CG1-CD2 3.72Å; I480-F484 HydrophobicContact CG1-CE2 4.37Å; I480-F484 HydrophobicContact CG1-CG 3.82Å; I480-F484 HydrophobicContact CG2-CB 3.71Å
481	K	80.7	Confident	86.4	Confident	149 Å²	149	50.9 Å²	50.9	65%	0.648	25%	0.245	S	C	*	.			trans	-83.5	-51	179.5	-66	157.9	-171.8	164	0	111.1	E445 R479	E445-K481 IonicContact OE2-NZ 3.86Å; E445-K481 PolarHBondContact OE2-NZ 2.8Å; R479-K481 PolarHBondContact O-N 2.88Å; R479-K481 VanDerWaalsContact O-N 3.14Å
482	K	78	Confident	86.6	Confident	185 Å²	185	48 Å²	48	80%	0.804	23%	0.23	S	C	*	.	S	Bend	trans	-152.3	154.5	175.4	-63	-173.7	-179.3	176.5	0	109.8
483	N	77.4	Confident	86.9	Confident	138 Å²	138	44.7 Å²	44.7	74%	0.738	21%	0.209	S	C	*	.			trans	38.1	75	169.3	-68.4	-11	0	0	0	117.3
484	F	86.1	Confident	87.2	Confident	13 Å²	13	44.4 Å²	44.4	6%	0.057	21%	0.206	C	C	.	.			trans	-93.1	143.9	172.6	-171.4	-96.5	0	0	0	112.3	R407 Y409 I444 F466 H478 I480 F488	R407-F484 HydrophobicContact CG-CD1 4.25Å; R407-F484 HydrophobicContact CG-CE1 4.06Å; Y409-F484 HydrophobicContact CD1-CB 3.83Å; Y409-F484 HydrophobicContact CE1-CB 3.95Å; Y409-F484 WeakPolarHBondContact CE1-O 3.13Å; Y409-F484 HydrophobicContact CG-CB 4.26Å; I444-F484 HydrophobicContact CD1-CD2 4.13Å; I444-F484 HydrophobicContact CD1-CE2 3.79Å; I444-F484 HydrophobicContact CG1-CD2 4.48Å; I444-F484 HydrophobicContact CG1-CE2 4.37Å; I444-F484 HydrophobicContact CG2-CE2 4.14Å; F466-F484 HydrophobicContact CB-CE1 3.97Å; F466-F484 HydrophobicContact CB-CE2 3.88Å; F466-F484 HydrophobicContact CB-CZ 3.43Å; F466-F484 VanDerWaalsContact CB-CZ 3.43Å; F466-F484 HydrophobicContact CD1-CZ 4.02Å; F466-F484 AromaticContact CD2-CE1 3.93Å; F466-F484 HydrophobicContact CD2-CE1 3.93Å; F466-F484 AromaticContact CD2-CZ 3.76Å; F466-F484 HydrophobicContact CD2-CZ 3.76Å; F466-F484 HydrophobicContact CG-CE1 4.04Å; F466-F484 HydrophobicContact CG-CE2 4.25Å; F466-F484 AromaticContact CG-CZ 3.45Å; F466-F484 HydrophobicContact CG-CZ 3.45Å; F466-F484 VanDerWaalsContact CG-CZ 3.45Å; H478-F484 AromaticContact CD2-CD2 3.9Å; H478-F484 AromaticContact CD2-CE2 3.94Å; I480-F484 HydrophobicContact CB-CB 4.46Å; I480-F484 HydrophobicContact CD1-CB 3.69Å; I480-F484 HydrophobicContact CD1-CD1 3.75Å; I480-F484 HydrophobicContact CD1-CD2 3.8Å; I480-F484 HydrophobicContact CD1-CE1 4.33Å; I480-F484 HydrophobicContact CD1-CE2 4.35Å; I480-F484 HydrophobicContact CD1-CG 3.47Å; I480-F484 VanDerWaalsContact CD1-CG 3.47Å; I480-F484 HydrophobicContact CG1-CB 3.91Å; I480-F484 HydrophobicContact CG1-CD2 3.72Å; I480-F484 HydrophobicContact CG1-CE2 4.37Å; I480-F484 HydrophobicContact CG1-CG 3.82Å; I480-F484 HydrophobicContact CG2-CB 3.71Å; F484-F488 HydrophobicContact CE1-CB 3.82Å; F484-F488 HydrophobicContact CE1-CD1 4.48Å; F484-F488 HydrophobicContact CE1-CG 4.42Å; F484-F488 HydrophobicContact CE2-CD1 4.35Å; F484-F488 HydrophobicContact CE2-CG 4.5Å; F484-F488 HydrophobicContact CZ-CB 3.76Å; F484-F488 AromaticContact CZ-CD1 3.65Å; F484-F488 HydrophobicContact CZ-CD1 3.65Å; F484-F488 AromaticContact CZ-CG 3.85Å; F484-F488 HydrophobicContact CZ-CG 3.85Å
485	P	85.9	Confident	87.2	Confident	28 Å²	28	43 Å²	43	18%	0.182	20%	0.202	C	C	.	.			trans	-70.2	132.2	177.9	-8.4	23	0	0	0	111.2	I444 Q487 F488	I444-P485 HydrophobicContact CD1-CG 4.19Å; P485-Q487 VanDerWaalsContact C-N 3.34Å; P485-Q487 PolarHBondContact O-N 3.07Å; P485-F488 HydrophobicContact CB-CB 4.15Å; P485-F488 HydrophobicContact CG-CB 4.28Å; P485-F488 HydrophobicContact CG-CD2 4.46Å; P485-F488 PolarHBondContact O-N 3.4Å
486	L	85.2	Confident	86.8	Confident	77 Å²	77	49 Å²	49	40%	0.403	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-30.1	-174.8	-65.8	-179.1	0	0	0	113.3	R407 Y409 R410	R407-L486 VanDerWaalsContact CD-O 3.31Å; R407-L486 WeakPolarHBondContact CD-O 3.36Å; R407-L486 PolarHBondContact NH1-O 2.75Å; Y409-L486 HydrophobicContact CD1-CD2 3.99Å; Y409-L486 HydrophobicContact CE1-CD2 4.34Å; R410-L486 HydrophobicContact CB-CD2 4.27Å
487	Q	85.6	Confident	86.4	Confident	35 Å²	35	51.9 Å²	51.9	16%	0.164	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	9.2	-179.6	-47.3	-58.8	-4.3	0	0	113.8	P485 G489 R490 E491	P485-Q487 VanDerWaalsContact C-N 3.34Å; P485-Q487 PolarHBondContact O-N 3.07Å; Q487-G489 PolarHBondContact O-N 3.43Å; Q487-G489 VanDerWaalsContact O-N 3.12Å; Q487-R490 HydrophobicContact CB-CB 4.43Å; Q487-R490 CarbonylContact O-C 3.54Å; Q487-R490 VanDerWaalsContact O-CA 3.31Å; Q487-R490 WeakPolarHBondContact O-CA 3.08Å; Q487-R490 WeakPolarHBondContact O-CB 3.31Å; Q487-R490 PolarHBondContact O-N 3.38Å; Q487-E491 HydrophobicContact CB-CG 4.08Å; Q487-E491 WeakPolarHBondContact CB-OE1 3.42Å; Q487-E491 WeakPolarHBondContact O-CG 3.34Å; Q487-E491 PolarHBondContact O-N 3.46Å
488	F	89.8	Confident	86.2	Confident	1 Å²	1	51.6 Å²	51.6	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-43.6	-52.7	-174.9	-178.9	-103.6	0	0	0	114.3	F435 A439 I444 F466 F484 P485 R490 E491 V492	F435-F488 AromaticContact CD1-CE1 3.92Å; F435-F488 HydrophobicContact CD1-CE1 3.92Å; F435-F488 HydrophobicContact CD1-CZ 4.43Å; F435-F488 HydrophobicContact CE1-CE1 4.18Å; A439-F488 HydrophobicContact CB-CZ 3.92Å; I444-F488 HydrophobicContact CD1-CD2 3.83Å; I444-F488 HydrophobicContact CD1-CE2 3.8Å; I444-F488 HydrophobicContact CD1-CG 4.32Å; I444-F488 HydrophobicContact CD1-CZ 4.26Å; F466-F488 HydrophobicContact CD1-CD1 4.18Å; F466-F488 HydrophobicContact CD1-CE1 4.3Å; F466-F488 AromaticContact CE1-CD1 3.82Å; F466-F488 HydrophobicContact CE1-CD1 3.82Å; F466-F488 AromaticContact CE1-CE1 3.88Å; F466-F488 HydrophobicContact CE1-CE1 3.88Å; F466-F488 HydrophobicContact CE2-CD1 4.4Å; F466-F488 AromaticContact CZ-CD1 3.95Å; F466-F488 HydrophobicContact CZ-CD1 3.95Å; F466-F488 HydrophobicContact CZ-CE1 4.37Å; F484-F488 HydrophobicContact CE1-CB 3.82Å; F484-F488 HydrophobicContact CE1-CD1 4.48Å; F484-F488 HydrophobicContact CE1-CG 4.42Å; F484-F488 HydrophobicContact CE2-CD1 4.35Å; F484-F488 HydrophobicContact CE2-CG 4.5Å; F484-F488 HydrophobicContact CZ-CB 3.76Å; F484-F488 AromaticContact CZ-CD1 3.65Å; F484-F488 HydrophobicContact CZ-CD1 3.65Å; F484-F488 AromaticContact CZ-CG 3.85Å; F484-F488 HydrophobicContact CZ-CG 3.85Å; P485-F488 HydrophobicContact CB-CB 4.15Å; P485-F488 HydrophobicContact CG-CB 4.28Å; P485-F488 HydrophobicContact CG-CD2 4.46Å; P485-F488 PolarHBondContact O-N 3.4Å; F488-R490 PolarHBondContact O-N 2.66Å; F488-E491 PolarHBondContact O-N 2.95Å; F488-E491 VanDerWaalsContact O-N 3.11Å; F488-V492 HydrophobicContact CE1-CG2 4.14Å; F488-V492 HydrophobicContact CE2-CG2 4.09Å; F488-V492 HydrophobicContact CZ-CG2 3.87Å; F488-V492 WeakPolarHBondContact O-CG2 3.37Å; F488-V492 PolarHBondContact O-N 3.36Å
489	G	88.9	Confident	85.9	Confident	2 Å²	2	52.4 Å²	52.4	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-21.4	177.9	0	0	0	0	0	115.4	F405 Q487 L493	F405-G489 VanDerWaalsContact CE1-C 3.42Å; F405-G489 WeakPolarHBondContact CE1-O 3.26Å; Q487-G489 PolarHBondContact O-N 3.43Å; Q487-G489 VanDerWaalsContact O-N 3.12Å; G489-L493 WeakPolarHBondContact O-CD1 3.36Å; G489-L493 WeakPolarHBondContact O-CG 3.3Å
490	R	89.7	Confident	85.8	Confident	9 Å²	9	51.6 Å²	51.6	3%	0.034	26%	0.263	C	S	.	.	H	α-helix	trans	-86.4	-36.7	169	-70.4	-179.7	61.1	120.8	1.5	112.4	G355 L357 F405 Q487 F488 L493 A494 K504 A505	G355-R490 VanDerWaalsContact O-CZ 3.31Å; G355-R490 PolarHBondContact O-NH1 3.46Å; G355-R490 PolarHBondContact O-NH2 3.43Å; L357-R490 HydrophobicContact CD1-CB 4.36Å; L357-R490 HydrophobicContact CD1-CG 4.36Å; F405-R490 HydrophobicContact CZ-CG 4.12Å; Q487-R490 HydrophobicContact CB-CB 4.43Å; Q487-R490 CarbonylContact O-C 3.54Å; Q487-R490 VanDerWaalsContact O-CA 3.31Å; Q487-R490 WeakPolarHBondContact O-CA 3.08Å; Q487-R490 WeakPolarHBondContact O-CB 3.31Å; Q487-R490 PolarHBondContact O-N 3.38Å; F488-R490 PolarHBondContact O-N 2.66Å; R490-L493 PolarHBondContact O-N 3.46Å; R490-A494 WeakPolarHBondContact O-CB 3.4Å; R490-A494 PolarHBondContact O-N 2.85Å; R490-K504 PolarHBondContact NH2-O 3.24Å; R490-A505 PolarHBondContact NE-O 2.78Å
491	E	88.1	Confident	85.7	Confident	53 Å²	53	53 Å²	53	25%	0.248	27%	0.27	C	S	.	.	H	α-helix	trans	-59.9	-45.6	177.3	-70.3	161.7	-157.9	0	0	110.5	Q442 Q487 F488 A494 S495 A505	Q442-E491 PolarHBondContact NE2-OE2 3.47Å; Q487-E491 HydrophobicContact CB-CG 4.08Å; Q487-E491 WeakPolarHBondContact CB-OE1 3.42Å; Q487-E491 WeakPolarHBondContact O-CG 3.34Å; Q487-E491 PolarHBondContact O-N 3.46Å; F488-E491 PolarHBondContact O-N 2.95Å; F488-E491 VanDerWaalsContact O-N 3.11Å; E491-A494 PolarHBondContact O-N 2.68Å; E491-S495 PolarHBondContact O-N 3.32Å; E491-A505 HydrophobicContact CG-CB 4.35Å
492	V	89.6	Confident	85.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.8	-51.2	175.1	178.2	0	0	0	0	111.2	A434 F435 Q438 F488 A494 S495	A434-V492 HydrophobicContact CB-CG1 4.01Å; F435-V492 HydrophobicContact CB-CG1 4.41Å; F435-V492 HydrophobicContact CD1-CB 4.08Å; F435-V492 HydrophobicContact CD1-CG1 3.86Å; F435-V492 HydrophobicContact CD1-CG2 3.72Å; F435-V492 HydrophobicContact CD2-CG1 3.78Å; F435-V492 HydrophobicContact CE1-CB 3.82Å; F435-V492 HydrophobicContact CE1-CG1 3.93Å; F435-V492 HydrophobicContact CE1-CG2 3.76Å; F435-V492 HydrophobicContact CE2-CB 4.45Å; F435-V492 HydrophobicContact CE2-CG1 3.84Å; F435-V492 HydrophobicContact CG-CB 4.49Å; F435-V492 HydrophobicContact CG-CG1 3.76Å; F435-V492 HydrophobicContact CG-CG2 4.39Å; F435-V492 HydrophobicContact CZ-CB 4.01Å; F435-V492 HydrophobicContact CZ-CG1 3.9Å; F435-V492 HydrophobicContact CZ-CG2 4.45Å; Q438-V492 HydrophobicContact CB-CG2 4.25Å; F488-V492 HydrophobicContact CE1-CG2 4.14Å; F488-V492 HydrophobicContact CE2-CG2 4.09Å; F488-V492 HydrophobicContact CZ-CG2 3.87Å; F488-V492 WeakPolarHBondContact O-CG2 3.37Å; F488-V492 PolarHBondContact O-N 3.36Å; V492-A494 VanDerWaalsContact C-N 3.33Å; V492-A494 PolarHBondContact O-N 3.02Å; V492-S495 VanDerWaalsContact O-CB 3.27Å; V492-S495 WeakPolarHBondContact O-CB 3.33Å; V492-S495 PolarHBondContact O-N 3.14Å; V492-S495 PolarHBondContact O-OG 3.03Å
493	L	89.4	Confident	85.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-74.8	-20.6	-175.4	-65.3	176	0	0	0	113.4	L357 V403 F405 I419 V421 I431 F435 G489 R490 I498 L499	L357-L493 HydrophobicContact CD1-CB 3.92Å; V403-L493 HydrophobicContact CB-CD1 4.32Å; V403-L493 HydrophobicContact CG1-CD1 4.03Å; V403-L493 HydrophobicContact CG1-CD2 4.3Å; V403-L493 HydrophobicContact CG2-CD2 4.35Å; F405-L493 HydrophobicContact CD1-CD1 4.26Å; F405-L493 HydrophobicContact CE1-CD1 4.29Å; I419-L493 HydrophobicContact CB-CD1 4.08Å; I419-L493 HydrophobicContact CD1-CD1 3.51Å; I419-L493 HydrophobicContact CG1-CD1 4.41Å; I419-L493 HydrophobicContact CG2-CD1 4.14Å; V421-L493 HydrophobicContact CG2-CD2 4.48Å; I431-L493 HydrophobicContact CG2-CD2 4.2Å; F435-L493 HydrophobicContact CE2-CD2 4.08Å; F435-L493 HydrophobicContact CE2-CG 4.36Å; F435-L493 HydrophobicContact CZ-CD2 4.46Å; F435-L493 HydrophobicContact CZ-CG 4.25Å; G489-L493 WeakPolarHBondContact O-CD1 3.36Å; G489-L493 WeakPolarHBondContact O-CG 3.3Å; R490-L493 PolarHBondContact O-N 3.46Å; L493-I498 HydrophobicContact CD2-CG2 3.88Å; L493-L499 VanDerWaalsContact O-CB 3.24Å; L493-L499 WeakPolarHBondContact O-CB 3.43Å; L493-L499 WeakPolarHBondContact O-CD1 2.98Å; L493-L499 VanDerWaalsContact O-CG 3.23Å; L493-L499 WeakPolarHBondContact O-CG 3.37Å
494	A	88.4	Confident	85.6	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-83.1	-14.6	173.5	0	0	0	0	0	113.6	L357 R490 E491 V492 I501 A505	L357-A494 HydrophobicContact CD2-CB 4Å; R490-A494 WeakPolarHBondContact O-CB 3.4Å; R490-A494 PolarHBondContact O-N 2.85Å; E491-A494 PolarHBondContact O-N 2.68Å; V492-A494 VanDerWaalsContact C-N 3.33Å; V492-A494 PolarHBondContact O-N 3.02Å; A494-I501 HydrophobicContact CB-CG1 4.28Å; A494-I501 CarbonylContact O-C 3.53Å; A494-I501 VanDerWaalsContact O-C 3.31Å; A494-I501 PolarHBondContact O-N 3.29Å; A494-A505 HydrophobicContact CB-CB 4.36Å
495	S	87.1	Confident	85	Confident	24 Å²	24	44 Å²	44	17%	0.168	24%	0.241	C	C	.	.	S	Bend	trans	-58.6	159.1	-175.9	71.6	0	0	0	0	113.7	E491 V492 A497 I498 L499 N500	E491-S495 PolarHBondContact O-N 3.32Å; V492-S495 VanDerWaalsContact O-CB 3.27Å; V492-S495 WeakPolarHBondContact O-CB 3.33Å; V492-S495 PolarHBondContact O-N 3.14Å; V492-S495 PolarHBondContact O-OG 3.03Å; S495-A497 PolarHBondContact O-N 2.82Å; S495-A497 VanDerWaalsContact O-N 3.14Å; S495-I498 PolarHBondContact O-N 3.07Å; S495-I498 VanDerWaalsContact O-N 3.07Å; S495-L499 PolarHBondContact O-N 2.92Å; S495-N500 PolarHBondContact O-N 3.34Å
496	E	81.9	Confident	84.4	Confident	154 Å²	154	44.5 Å²	44.5	72%	0.72	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.7	177.7	-59.2	-170.5	169.6	0	0	113.1
497	A	81.6	Confident	83.7	Confident	62 Å²	62	43.8 Å²	43.8	51%	0.512	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-27.3	178.6	0	0	0	0	0	114.2	S495	S495-A497 PolarHBondContact O-N 2.82Å; S495-A497 VanDerWaalsContact O-N 3.14Å
498	I	87.9	Confident	83	Confident	2 Å²	2	49 Å²	49	1%	0.01	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-51.7	-166.7	-49.9	-56.7	0	0	0	113.8	V421 C425 C426 D430 I431 A434 L493 S495	V421-I498 HydrophobicContact CG1-CG2 4.07Å; V421-I498 HydrophobicContact CG2-CG2 4.31Å; C425-I498 VanDerWaalsContact CB-O 3.28Å; C425-I498 WeakPolarHBondContact CB-O 3.48Å; C426-I498 HydrophobicContact CB-CD1 4.48Å; D430-I498 HydrophobicContact CB-CD1 4.47Å; I431-I498 HydrophobicContact CB-CD1 4.38Å; I431-I498 HydrophobicContact CG1-CD1 3.94Å; I431-I498 HydrophobicContact CG1-CG2 4.25Å; A434-I498 HydrophobicContact CB-CD1 3.84Å; A434-I498 HydrophobicContact CB-CG1 4.02Å; L493-I498 HydrophobicContact CD2-CG2 3.88Å; S495-I498 PolarHBondContact O-N 3.07Å; S495-I498 VanDerWaalsContact O-N 3.07Å
499	L	86.6	Confident	81.9	Confident	32 Å²	32	56 Å²	56	17%	0.168	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	-11.5	177.5	-67.3	177.6	0	0	0	113.7	L357 I419 V421 L493 S495 I501	L357-L499 HydrophobicContact CB-CD1 4.31Å; I419-L499 HydrophobicContact CG2-CD1 4.46Å; V421-L499 HydrophobicContact CB-CD2 4.49Å; V421-L499 HydrophobicContact CG1-CD2 4.01Å; V421-L499 HydrophobicContact CG2-CD2 4.45Å; L493-L499 VanDerWaalsContact O-CB 3.24Å; L493-L499 WeakPolarHBondContact O-CB 3.43Å; L493-L499 WeakPolarHBondContact O-CD1 2.98Å; L493-L499 VanDerWaalsContact O-CG 3.23Å; L493-L499 WeakPolarHBondContact O-CG 3.37Å; S495-L499 PolarHBondContact O-N 2.92Å; L499-I501 HydrophobicContact CB-CD1 3.79Å; L499-I501 HydrophobicContact CB-CG1 3.66Å; L499-I501 HydrophobicContact CD1-CD1 3.93Å; L499-I501 PolarHBondContact O-N 2.87Å
500	N	86.3	Confident	81.3	Confident	105 Å²	105	56.6 Å²	56.6	56%	0.561	29%	0.29	S	S	*	.			trans	50.8	54.4	-179.6	-162.9	6	0	0	0	113.7	S495	S495-N500 PolarHBondContact O-N 3.34Å
501	I	84.6	Confident	80.5	Confident	44 Å²	44	61.7 Å²	61.7	23%	0.226	31%	0.314	C	S	.	.			trans	-139.3	54.8	-179.1	49.8	170.6	0	0	0	110.8	L357 A494 L499 D503 K504	L357-I501 HydrophobicContact CB-CD1 4.04Å; L357-I501 HydrophobicContact CD2-CD1 4.12Å; A494-I501 HydrophobicContact CB-CG1 4.28Å; A494-I501 CarbonylContact O-C 3.53Å; A494-I501 VanDerWaalsContact O-C 3.31Å; A494-I501 PolarHBondContact O-N 3.29Å; L499-I501 HydrophobicContact CB-CD1 3.79Å; L499-I501 HydrophobicContact CB-CG1 3.66Å; L499-I501 HydrophobicContact CD1-CD1 3.93Å; L499-I501 PolarHBondContact O-N 2.87Å; I501-D503 PolarHBondContact O-N 3.34Å; I501-D503 VanDerWaalsContact O-N 3.11Å; I501-K504 HydrophobicContact CB-CB 4.3Å; I501-K504 HydrophobicContact CB-CD 4.22Å; I501-K504 HydrophobicContact CB-CG 4.34Å; I501-K504 HydrophobicContact CD1-CB 4.17Å; I501-K504 HydrophobicContact CD1-CD 3.82Å; I501-K504 HydrophobicContact CG1-CB 4.41Å; I501-K504 WeakPolarHBondContact O-CB 3.46Å; I501-K504 PolarHBondContact O-N 3.49Å
502	P	79.8	Confident	80.3	Confident	66 Å²	66	62.8 Å²	62.8	43%	0.429	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-55.5	-34.6	-173.3	22.4	-33.9	0	0	0	113.3	K504 A505	P502-K504 PolarHBondContact O-N 3.1Å; P502-K504 VanDerWaalsContact O-N 3.12Å; P502-A505 VanDerWaalsContact O-CB 3.31Å; P502-A505 WeakPolarHBondContact O-CB 3.37Å; P502-A505 PolarHBondContact O-N 3.09Å; P502-A505 VanDerWaalsContact O-N 3.08Å
503	D	75.8	Confident	80.1	Confident	132 Å²	132	65 Å²	65	71%	0.706	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-57.6	-25.8	175.9	-56.6	-44.1	0	0	0	113.6	I501 A505	I501-D503 PolarHBondContact O-N 3.34Å; I501-D503 VanDerWaalsContact O-N 3.11Å; D503-A505 VanDerWaalsContact C-N 3.34Å
504	K	79.2	Confident	80	Confident	73 Å²	73	69.5 Å²	69.5	32%	0.317	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-86.1	2.7	-180	-68.7	-171.6	162.3	-173.6	0	114.3	L357 R490 I501 P502 D506 C510	L357-K504 HydrophobicContact CD2-CB 3.79Å; L357-K504 VanDerWaalsContact CD2-O 3.26Å; L357-K504 WeakPolarHBondContact CD2-O 3Å; L357-K504 WeakPolarHBondContact O-CD 3.43Å; L357-K504 PolarHBondContact O-NZ 3.47Å; R490-K504 PolarHBondContact NH2-O 3.24Å; I501-K504 HydrophobicContact CB-CB 4.3Å; I501-K504 HydrophobicContact CB-CD 4.22Å; I501-K504 HydrophobicContact CB-CG 4.34Å; I501-K504 HydrophobicContact CD1-CB 4.17Å; I501-K504 HydrophobicContact CD1-CD 3.82Å; I501-K504 HydrophobicContact CG1-CB 4.41Å; I501-K504 WeakPolarHBondContact O-CB 3.46Å; I501-K504 PolarHBondContact O-N 3.49Å; P502-K504 PolarHBondContact O-N 3.1Å; P502-K504 VanDerWaalsContact O-N 3.12Å; K504-D506 PolarHBondContact O-N 3.3Å; K504-C510 VanDerWaalsContact CA-SG 3.52Å; K504-C510 PolarHBondContact O-SG 3.29Å
505	A	72.8	Confident	79.9	Confident	23 Å²	23	75.6 Å²	75.6	19%	0.19	38%	0.384	C	S	.	.	S	Bend	trans	-58.4	-48.8	179.1	0	0	0	0	0	112.5	R490 E491 A494 P502 D503	R490-A505 PolarHBondContact NE-O 2.78Å; E491-A505 HydrophobicContact CG-CB 4.35Å; A494-A505 HydrophobicContact CB-CB 4.36Å; P502-A505 VanDerWaalsContact O-CB 3.31Å; P502-A505 WeakPolarHBondContact O-CB 3.37Å; P502-A505 PolarHBondContact O-N 3.09Å; P502-A505 VanDerWaalsContact O-N 3.08Å; D503-A505 VanDerWaalsContact C-N 3.34Å
506	D	73.5	Confident	79.9	Confident	39 Å²	39	79.2 Å²	79.2	21%	0.209	40%	0.398	C	S	.	.	S	Bend	trans	-85.1	113	169.7	-168.7	4	0	0	0	111.1	K504 R508 Q509	K504-D506 PolarHBondContact O-N 3.3Å; D506-R508 PolarHBondContact O-N 2.71Å; D506-R508 PolarHBondContact OD1-N 3.05Å; D506-R508 IonicContact OD1-NH1 2.76Å; D506-R508 PolarHBondContact OD1-NH1 3.32Å; D506-R508 IonicContact OD2-CZ 2.68Å; D506-R508 IonicContact OD2-NH1 2.73Å; D506-R508 PolarHBondContact OD2-NH1 3.04Å; D506-Q509 HydrophobicContact CB-CG 4.42Å; D506-Q509 PolarHBondContact O-N 2.52Å
507	W	70.3	Confident	80.2	Confident	62 Å²	62	72.1 Å²	72.1	24%	0.235	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-51.2	-26.3	174.5	72.7	-77.8	0	0	0	114	W328 Q509 C510	W328-W507 HydrophobicContact CZ3-CH2 4.33Å; W507-Q509 PolarHBondContact O-N 3.2Å; W507-C510 WeakPolarHBondContact O-CB 3.13Å; W507-C510 PolarHBondContact O-N 2.99Å
508	R	70.9	Confident	80.5	Confident	146 Å²	146	72 Å²	72	55%	0.551	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-63.3	-27.6	176.5	-62.9	-173.5	-167	89.5	-3.1	113.4	D506 C510	D506-R508 PolarHBondContact O-N 2.71Å; D506-R508 PolarHBondContact OD1-N 3.05Å; D506-R508 IonicContact OD1-NH1 2.76Å; D506-R508 PolarHBondContact OD1-NH1 3.32Å; D506-R508 IonicContact OD2-CZ 2.68Å; D506-R508 IonicContact OD2-NH1 2.73Å; D506-R508 PolarHBondContact OD2-NH1 3.04Å; R508-C510 VanDerWaalsContact C-N 3.3Å
509	Q	68.6	Low	80.5	Confident	146 Å²	146	76 Å²	76	68%	0.682	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-86.2	-8.4	177.6	-54.2	-173.5	45.7	0	0	111.7	D506 W507	D506-Q509 HydrophobicContact CB-CG 4.42Å; D506-Q509 PolarHBondContact O-N 2.52Å; W507-Q509 PolarHBondContact O-N 3.2Å
510	C	74.6	Confident	80.7	Confident	16 Å²	16	76.4 Å²	76.4	11%	0.108	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-97.2	14.9	-179.5	-55	0	0	0	0	113.3	G355 K504 W507 R508 I512	G355-C510 VanDerWaalsContact CA-CB 3.48Å; G355-C510 WeakPolarHBondContact CA-O 3.36Å; G355-C510 WeakPolarHBondContact O-CB 3.41Å; K504-C510 VanDerWaalsContact CA-SG 3.52Å; K504-C510 PolarHBondContact O-SG 3.29Å; W507-C510 WeakPolarHBondContact O-CB 3.13Å; W507-C510 PolarHBondContact O-N 2.99Å; R508-C510 VanDerWaalsContact C-N 3.3Å; C510-I512 PolarHBondContact O-N 3.18Å
511	Q	74	Confident	80.9	Confident	115 Å²	115	71.4 Å²	71.4	54%	0.537	35%	0.354	S	S	.	.			trans	-74	124.8	-175.9	-67.2	-176	8	0	0	111.3
512	I	83.6	Confident	81.1	Confident	76 Å²	76	76.4 Å²	76.4	39%	0.39	37%	0.37	S	S	.	.			trans	-110.4	171.7	176.2	51.4	165	0	0	0	109.9	C510 E516 E517 L520	C510-I512 PolarHBondContact O-N 3.18Å; I512-E516 HydrophobicContact CB-CB 4.35Å; I512-E516 HydrophobicContact CD1-CB 4.01Å; I512-E517 HydrophobicContact CD1-CG 3.86Å; I512-E517 HydrophobicContact CG1-CG 3.82Å; I512-L520 HydrophobicContact CD1-CD1 3.76Å
513	S	86	Confident	81.7	Confident	46 Å²	46	80 Å²	80	32%	0.322	38%	0.375	S	S	.	.			trans	-67.5	157.1	176.8	68.3	0	0	0	0	111.9	E515 E516 E517	S513-E515 PolarHBondContact O-N 3.19Å; S513-E516 VanDerWaalsContact CB-OE2 3.28Å; S513-E516 WeakPolarHBondContact CB-OE2 3.22Å; S513-E516 PolarHBondContact N-OE2 3.23Å; S513-E516 PolarHBondContact O-N 3.41Å; S513-E516 WeakPolarHBondContact OG-CB 3.49Å; S513-E516 WeakPolarHBondContact OG-CG 3.3Å; S513-E516 PolarHBondContact OG-N 2.6Å; S513-E516 PolarHBondContact OG-OE2 3.02Å; S513-E517 PolarHBondContact O-N 3.09Å
514	K	86.4	Confident	82.5	Confident	95 Å²	95	73.9 Å²	73.9	41%	0.413	34%	0.342	S	S	.	.	H	α-helix	trans	-65.2	-32.1	178.2	176	165.5	177.7	156.5	0	111.5	H339 E516 E517 E518	H339-K514 WeakPolarHBondContact ND1-CE 3.46Å; H339-K514 PolarHBondContact ND1-NZ 3.29Å; K514-E516 VanDerWaalsContact C-N 3.34Å; K514-E517 WeakPolarHBondContact O-CB 3.29Å; K514-E517 PolarHBondContact O-N 3.29Å; K514-E518 VanDerWaalsContact CE-OE1 3.27Å; K514-E518 WeakPolarHBondContact CE-OE1 3.19Å; K514-E518 WeakPolarHBondContact O-CB 3.42Å; K514-E518 PolarHBondContact O-N 3.42Å
515	E	86.3	Confident	83.1	Confident	129 Å²	129	74.3 Å²	74.3	60%	0.603	34%	0.341	S	S	*	.	H	α-helix	trans	-66.6	-37.3	178.1	-64.4	67.5	-153.2	0	0	111	S513 T519	S513-E515 PolarHBondContact O-N 3.19Å; E515-T519 WeakPolarHBondContact O-CB 3.32Å; E515-T519 PolarHBondContact O-N 2.97Å; E515-T519 PolarHBondContact O-OG1 3.43Å
516	E	86.6	Confident	83.9	Confident	101 Å²	101	80.5 Å²	80.5	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-70.9	-45.3	170	-69.8	161.7	134.4	0	0	111.5	I512 S513 K514 E518 T519 L520	I512-E516 HydrophobicContact CB-CB 4.35Å; I512-E516 HydrophobicContact CD1-CB 4.01Å; S513-E516 VanDerWaalsContact CB-OE2 3.28Å; S513-E516 WeakPolarHBondContact CB-OE2 3.22Å; S513-E516 PolarHBondContact N-OE2 3.23Å; S513-E516 PolarHBondContact O-N 3.41Å; S513-E516 WeakPolarHBondContact OG-CB 3.49Å; S513-E516 WeakPolarHBondContact OG-CG 3.3Å; S513-E516 PolarHBondContact OG-N 2.6Å; S513-E516 PolarHBondContact OG-OE2 3.02Å; K514-E516 VanDerWaalsContact C-N 3.34Å; E516-E518 VanDerWaalsContact C-N 3.29Å; E516-E518 PolarHBondContact O-N 2.72Å; E516-T519 PolarHBondContact O-N 2.86Å; E516-L520 WeakPolarHBondContact O-CG 3.46Å; E516-L520 PolarHBondContact O-N 3.25Å
517	E	88.8	Confident	84.8	Confident	5 Å²	5	80.6 Å²	80.6	2%	0.023	36%	0.364	C	S	.	.	H	α-helix	trans	-54.2	-44.8	173.5	-73.3	-173.8	158.6	0	0	111.6	H339 L340 K354 I512 S513 K514 A521	H339-E517 IonicContact CD2-OE2 2.73Å; H339-E517 IonicContact CE1-OE2 2.66Å; H339-E517 IonicContact NE2-OE2 3.16Å; H339-E517 PolarHBondContact NE2-OE2 2.84Å; L340-E517 HydrophobicContact CD2-CB 3.79Å; L340-E517 HydrophobicContact CD2-CG 4.09Å; K354-E517 WeakPolarHBondContact CD-OE1 3.48Å; K354-E517 WeakPolarHBondContact CE-OE1 3.31Å; K354-E517 WeakPolarHBondContact CG-OE1 3.35Å; K354-E517 IonicContact NZ-OE1 3.72Å; K354-E517 PolarHBondContact NZ-OE1 2.84Å; K354-E517 VanDerWaalsContact NZ-OE1 3.15Å; K354-E517 IonicContact NZ-OE2 2.75Å; K354-E517 PolarHBondContact NZ-OE2 3.19Å; K354-E517 VanDerWaalsContact NZ-OE2 3.07Å; I512-E517 HydrophobicContact CD1-CG 3.86Å; I512-E517 HydrophobicContact CG1-CG 3.82Å; S513-E517 PolarHBondContact O-N 3.09Å; K514-E517 WeakPolarHBondContact O-CB 3.29Å; K514-E517 PolarHBondContact O-N 3.29Å; E517-A521 VanDerWaalsContact O-CB 3.3Å; E517-A521 WeakPolarHBondContact O-CB 3.44Å; E517-A521 PolarHBondContact O-N 3.21Å
518	E	87.6	Confident	85.8	Confident	60 Å²	60	77.8 Å²	77.8	28%	0.28	35%	0.354	S	S	.	.	H	α-helix	trans	-66.4	-34.2	175.8	-88.9	-172.3	-150.3	0	0	113.6	H339 K514 E516 R522	H339-E518 HydrophobicContact CB-CG 3.63Å; K514-E518 VanDerWaalsContact CE-OE1 3.27Å; K514-E518 WeakPolarHBondContact CE-OE1 3.19Å; K514-E518 WeakPolarHBondContact O-CB 3.42Å; K514-E518 PolarHBondContact O-N 3.42Å; E516-E518 VanDerWaalsContact C-N 3.29Å; E516-E518 PolarHBondContact O-N 2.72Å; E518-R522 VanDerWaalsContact O-CB 3.32Å; E518-R522 WeakPolarHBondContact O-CB 3.49Å; E518-R522 VanDerWaalsContact O-CG 3.24Å; E518-R522 WeakPolarHBondContact O-CG 3.29Å; E518-R522 PolarHBondContact O-N 2.97Å; E518-R522 PolarHBondContact O-NE 3.08Å; E518-R522 IonicContact OE2-CZ 3.96Å; E518-R522 IonicContact OE2-NH2 3.38Å; E518-R522 PolarHBondContact OE2-NH2 3.5Å
519	T	89.4	Confident	86.7	Confident	86 Å²	86	76.5 Å²	76.5	53%	0.528	35%	0.354	S	S	.	.	H	α-helix	trans	-73.5	-42.6	178.7	-61.9	0	0	0	0	110.8	E515 E516 R522 R523	E515-T519 WeakPolarHBondContact O-CB 3.32Å; E515-T519 PolarHBondContact O-N 2.97Å; E515-T519 PolarHBondContact O-OG1 3.43Å; E516-T519 PolarHBondContact O-N 2.86Å; T519-R522 PolarHBondContact O-N 2.69Å; T519-R523 WeakPolarHBondContact O-CB 3.49Å; T519-R523 PolarHBondContact O-N 2.88Å
520	L	89.9	Confident	87.7	Confident	40 Å²	40	74.5 Å²	74.5	21%	0.209	35%	0.354	C	S	.	.	H	α-helix	trans	-62.1	-45.1	171.4	-68.5	-179.3	0	0	0	111.2	L352 D359 I512 E516 R522 R523 F524	L352-L520 HydrophobicContact CD1-CB 3.86Å; D359-L520 HydrophobicContact CB-CD2 4.08Å; I512-L520 HydrophobicContact CD1-CD1 3.76Å; E516-L520 WeakPolarHBondContact O-CG 3.46Å; E516-L520 PolarHBondContact O-N 3.25Å; L520-R522 PolarHBondContact O-N 3.05Å; L520-R523 PolarHBondContact O-N 2.82Å; L520-F524 WeakPolarHBondContact O-CB 3.4Å; L520-F524 PolarHBondContact O-N 3.22Å
521	A	89.4	Confident	88.4	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-62.2	-42.5	176.6	0	0	0	0	0	112	H339 V342 L352 E517 F524 R525	H339-A521 VanDerWaalsContact O-CB 3.26Å; H339-A521 WeakPolarHBondContact O-CB 3.43Å; V342-A521 HydrophobicContact CG1-CB 4.34Å; L352-A521 HydrophobicContact CD1-CB 4Å; E517-A521 VanDerWaalsContact O-CB 3.3Å; E517-A521 WeakPolarHBondContact O-CB 3.44Å; E517-A521 PolarHBondContact O-N 3.21Å; A521-F524 PolarHBondContact O-N 3.24Å; A521-R525 VanDerWaalsContact C-NH1 3.29Å; A521-R525 VanDerWaalsContact O-CG 3.28Å; A521-R525 WeakPolarHBondContact O-CG 3.43Å; A521-R525 PolarHBondContact O-N 3.47Å; A521-R525 PolarHBondContact O-NH1 3.18Å
522	R	89.8	Confident	89.1	Confident	148 Å²	148	71.4 Å²	71.4	56%	0.558	34%	0.338	S	S	*	.	H	α-helix	trans	-64.5	-39.7	175.4	-78.7	179.8	-109.4	-179.7	-9.5	112.4	E518 T519 L520 K526	E518-R522 VanDerWaalsContact O-CB 3.32Å; E518-R522 WeakPolarHBondContact O-CB 3.49Å; E518-R522 VanDerWaalsContact O-CG 3.24Å; E518-R522 WeakPolarHBondContact O-CG 3.29Å; E518-R522 PolarHBondContact O-N 2.97Å; E518-R522 PolarHBondContact O-NE 3.08Å; E518-R522 IonicContact OE2-CZ 3.96Å; E518-R522 IonicContact OE2-NH2 3.38Å; E518-R522 PolarHBondContact OE2-NH2 3.5Å; T519-R522 PolarHBondContact O-N 2.69Å; L520-R522 PolarHBondContact O-N 3.05Å; R522-K526 PolarHBondContact O-N 3.12Å
523	R	92.3	Very high	89.3	Confident	142 Å²	142	69 Å²	69	54%	0.536	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-52.4	173.4	179.8	-178.4	177.8	-175.1	2.3	111.3	T519 L520 R525 K526 D527	T519-R523 WeakPolarHBondContact O-CB 3.49Å; T519-R523 PolarHBondContact O-N 2.88Å; L520-R523 PolarHBondContact O-N 2.82Å; R523-R525 VanDerWaalsContact C-N 3.35Å; R523-R525 PolarHBondContact O-N 2.72Å; R523-K526 PolarHBondContact O-N 3.29Å; R523-D527 IonicContact NE-OD2 2.66Å; R523-D527 VanDerWaalsContact O-CB 3.26Å; R523-D527 WeakPolarHBondContact O-CB 3.25Å; R523-D527 VanDerWaalsContact O-CG 3.3Å; R523-D527 PolarHBondContact O-N 3.29Å
524	F	92.5	Very high	89.1	Confident	3 Å²	3	68.5 Å²	68.5	1%	0.013	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-42.1	-178.4	-167	-76.2	0	0	0	111.7	V342 L350 L352 D360 V362 L391 F394 F395 L520 A521 D527 F528	V342-F524 HydrophobicContact CB-CD1 4.02Å; V342-F524 HydrophobicContact CG1-CB 4.18Å; V342-F524 HydrophobicContact CG1-CD1 3.98Å; V342-F524 HydrophobicContact CG1-CG 4.37Å; V342-F524 HydrophobicContact CG2-CD1 3.87Å; V342-F524 HydrophobicContact CG2-CE1 4.07Å; L350-F524 HydrophobicContact CD2-CE1 3.95Å; L352-F524 HydrophobicContact CD2-CD2 4.26Å; D360-F524 HydrophobicContact CB-CD2 4.5Å; D360-F524 HydrophobicContact CB-CE2 4.27Å; V362-F524 HydrophobicContact CG1-CD1 4.38Å; V362-F524 HydrophobicContact CG1-CD2 4.14Å; V362-F524 HydrophobicContact CG1-CE1 3.91Å; V362-F524 HydrophobicContact CG1-CE2 3.61Å; V362-F524 HydrophobicContact CG1-CZ 3.5Å; V362-F524 VanDerWaalsContact CG1-CZ 3.5Å; V362-F524 HydrophobicContact CG2-CZ 4.25Å; L391-F524 HydrophobicContact CD2-CZ 4.25Å; F394-F524 HydrophobicContact CD1-CZ 4.28Å; F394-F524 HydrophobicContact CE1-CE1 4.45Å; F394-F524 AromaticContact CE1-CE2 3.69Å; F394-F524 HydrophobicContact CE1-CE2 3.69Å; F394-F524 AromaticContact CE1-CZ 3.62Å; F394-F524 HydrophobicContact CE1-CZ 3.62Å; F394-F524 HydrophobicContact CZ-CE2 4.31Å; F394-F524 HydrophobicContact CZ-CZ 4.34Å; F395-F524 HydrophobicContact CE1-CE2 4.28Å; F395-F524 HydrophobicContact CZ-CE2 4.19Å; F395-F524 HydrophobicContact CZ-CZ 4.32Å; L520-F524 WeakPolarHBondContact O-CB 3.4Å; L520-F524 PolarHBondContact O-N 3.22Å; A521-F524 PolarHBondContact O-N 3.24Å; F524-D527 PolarHBondContact O-N 3.05Å; F524-F528 HydrophobicContact CD1-CB 4.05Å; F524-F528 HydrophobicContact CE1-CB 3.82Å; F524-F528 AromaticContact CE1-CD2 3.99Å; F524-F528 HydrophobicContact CE1-CD2 3.99Å; F524-F528 HydrophobicContact CE1-CG 4Å; F524-F528 HydrophobicContact CZ-CD2 4.41Å; F524-F528 WeakPolarHBondContact O-CB 3.43Å; F524-F528 PolarHBondContact O-N 3.27Å
525	R	91.1	Very high	88.5	Confident	82 Å²	82	69.8 Å²	69.8	31%	0.309	33%	0.331	S	S	.	.	H	α-helix	trans	-54.6	-55.5	175	-74.7	-172.8	-157	91.6	-1.9	112	H339 V341 V342 A521 R523 D527 F528 E529	H339-R525 PolarHBondContact O-NH2 3Å; V341-R525 VanDerWaalsContact O-CZ 3.28Å; V341-R525 PolarHBondContact O-NE 2.9Å; V341-R525 VanDerWaalsContact O-NE 3.09Å; V341-R525 PolarHBondContact O-NH2 3Å; V342-R525 HydrophobicContact CB-CG 3.81Å; V342-R525 HydrophobicContact CG1-CG 4.05Å; V342-R525 WeakPolarHBondContact O-CD 3.42Å; V342-R525 VanDerWaalsContact O-CG 3.28Å; V342-R525 WeakPolarHBondContact O-CG 3.43Å; A521-R525 VanDerWaalsContact C-NH1 3.29Å; A521-R525 VanDerWaalsContact O-CG 3.28Å; A521-R525 WeakPolarHBondContact O-CG 3.43Å; A521-R525 PolarHBondContact O-N 3.47Å; A521-R525 PolarHBondContact O-NH1 3.18Å; R523-R525 VanDerWaalsContact C-N 3.35Å; R523-R525 PolarHBondContact O-N 2.72Å; R525-D527 VanDerWaalsContact C-N 3.27Å; R525-D527 PolarHBondContact O-N 3.36Å; R525-F528 PolarHBondContact O-N 3.38Å; R525-E529 WeakPolarHBondContact O-CB 3.4Å; R525-E529 PolarHBondContact O-N 2.75Å
526	K	91.3	Very high	87.1	Confident	154 Å²	154	70.7 Å²	70.7	67%	0.67	34%	0.34	S	S	*	.	H	α-helix	trans	-62.2	-35.3	178.8	-176.9	-178.5	177.5	-176.5	0	112.7	R522 R523	R522-K526 PolarHBondContact O-N 3.12Å; R523-K526 PolarHBondContact O-N 3.29Å
527	D	91.1	Very high	85.1	Confident	40 Å²	40	74 Å²	74	21%	0.214	36%	0.36	C	S	.	.	H	α-helix	trans	-70.7	-33.9	178.5	-83.1	-21.3	0	0	0	112.4	F394 R398 R523 F524 R525	F394-D527 HydrophobicContact CE2-CB 4.31Å; F394-D527 VanDerWaalsContact CE2-O 3.25Å; F394-D527 WeakPolarHBondContact CE2-O 3.23Å; F394-D527 HydrophobicContact CZ-CB 4.18Å; R398-D527 VanDerWaalsContact CZ-CG 3.5Å; R398-D527 IonicContact CZ-OD1 3.15Å; R398-D527 IonicContact CZ-OD2 2.66Å; R398-D527 VanDerWaalsContact NH1-CG 3.31Å; R398-D527 IonicContact NH1-OD1 2.81Å; R398-D527 IonicContact NH1-OD2 3.65Å; R398-D527 PolarHBondContact NH1-OD2 3.07Å; R398-D527 IonicContact NH2-OD1 3.91Å; R398-D527 PolarHBondContact NH2-OD1 2.67Å; R398-D527 IonicContact NH2-OD2 3.78Å; R398-D527 PolarHBondContact NH2-OD2 3.28Å; R398-D527 VanDerWaalsContact NH2-OD2 3.16Å; R523-D527 IonicContact NE-OD2 2.66Å; R523-D527 VanDerWaalsContact O-CB 3.26Å; R523-D527 WeakPolarHBondContact O-CB 3.25Å; R523-D527 VanDerWaalsContact O-CG 3.3Å; R523-D527 PolarHBondContact O-N 3.29Å; F524-D527 PolarHBondContact O-N 3.05Å; R525-D527 VanDerWaalsContact C-N 3.27Å; R525-D527 PolarHBondContact O-N 3.36Å
528	F	92.2	Very high	85	Confident	3 Å²	3	77.5 Å²	77.5	1%	0.013	38%	0.377	C	S	.	.	H	α-helix	trans	-88.6	-24.6	-178.3	-175.3	-98.3	0	0	0	113.6	N343 L350 T390 L391 F394 F524 R525 P530 F531 D532	N343-F528 HydrophobicContact CB-CE1 4.31Å; L350-F528 HydrophobicContact CD2-CE1 4.41Å; L350-F528 HydrophobicContact CD2-CE2 4.28Å; L350-F528 HydrophobicContact CD2-CZ 4.17Å; T390-F528 HydrophobicContact CG2-CE2 3.84Å; T390-F528 HydrophobicContact CG2-CZ 3.7Å; L391-F528 HydrophobicContact CD2-CD2 4.27Å; L391-F528 HydrophobicContact CD2-CE2 3.76Å; L391-F528 HydrophobicContact CG-CE2 4.41Å; F394-F528 HydrophobicContact CD1-CD2 4.26Å; F394-F528 HydrophobicContact CD2-CD2 4.49Å; F394-F528 HydrophobicContact CG-CD2 4.2Å; F524-F528 HydrophobicContact CD1-CB 4.05Å; F524-F528 HydrophobicContact CE1-CB 3.82Å; F524-F528 AromaticContact CE1-CD2 3.99Å; F524-F528 HydrophobicContact CE1-CD2 3.99Å; F524-F528 HydrophobicContact CE1-CG 4Å; F524-F528 HydrophobicContact CZ-CD2 4.41Å; F524-F528 WeakPolarHBondContact O-CB 3.43Å; F524-F528 PolarHBondContact O-N 3.27Å; R525-F528 PolarHBondContact O-N 3.38Å; F528-P530 VanDerWaalsContact C-N 3.31Å; F528-P530 VanDerWaalsContact O-N 3.1Å; F528-F531 WeakPolarHBondContact O-CA 3.46Å; F528-F531 WeakPolarHBondContact O-CB 3.36Å; F528-F531 PolarHBondContact O-N 2.66Å; F528-D532 HydrophobicContact CD1-CB 4.06Å; F528-D532 HydrophobicContact CE1-CB 3.97Å; F528-D532 PolarHBondContact O-N 2.94Å
529	E	89.7	Confident	84.8	Confident	119 Å²	119	78.4 Å²	78.4	56%	0.556	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-41.3	-42.7	179	-178.9	175.1	-152.1	0	0	114.8	R525 F531 D532	R525-E529 WeakPolarHBondContact O-CB 3.4Å; R525-E529 PolarHBondContact O-N 2.75Å; E529-F531 PolarHBondContact O-N 3.49Å; E529-F531 VanDerWaalsContact O-N 3.12Å; E529-D532 PolarHBondContact O-N 2.91Å
530	P	90.3	Very high	84.6	Confident	104 Å²	104	77.9 Å²	77.9	68%	0.675	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-72.2	-1.6	177.1	-16.9	32.8	0	0	0	115.6	F528	F528-P530 VanDerWaalsContact C-N 3.31Å; F528-P530 VanDerWaalsContact O-N 3.1Å
531	F	89.1	Confident	84.2	Confident	44 Å²	44	80.2 Å²	80.2	19%	0.193	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-119.5	-2.3	179.7	-61	-99	0	0	0	111.9	T390 R393 F394 F528 E529 F533	T390-F531 HydrophobicContact CG2-CB 3.98Å; T390-F531 WeakPolarHBondContact CG2-O 3.03Å; R393-F531 HydrophobicContact CG-CD1 4.26Å; R393-F531 HydrophobicContact CG-CE1 4.11Å; F394-F531 HydrophobicContact CB-CD1 4.2Å; F394-F531 HydrophobicContact CB-CE1 4.49Å; F394-F531 HydrophobicContact CB-CG 4.24Å; F394-F531 AromaticContact CD2-CD2 3.75Å; F394-F531 HydrophobicContact CD2-CD2 3.75Å; F394-F531 AromaticContact CD2-CE2 3.81Å; F394-F531 HydrophobicContact CD2-CE2 3.81Å; F394-F531 HydrophobicContact CD2-CG 4.3Å; F394-F531 HydrophobicContact CD2-CZ 4.39Å; F528-F531 WeakPolarHBondContact O-CA 3.46Å; F528-F531 WeakPolarHBondContact O-CB 3.36Å; F528-F531 PolarHBondContact O-N 2.66Å; E529-F531 PolarHBondContact O-N 3.49Å; E529-F531 VanDerWaalsContact O-N 3.12Å; F531-F533 PolarHBondContact O-N 2.96Å; F531-F533 VanDerWaalsContact O-N 3.15Å
532	D	87.7	Confident	83.9	Confident	23 Å²	23	85.2 Å²	85.2	12%	0.123	41%	0.408	C	S	.	.			trans	-78.3	98.1	-168.3	-163.1	-14.3	0	0	0	112.4	N343 F528 E529 T534 L535	N343-D532 PolarHBondContact ND2-OD1 2.98Å; N343-D532 PolarHBondContact ND2-OD2 2.95Å; F528-D532 HydrophobicContact CD1-CB 4.06Å; F528-D532 HydrophobicContact CE1-CB 3.97Å; F528-D532 PolarHBondContact O-N 2.94Å; E529-D532 PolarHBondContact O-N 2.91Å; D532-T534 PolarHBondContact O-N 3.11Å; D532-T534 PolarHBondContact OD1-N 3.4Å; D532-T534 VanDerWaalsContact OD1-N 3.17Å; D532-T534 PolarHBondContact OD1-OG1 3.45Å; D532-L535 HydrophobicContact CB-CD1 4.12Å; D532-L535 HydrophobicContact CB-CG 4.33Å; D532-L535 PolarHBondContact O-N 3.33Å
533	F	87.1	Confident	83.5	Confident	26 Å²	26	81 Å²	81	11%	0.114	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-69.2	-13.6	-178.7	68.1	-95.4	0	0	0	113.7	E383 K386 Y387 T390 F531 L535 D536	E383-F533 HydrophobicContact CG-CE2 4.37Å; E383-F533 HydrophobicContact CG-CZ 4.36Å; K386-F533 HydrophobicContact CB-CD1 4.49Å; K386-F533 HydrophobicContact CB-CE1 3.98Å; K386-F533 HydrophobicContact CB-CE2 4Å; K386-F533 HydrophobicContact CB-CZ 3.71Å; K386-F533 HydrophobicContact CD-CD2 3.85Å; K386-F533 HydrophobicContact CD-CE2 3.66Å; K386-F533 HydrophobicContact CD-CZ 4.26Å; K386-F533 HydrophobicContact CG-CE2 4.48Å; Y387-F533 AromaticContact CD1-CE1 3.7Å; Y387-F533 HydrophobicContact CD1-CE1 3.7Å; Y387-F533 AromaticContact CD1-CZ 3.92Å; Y387-F533 HydrophobicContact CD1-CZ 3.92Å; Y387-F533 HydrophobicContact CD2-CE1 4.45Å; Y387-F533 AromaticContact CD2-CZ 3.92Å; Y387-F533 HydrophobicContact CD2-CZ 3.92Å; Y387-F533 AromaticContact CE1-CE1 3.86Å; Y387-F533 HydrophobicContact CE1-CE1 3.86Å; Y387-F533 AromaticContact CE1-CZ 3.85Å; Y387-F533 HydrophobicContact CE1-CZ 3.85Å; Y387-F533 AromaticContact CE2-CZ 3.86Å; Y387-F533 HydrophobicContact CE2-CZ 3.86Å; Y387-F533 HydrophobicContact CG-CE1 4.01Å; Y387-F533 AromaticContact CG-CZ 3.94Å; Y387-F533 HydrophobicContact CG-CZ 3.94Å; Y387-F533 AromaticContact CZ-CZ 3.82Å; T390-F533 HydrophobicContact CG2-CD1 4.24Å; F531-F533 PolarHBondContact O-N 2.96Å; F531-F533 VanDerWaalsContact O-N 3.15Å; F533-L535 PolarHBondContact O-N 3.25Å; F533-D536 PolarHBondContact O-N 2.65Å
534	T	83.5	Confident	82.9	Confident	35 Å²	35	76.6 Å²	76.6	22%	0.215	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-80.4	9.6	179.6	81.3	0	0	0	0	112.8	N343 D532	N343-T534 PolarHBondContact ND2-OG1 3.25Å; D532-T534 PolarHBondContact O-N 3.11Å; D532-T534 PolarHBondContact OD1-N 3.4Å; D532-T534 VanDerWaalsContact OD1-N 3.17Å; D532-T534 PolarHBondContact OD1-OG1 3.45Å
535	L	71.9	Confident	82.2	Confident	122 Å²	122	82.3 Å²	82.3	64%	0.639	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-104.4	-10.6	173.2	-57.5	178.4	0	0	0	112.6	D532 F533	D532-L535 HydrophobicContact CB-CD1 4.12Å; D532-L535 HydrophobicContact CB-CG 4.33Å; D532-L535 PolarHBondContact O-N 3.33Å; F533-L535 PolarHBondContact O-N 3.25Å
536	D	58.3	Low	81.4	Confident	148 Å²	148	82.3 Å²	82.3	79%	0.791	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-11.3	-175.5	-71.5	-35.6	0	0	0	114.1	F533	F533-D536 PolarHBondContact O-N 2.65Å
537	D	44.9	Very low	80.5	Confident	170 Å²	170	75.8 Å²	75.8	91%	0.909	40%	0.404	S	S	*	.			trans	-96.9	0	180	-84.6	-41.8	0	0	0	112.5	K386	K386-D537 IonicContact NZ-OD1 3.07Å; K386-D537 IonicContact NZ-OD2 2.7Å; K386-D537 PolarHBondContact NZ-OD2 2.7Å

Retrieved 537 of 537 residues in 201.4 ms (Link to these results)

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