A0A3Q0KGB7_SCHMA Loading...

Agenet-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KGB7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 799 aa.

						>A0A3Q0KGB7_SCHMA|A0A3Q0KGB7
MELTIPVEQIGSEHQKIPALLVGIEKTVCTIRYTANHCTIKVGLSELQLAPNAFSINEKLDVQSGSSENEEMPHNSNHNFSPRDPVEVWLDSGSTAKKKSTADVETSGSVESVSIAPPGAWWPGRVLTIQGGFAHVEVAAPLQEYTGVEDKPTAHAMPHLIGLGSVVLPYRSTLVKVTEIRVPWNGKFSCDHTEDRSQTGTLTSGFIKDNVVESNNLLVTGILHRHSICIPAYLYRLAANPESHSTLAKFCGAPCLIQCDSEPFLPGTFAKLILGDKEGSNGSGRHSPVHADYGSMSPSLCLSTYTWPSPSLISQAAMMNVPYIAGTLSPAGITDPNILLTGLPGANGPLVLLHIWSGSSEAIRRATFLELGHIRLLAVRFHLLKNLSKGETGDLELSNSGELDVEDGDAPAIHCKPISIPATVSSDKQASGGMIIGYECRFRILPHLIGLAIGHRGATIQEARGIPGVRAVDLLFDGIVHVEAETIEACHAVRNLLDFTEVEIPVQPRLASRLIGSKGMNIRKLAEAAGVRRAKLLDPFARKRRLMAQRQGHCPVRGGSVTDGDAHEDTSNGEETDNGNEKLSVNLDGYLDDNKNSGGIADLSPAFSLVGTRSSVAKMRLLLEFQADNWNELDELEEARRSLFSQLRQTNQLNHQSDSVSPTRISNGRPSRGGGNFGRNRTVGRGRRQPESFVPEQSLDDKEVSHPPNAHGQHLRGKNIHQSDVPNNNMKSRHSSVNDSYSCYSNGVMSIGDHENTQVNNKAIKNDDLGANNVNDDQTSKQNNGTFRRSQNRNKARAS
					

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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	54.9	Low	82.6	Confident	121 Å²	121	32.5 Å²	32.5	60%	0.596	17%	0.169	S	C	*	.				0	111.4	0	-173.5	178.2	-171.4	0	0	108.2	I56 A248 K249	M1-I56 HydrophobicContact CE-CD1 3.57Å; M1-I56 HydrophobicContact CE-CG1 4.27Å; M1-I56 HydrophobicContact SD-CD1 4.39Å; M1-A248 HydrophobicContact CE-CB 4.37Å; M1-A248 HydrophobicContact SD-CB 4.49Å; M1-K249 HydrophobicContact SD-CG 3.95Å
2	E	68.6	Low	82	Confident	111 Å²	111	38.2 Å²	38.2	52%	0.519	21%	0.213	S	C	.	.			trans	-77.6	147.7	172.8	-57.5	-160.2	103.2	0	0	110.3	T4 L20 R32	E2-T4 HydrophobicContact CB-CG2 4.09Å; E2-T4 PolarHBondContact O-N 2.89Å; E2-L20 WeakPolarHBondContact OE2-CD1 3.44Å; E2-R32 IonicContact OE1-CZ 3.16Å; E2-R32 IonicContact OE1-NH2 2.74Å; E2-R32 PolarHBondContact OE1-NH2 3.02Å; E2-R32 IonicContact OE2-CZ 2.82Å; E2-R32 IonicContact OE2-NH2 3.41Å; E2-R32 PolarHBondContact OE2-NH2 3.2Å
3	L	83.9	Confident	81.2	Confident	21 Å²	21	38.1 Å²	38.1	11%	0.11	21%	0.21	C	C	.	.	S	Bend	trans	-83.7	62.9	172.6	-63.2	-168.2	0	0	0	110.9	P241 H244 A248 C255 L256 I257	L3-P241 HydrophobicContact CD1-CB 3.78Å; L3-P241 WeakPolarHBondContact CD1-O 3.21Å; L3-P241 HydrophobicContact CG-CB 4.33Å; L3-H244 HydrophobicContact CD1-CB 3.93Å; L3-A248 HydrophobicContact CD2-CB 3.27Å; L3-C255 CarbonylContact C-O 3.53Å; L3-C255 VanDerWaalsContact C-O 3.27Å; L3-C255 VanDerWaalsContact CA-O 3.3Å; L3-C255 WeakPolarHBondContact CA-O 3.32Å; L3-L256 VanDerWaalsContact O-CD1 3.31Å; L3-L256 WeakPolarHBondContact O-CD1 3.21Å; L3-I257 HydrophobicContact CD1-CB 4.18Å; L3-I257 HydrophobicContact CD1-CD1 4.38Å; L3-I257 HydrophobicContact CD1-CG1 4.43Å
4	T	89.6	Confident	80.8	Confident	15 Å²	15	41.3 Å²	41.3	9%	0.092	22%	0.223	C	C	.	.			trans	-134.2	148.5	-176.6	59	0	0	0	0	111	E2 L20 L21 V22	E2-T4 HydrophobicContact CB-CG2 4.09Å; E2-T4 PolarHBondContact O-N 2.89Å; T4-L20 HydrophobicContact CG2-CB 4.41Å; T4-L21 VanDerWaalsContact CA-O 3.22Å; T4-L21 WeakPolarHBondContact CA-O 3.37Å; T4-L21 WeakPolarHBondContact CB-O 3.39Å; T4-V22 HydrophobicContact CG2-CG2 4.05Å
5	I	89.5	Confident	81.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.6	175.8	-56.6	169.7	0	0	0	109.1	V7 L21 L49 A53 L223 L256 W356	I5-V7 PolarHBondContact O-N 3.12Å; I5-L21 HydrophobicContact CB-CB 4.27Å; I5-L21 PolarHBondContact N-O 3.33Å; I5-L21 WeakPolarHBondContact O-CB 3.47Å; I5-L21 PolarHBondContact O-N 3.2Å; I5-L49 HydrophobicContact CG2-CD2 3.69Å; I5-A53 HydrophobicContact CG2-CB 4.11Å; I5-L223 HydrophobicContact CD1-CD1 3.96Å; I5-L256 HydrophobicContact CD1-CB 3.9Å; I5-L256 HydrophobicContact CG1-CB 3.99Å; I5-W356 HydrophobicContact CD1-CB 3.88Å
6	P	89.8	Confident	81.4	Confident	14 Å²	14	40.1 Å²	40.1	9%	0.091	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	125.8	170.8	-27.6	36.1	0	0	0	112.7	L20 A50 N52 A53 P254	P6-L20 HydrophobicContact CG-CD2 4.42Å; P6-A50 HydrophobicContact CB-CB 3.86Å; P6-A50 PolarHBondContact O-N 2.86Å; P6-A50 VanDerWaalsContact O-N 3.08Å; P6-N52 WeakPolarHBondContact CB-OD1 3.41Å; P6-A53 HydrophobicContact CB-CB 4.4Å; P6-A53 WeakPolarHBondContact O-CB 3.16Å; P6-P254 HydrophobicContact CG-CG 4.34Å
7	V	89.5	Confident	81.8	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	164.5	-178.4	-69.5	0	0	0	0	110.7	I5 A19 L21 I31 Q48 L49 L217	I5-V7 PolarHBondContact O-N 3.12Å; V7-A19 HydrophobicContact CG2-CB 4.15Å; V7-A19 PolarHBondContact N-O 2.83Å; V7-A19 CarbonylContact O-C 3.59Å; V7-A19 PolarHBondContact O-N 2.73Å; V7-L21 HydrophobicContact CG1-CB 3.92Å; V7-L21 HydrophobicContact CG1-CD2 4.3Å; V7-L21 HydrophobicContact CG2-CB 4Å; V7-I31 HydrophobicContact CG2-CG2 4.16Å; V7-Q48 CarbonylContact C-O 3.49Å; V7-Q48 VanDerWaalsContact CA-O 3.26Å; V7-Q48 WeakPolarHBondContact CA-O 3.39Å; V7-Q48 WeakPolarHBondContact CB-O 3.33Å; V7-L49 HydrophobicContact CG1-CD2 4.34Å; V7-L217 HydrophobicContact CG1-CD1 4.25Å
8	E	88.7	Confident	82.2	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.019	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129.1	170.6	-56.3	-179.6	156.3	0	0	108.9	K16 I17 Q48 A50 R181	E8-K16 HydrophobicContact CB-CB 4.31Å; E8-I17 CarbonylContact C-O 3.57Å; E8-I17 VanDerWaalsContact CA-O 3.31Å; E8-I17 WeakPolarHBondContact CA-O 3.48Å; E8-Q48 HydrophobicContact CB-CG 3.93Å; E8-Q48 PolarHBondContact N-O 2.79Å; E8-Q48 PolarHBondContact O-N 2.6Å; E8-Q48 PolarHBondContact OE2-NE2 2.76Å; E8-A50 HydrophobicContact CG-CB 3.9Å; E8-R181 VanDerWaalsContact CD-NH2 3.26Å; E8-R181 IonicContact OE1-CZ 3.7Å; E8-R181 VanDerWaalsContact OE1-CZ 3.26Å; E8-R181 IonicContact OE1-NH1 2.86Å; E8-R181 PolarHBondContact OE1-NH1 2.72Å; E8-R181 IonicContact OE1-NH2 2.9Å; E8-R181 PolarHBondContact OE1-NH2 3.33Å; E8-R181 IonicContact OE2-CZ 2.68Å; E8-R181 IonicContact OE2-NH2 2.56Å; E8-R181 PolarHBondContact OE2-NH2 2.95Å
9	Q	88.5	Confident	82.6	Confident	18 Å²	18	35.7 Å²	35.7	8%	0.084	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129	172.1	-173.3	178.2	6.3	0	0	109.9	G11 K16 I17 I31 Y33 V42 E46 L47	Q9-G11 PolarHBondContact O-N 3.22Å; Q9-K16 CarbonylContact O-C 3.44Å; Q9-K16 WeakPolarHBondContact O-CA 3.5Å; Q9-I17 PolarHBondContact N-O 3.33Å; Q9-I17 PolarHBondContact O-N 2.81Å; Q9-I31 HydrophobicContact CB-CD1 4.2Å; Q9-Y33 PolarHBondContact OE1-OH 2.68Å; Q9-Y33 VanDerWaalsContact OE1-OH 3.12Å; Q9-V42 HydrophobicContact CG-CG1 4.17Å; Q9-E46 CarbonylContact C-O 3.6Å; Q9-E46 WeakPolarHBondContact CA-O 3.34Å; Q9-E46 HydrophobicContact CG-CB 4.43Å; Q9-E46 PolarHBondContact NE2-OE2 3.39Å; Q9-L47 HydrophobicContact CB-CD2 3.95Å; Q9-L47 HydrophobicContact CG-CD2 4.21Å
10	I	86.3	Confident	82.9	Confident	38 Å²	38	35.7 Å²	35.7	20%	0.195	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	102.8	173.3	-55	171.2	0	0	0	107	E46	I10-E46 PolarHBondContact N-O 3.07Å
11	G	79.4	Confident	83.3	Confident	14 Å²	14	34 Å²	34	14%	0.144	18%	0.182	C	C	.	.			trans	-71.5	167.3	175.4	0	0	0	0	0	112.7	Q9 E13 H14 Q15	Q9-G11 PolarHBondContact O-N 3.22Å; G11-E13 PolarHBondContact O-N 2.83Å; G11-H14 WeakPolarHBondContact O-CA 3.4Å; G11-H14 PolarHBondContact O-N 3.37Å; G11-Q15 PolarHBondContact N-O 2.96Å
12	S	75.3	Confident	84.9	Confident	101 Å²	101	30.5 Å²	30.5	71%	0.706	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.9	-178.3	50.9	0	0	0	0	114.3	H14 V166	S12-H14 VanDerWaalsContact C-N 3.28Å; S12-H14 PolarHBondContact O-N 2.8Å; S12-V166 WeakPolarHBondContact O-CG2 3.25Å
13	E	72.1	Confident	85.8	Confident	37 Å²	37	25.6 Å²	25.6	17%	0.173	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	22.8	174.9	-57.8	-170.2	-160.2	0	0	112.2	G11 Q15 K97 W122 P141 V166 L168	G11-E13 PolarHBondContact O-N 2.83Å; E13-Q15 PolarHBondContact O-N 2.95Å; E13-K97 IonicContact OE1-NZ 2.68Å; E13-K97 PolarHBondContact OE1-NZ 3.1Å; E13-K97 IonicContact OE2-NZ 3.21Å; E13-K97 PolarHBondContact OE2-NZ 3.32Å; E13-W122 HydrophobicContact CB-CH2 4.08Å; E13-W122 HydrophobicContact CB-CZ3 3.89Å; E13-P141 WeakPolarHBondContact OE2-CG 3.43Å; E13-V166 HydrophobicContact CG-CG1 4.34Å; E13-L168 HydrophobicContact CB-CD1 4.32Å; E13-L168 HydrophobicContact CB-CD2 4.38Å; E13-L168 WeakPolarHBondContact O-CD1 3.26Å; E13-L168 WeakPolarHBondContact OE2-CD2 3.33Å
14	H	75.3	Confident	86	Confident	83 Å²	83	24.8 Å²	24.8	38%	0.384	14%	0.143	S	C	.	.	S	Bend	trans	59.9	7.7	-177.6	-70.1	-84.7	0	0	0	116.5	G11 S12 L163	G11-H14 WeakPolarHBondContact O-CA 3.4Å; G11-H14 PolarHBondContact O-N 3.37Å; S12-H14 VanDerWaalsContact C-N 3.28Å; S12-H14 PolarHBondContact O-N 2.8Å; H14-L163 HydrophobicContact CB-CD1 4.43Å; H14-L163 PolarHBondContact CD2-O 2.89Å; H14-L163 PolarHBondContact NE2-O 2.99Å
15	Q	84.6	Confident	85.5	Confident	30 Å²	30	28.8 Å²	28.8	14%	0.14	16%	0.16	C	C	.	.			trans	-58	138.2	166.1	64.8	-166.9	99.6	0	0	111.9	G11 E13 I17 A120 W121 W122	G11-Q15 PolarHBondContact N-O 2.96Å; E13-Q15 PolarHBondContact O-N 2.95Å; Q15-I17 HydrophobicContact CG-CD1 4.44Å; Q15-I17 HydrophobicContact CG-CG1 4.23Å; Q15-A120 HydrophobicContact CB-CB 3.99Å; Q15-W121 WeakPolarHBondContact CA-O 3.5Å; Q15-W122 HydrophobicContact CB-CD2 3.93Å; Q15-W122 HydrophobicContact CB-CE3 3.96Å; Q15-W122 HydrophobicContact CB-CH2 3.8Å; Q15-W122 HydrophobicContact CB-CZ2 3.75Å; Q15-W122 HydrophobicContact CB-CZ3 3.9Å; Q15-W122 HydrophobicContact CG-CH2 4.26Å; Q15-W122 HydrophobicContact CG-CZ2 4.34Å
16	K	87	Confident	84.8	Confident	33 Å²	33	36 Å²	36	14%	0.143	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	109.1	176.4	-71.5	168.1	172.1	-177.3	0	109.6	E8 Q9 Q48 E87 W121 W184	E8-K16 HydrophobicContact CB-CB 4.31Å; Q9-K16 CarbonylContact O-C 3.44Å; Q9-K16 WeakPolarHBondContact O-CA 3.5Å; K16-Q48 VanDerWaalsContact CD-NE2 3.34Å; K16-Q48 VanDerWaalsContact CE-NE2 3.25Å; K16-E87 IonicContact NZ-OE1 3.76Å; K16-E87 PolarHBondContact NZ-OE1 2.87Å; K16-E87 IonicContact NZ-OE2 2.69Å; K16-W121 HydrophobicContact CB-CB 4.13Å; K16-W121 PolarHBondContact N-O 2.71Å; K16-W121 PolarHBondContact O-N 3.1Å; K16-W184 PolarHBondContact NZ-O 3.27Å
17	I	87.5	Confident	84.1	Confident	9 Å²	9	39.3 Å²	39.3	5%	0.046	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.7	-174.9	-48.8	166.6	0	0	0	109.8	E8 Q9 Q15 Y33 P117 A120	E8-I17 CarbonylContact C-O 3.57Å; E8-I17 VanDerWaalsContact CA-O 3.31Å; E8-I17 WeakPolarHBondContact CA-O 3.48Å; Q9-I17 PolarHBondContact N-O 3.33Å; Q9-I17 PolarHBondContact O-N 2.81Å; Q15-I17 HydrophobicContact CG-CD1 4.44Å; Q15-I17 HydrophobicContact CG-CG1 4.23Å; I17-Y33 HydrophobicContact CB-CE1 4.23Å; I17-Y33 HydrophobicContact CG2-CD1 3.78Å; I17-Y33 HydrophobicContact CG2-CE1 3.53Å; I17-P117 HydrophobicContact CD1-CG 4.32Å; I17-P117 HydrophobicContact CG2-CB 3.71Å; I17-P117 HydrophobicContact CG2-CG 4.32Å; I17-A120 HydrophobicContact CG1-CB 4Å
18	P	88.9	Confident	83.8	Confident	26 Å²	26	41.8 Å²	41.8	17%	0.169	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	135.1	179.9	-23.4	34.9	0	0	0	113.9	T34 W89	P18-T34 HydrophobicContact CB-CG2 4.3Å; P18-W89 HydrophobicContact CG-CH2 4.04Å; P18-W89 HydrophobicContact CG-CZ3 3.65Å
19	A	89.4	Confident	83.6	Confident	3 Å²	3	41.6 Å²	41.6	3%	0.025	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	171.9	177.6	0	0	0	0	0	111.9	V7 I31 R32 Y33	V7-A19 HydrophobicContact CG2-CB 4.15Å; V7-A19 PolarHBondContact N-O 2.83Å; V7-A19 CarbonylContact O-C 3.59Å; V7-A19 PolarHBondContact O-N 2.73Å; A19-I31 HydrophobicContact CB-CB 4.18Å; A19-I31 HydrophobicContact CB-CD1 3.9Å; A19-I31 HydrophobicContact CB-CG1 4.47Å; A19-R32 CarbonylContact C-O 3.43Å; A19-R32 WeakPolarHBondContact CA-O 3.42Å; A19-R32 WeakPolarHBondContact CB-O 3.31Å; A19-Y33 HydrophobicContact CB-CD1 4.28Å
20	L	90.2	Very high	83.7	Confident	34 Å²	34	42 Å²	42	18%	0.178	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	129.1	173.2	-60.8	175.3	0	0	0	108.5	E2 T4 P6 V22 I31 R32 T34	E2-L20 WeakPolarHBondContact OE2-CD1 3.44Å; T4-L20 HydrophobicContact CG2-CB 4.41Å; P6-L20 HydrophobicContact CG-CD2 4.42Å; L20-V22 PolarHBondContact O-N 2.76Å; L20-I31 CarbonylContact O-C 3.55Å; L20-I31 VanDerWaalsContact O-CA 3.27Å; L20-I31 WeakPolarHBondContact O-CA 3.3Å; L20-R32 PolarHBondContact N-O 3.3Å; L20-R32 PolarHBondContact O-N 2.94Å; L20-T34 HydrophobicContact CG-CG2 4.31Å
21	L	90.2	Very high	83.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	116.3	174.6	-178.9	59.5	0	0	0	109.1	T4 I5 V7 I24 C29 I31 L47 L217 L256	T4-L21 VanDerWaalsContact CA-O 3.22Å; T4-L21 WeakPolarHBondContact CA-O 3.37Å; T4-L21 WeakPolarHBondContact CB-O 3.39Å; I5-L21 HydrophobicContact CB-CB 4.27Å; I5-L21 PolarHBondContact N-O 3.33Å; I5-L21 WeakPolarHBondContact O-CB 3.47Å; I5-L21 PolarHBondContact O-N 3.2Å; V7-L21 HydrophobicContact CG1-CB 3.92Å; V7-L21 HydrophobicContact CG1-CD2 4.3Å; V7-L21 HydrophobicContact CG2-CB 4Å; L21-I24 HydrophobicContact CD1-CG1 4.32Å; L21-I24 HydrophobicContact CD2-CD1 4.13Å; L21-I24 HydrophobicContact CD2-CG1 4.34Å; L21-C29 HydrophobicContact CD1-CB 3.56Å; L21-I31 HydrophobicContact CD1-CG2 4.02Å; L21-L47 HydrophobicContact CD1-CD1 4.46Å; L21-L217 HydrophobicContact CD2-CD1 4.14Å; L21-L256 HydrophobicContact CG-CD2 4.2Å
22	V	89.8	Confident	84.4	Confident	48 Å²	48	41.4 Å²	41.4	29%	0.291	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-23	-170.2	-173	0	0	0	0	112.8	T4 L20 T30 R32 L256	T4-V22 HydrophobicContact CG2-CG2 4.05Å; L20-V22 PolarHBondContact O-N 2.76Å; V22-T30 PolarHBondContact N-O 2.84Å; V22-R32 HydrophobicContact CG2-CB 3.68Å; V22-L256 VanDerWaalsContact O-CD1 3.29Å; V22-L256 WeakPolarHBondContact O-CD1 3.39Å
23	G	87	Confident	84.9	Confident	8 Å²	8	37.9 Å²	37.9	8%	0.082	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	156	177.9	0	0	0	0	0	112.5	T30	G23-T30 PolarHBondContact N-O 3.39Å; G23-T30 PolarHBondContact O-N 3.44Å
24	I	86.7	Confident	85.3	Confident	5 Å²	5	39 Å²	39	3%	0.026	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	114.7	178.9	-63.2	173.1	0	0	0	108.6	L21 L223 L256 Q258 A325 W356	L21-I24 HydrophobicContact CD1-CG1 4.32Å; L21-I24 HydrophobicContact CD2-CD1 4.13Å; L21-I24 HydrophobicContact CD2-CG1 4.34Å; I24-L223 HydrophobicContact CD1-CD2 4.17Å; I24-L256 HydrophobicContact CD1-CD2 3.94Å; I24-L256 HydrophobicContact CG1-CD2 3.83Å; I24-Q258 PolarHBondContact O-NE2 2.88Å; I24-Q258 PolarHBondContact O-OE1 3.1Å; I24-A325 HydrophobicContact CD1-CB 4.48Å; I24-A325 HydrophobicContact CG2-CB 3.92Å; I24-W356 HydrophobicContact CB-CH2 4.16Å; I24-W356 HydrophobicContact CB-CZ2 4.03Å; I24-W356 HydrophobicContact CD1-CD2 3.75Å; I24-W356 HydrophobicContact CD1-CE3 4.31Å; I24-W356 HydrophobicContact CD1-CG 3.92Å; I24-W356 HydrophobicContact CD1-CZ2 4.1Å; I24-W356 HydrophobicContact CG2-CZ2 4.14Å
25	E	80	Confident	85	Confident	98 Å²	98	37.8 Å²	37.8	46%	0.458	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	86	176.7	-71	175.2	-154.7	0	0	108.9	T27 V28 K41	E25-T27 PolarHBondContact O-N 3.04Å; E25-V28 CarbonylContact C-O 3.49Å; E25-V28 PolarHBondContact N-O 2.98Å; E25-V28 PolarHBondContact O-N 2.99Å; E25-K41 WeakPolarHBondContact OE1-CE 3.45Å; E25-K41 IonicContact OE1-NZ 3.26Å; E25-K41 PolarHBondContact OE1-NZ 3.05Å; E25-K41 IonicContact OE2-NZ 3.86Å; E25-K41 PolarHBondContact OE2-NZ 3.12Å
26	K	75.6	Confident	84.3	Confident	152 Å²	152	40.2 Å²	40.2	66%	0.661	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	-105.4	-178	-56.8	168	-174.2	172.1	0	111.1	Y323	K26-Y323 CarbonylContact C-O 3.53Å; K26-Y323 WeakPolarHBondContact CA-O 3.25Å; K26-Y323 VanDerWaalsContact O-O 3.04Å
27	T	73.8	Confident	83.9	Confident	84 Å²	84	44.9 Å²	44.9	52%	0.515	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-9.7	179.6	51.9	0	0	0	0	114.2	E25	E25-T27 PolarHBondContact O-N 3.04Å
28	V	82.6	Confident	83.6	Confident	52 Å²	52	46.6 Å²	46.6	32%	0.315	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.9	-175.9	-178.4	0	0	0	0	109.9	E25 K41	E25-V28 CarbonylContact C-O 3.49Å; E25-V28 PolarHBondContact N-O 2.98Å; E25-V28 PolarHBondContact O-N 2.99Å; V28-K41 HydrophobicContact CG1-CB 3.76Å; V28-K41 HydrophobicContact CG1-CD 4.13Å; V28-K41 HydrophobicContact CG1-CG 4.16Å
29	C	86	Confident	83.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.5	175.7	-72.7	0	0	0	0	110.5	L21 I31 K41 V42 L44 L47	L21-C29 HydrophobicContact CD1-CB 3.56Å; C29-I31 HydrophobicContact CB-CG2 4.49Å; C29-K41 CarbonylContact O-C 3.56Å; C29-K41 WeakPolarHBondContact O-CA 3.27Å; C29-V42 PolarHBondContact N-O 2.85Å; C29-V42 PolarHBondContact O-N 3.17Å; C29-L44 WeakPolarHBondContact SG-CD2 3.43Å; C29-L47 HydrophobicContact CB-CD1 3.52Å
30	T	89.7	Confident	83.4	Confident	27 Å²	27	51.4 Å²	51.4	17%	0.166	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	114.1	166.2	-58.9	0	0	0	0	108.1	V22 G23 K41	V22-T30 PolarHBondContact N-O 2.84Å; G23-T30 PolarHBondContact N-O 3.39Å; G23-T30 PolarHBondContact O-N 3.44Å; T30-K41 WeakPolarHBondContact OG1-CE 3.49Å
31	I	90.6	Very high	83.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	155.5	176	66.2	165.5	0	0	0	111	V7 Q9 A19 L20 L21 C29 T39 I40 V42 L47	V7-I31 HydrophobicContact CG2-CG2 4.16Å; Q9-I31 HydrophobicContact CB-CD1 4.2Å; A19-I31 HydrophobicContact CB-CB 4.18Å; A19-I31 HydrophobicContact CB-CD1 3.9Å; A19-I31 HydrophobicContact CB-CG1 4.47Å; L20-I31 CarbonylContact O-C 3.55Å; L20-I31 VanDerWaalsContact O-CA 3.27Å; L20-I31 WeakPolarHBondContact O-CA 3.3Å; L21-I31 HydrophobicContact CD1-CG2 4.02Å; C29-I31 HydrophobicContact CB-CG2 4.49Å; I31-T39 CarbonylContact O-C 3.44Å; I31-T39 WeakPolarHBondContact O-CA 3.36Å; I31-I40 HydrophobicContact CD1-CD1 4.23Å; I31-I40 HydrophobicContact CD1-CG1 4.06Å; I31-I40 HydrophobicContact CG1-CD1 4.39Å; I31-I40 HydrophobicContact CG1-CG1 3.7Å; I31-I40 PolarHBondContact N-O 3.35Å; I31-I40 PolarHBondContact O-N 2.78Å; I31-V42 HydrophobicContact CD1-CB 4.46Å; I31-V42 HydrophobicContact CD1-CG2 3.78Å; I31-V42 HydrophobicContact CG1-CG2 3.9Å; I31-L47 HydrophobicContact CD1-CD2 4.17Å; I31-L47 HydrophobicContact CG2-CD1 3.76Å; I31-L47 HydrophobicContact CG2-CD2 4Å
32	R	89.6	Confident	83.2	Confident	40 Å²	40	55.9 Å²	55.9	15%	0.151	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.6	173.9	177.8	167.7	62.8	-140.6	3.5	109.8	E2 A19 L20 V22 H37 C38 T39	E2-R32 IonicContact OE1-CZ 3.16Å; E2-R32 IonicContact OE1-NH2 2.74Å; E2-R32 PolarHBondContact OE1-NH2 3.02Å; E2-R32 IonicContact OE2-CZ 2.82Å; E2-R32 IonicContact OE2-NH2 3.41Å; E2-R32 PolarHBondContact OE2-NH2 3.2Å; A19-R32 CarbonylContact C-O 3.43Å; A19-R32 WeakPolarHBondContact CA-O 3.42Å; A19-R32 WeakPolarHBondContact CB-O 3.31Å; L20-R32 PolarHBondContact N-O 3.3Å; L20-R32 PolarHBondContact O-N 2.94Å; V22-R32 HydrophobicContact CG2-CB 3.68Å; R32-H37 WeakPolarHBondContact CG-O 3.32Å; R32-C38 WeakPolarHBondContact CA-O 3.39Å; R32-T39 HydrophobicContact CB-CG2 4.03Å; R32-T39 HydrophobicContact CG-CG2 4.24Å
33	Y	86.2	Confident	83	Confident	26 Å²	26	54.5 Å²	54.5	10%	0.102	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	140.6	174.9	-69	-64.6	0	0	0	111.3	Q9 I17 A19 H37 C38 I40	Q9-Y33 PolarHBondContact OE1-OH 2.68Å; Q9-Y33 VanDerWaalsContact OE1-OH 3.12Å; I17-Y33 HydrophobicContact CB-CE1 4.23Å; I17-Y33 HydrophobicContact CG2-CD1 3.78Å; I17-Y33 HydrophobicContact CG2-CE1 3.53Å; A19-Y33 HydrophobicContact CB-CD1 4.28Å; Y33-H37 WeakPolarHBondContact O-CA 3.43Å; Y33-H37 PolarHBondContact O-N 3.14Å; Y33-H37 VanDerWaalsContact O-N 3.16Å; Y33-C38 HydrophobicContact CD2-CB 4.37Å; Y33-C38 PolarHBondContact N-O 2.86Å; Y33-I40 HydrophobicContact CE2-CD1 3.65Å; Y33-I40 HydrophobicContact CE2-CG1 3.95Å; Y33-I40 HydrophobicContact CE2-CG2 4.44Å; Y33-I40 WeakPolarHBondContact OH-CD1 3.46Å
34	T	79.9	Confident	82.7	Confident	61 Å²	61	54.4 Å²	54.4	37%	0.374	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-39.3	-168	48.8	0	0	0	0	114.9	P18 L20	P18-T34 HydrophobicContact CB-CG2 4.3Å; L20-T34 HydrophobicContact CG-CG2 4.31Å
35	A	69.8	Low	82.4	Confident	58 Å²	58	57.1 Å²	57.1	48%	0.479	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-39.6	-177	0	0	0	0	0	113.8	P118	A35-P118 HydrophobicContact CB-CB 3.79Å; A35-P118 HydrophobicContact CB-CG 3.6Å
36	N	70.8	Confident	82.6	Confident	80 Å²	80	56.3 Å²	56.3	43%	0.428	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-7.8	-173.5	-57.4	35.1	0	0	0	112.6	C38 A116	N36-C38 HydrophobicContact CB-CB 4.36Å; N36-C38 PolarHBondContact O-N 2.93Å; N36-A116 PolarHBondContact ND2-O 2.78Å
37	H	77.6	Confident	83.2	Confident	131 Å²	131	49.1 Å²	49.1	61%	0.606	28%	0.276	S	S	*	.			trans	51.9	8.1	-171.1	-61.7	-87.6	0	0	0	116.1	R32 Y33 T39	R32-H37 WeakPolarHBondContact CG-O 3.32Å; Y33-H37 WeakPolarHBondContact O-CA 3.43Å; Y33-H37 PolarHBondContact O-N 3.14Å; Y33-H37 VanDerWaalsContact O-N 3.16Å; H37-T39 PolarHBondContact O-N 2.92Å
38	C	81.9	Confident	83.7	Confident	46 Å²	46	45.4 Å²	45.4	31%	0.311	25%	0.253	S	S	.	.			trans	-65.4	129.1	178	-177.9	0	0	0	0	110.7	R32 Y33 N36	R32-C38 WeakPolarHBondContact CA-O 3.39Å; Y33-C38 HydrophobicContact CD2-CB 4.37Å; Y33-C38 PolarHBondContact N-O 2.86Å; N36-C38 HydrophobicContact CB-CB 4.36Å; N36-C38 PolarHBondContact O-N 2.93Å
39	T	85.8	Confident	83.9	Confident	84 Å²	84	42.9 Å²	42.9	52%	0.515	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	129.4	179.3	51.3	0	0	0	0	111.6	I31 R32 H37	I31-T39 CarbonylContact O-C 3.44Å; I31-T39 WeakPolarHBondContact O-CA 3.36Å; R32-T39 HydrophobicContact CB-CG2 4.03Å; R32-T39 HydrophobicContact CG-CG2 4.24Å; H37-T39 PolarHBondContact O-N 2.92Å
40	I	88.6	Confident	83.9	Confident	46 Å²	46	43.1 Å²	43.1	24%	0.236	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	159.3	175.7	60.9	162	0	0	0	111.6	I31 Y33 V42	I31-I40 HydrophobicContact CD1-CD1 4.23Å; I31-I40 HydrophobicContact CD1-CG1 4.06Å; I31-I40 HydrophobicContact CG1-CD1 4.39Å; I31-I40 HydrophobicContact CG1-CG1 3.7Å; I31-I40 PolarHBondContact N-O 3.35Å; I31-I40 PolarHBondContact O-N 2.78Å; Y33-I40 HydrophobicContact CE2-CD1 3.65Å; Y33-I40 HydrophobicContact CE2-CG1 3.95Å; Y33-I40 HydrophobicContact CE2-CG2 4.44Å; Y33-I40 WeakPolarHBondContact OH-CD1 3.46Å; I40-V42 HydrophobicContact CD1-CG2 3.56Å; I40-V42 HydrophobicContact CG1-CG2 3.83Å
41	K	88.5	Confident	83.3	Confident	120 Å²	120	44.3 Å²	44.3	52%	0.522	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.9	174.3	-74.5	-169.8	173.4	-172.7	0	110.6	E25 V28 C29 T30	E25-K41 WeakPolarHBondContact OE1-CE 3.45Å; E25-K41 IonicContact OE1-NZ 3.26Å; E25-K41 PolarHBondContact OE1-NZ 3.05Å; E25-K41 IonicContact OE2-NZ 3.86Å; E25-K41 PolarHBondContact OE2-NZ 3.12Å; V28-K41 HydrophobicContact CG1-CB 3.76Å; V28-K41 HydrophobicContact CG1-CD 4.13Å; V28-K41 HydrophobicContact CG1-CG 4.16Å; C29-K41 CarbonylContact O-C 3.56Å; C29-K41 WeakPolarHBondContact O-CA 3.27Å; T30-K41 WeakPolarHBondContact OG1-CE 3.49Å
42	V	87.1	Confident	82.8	Confident	8 Å²	8	48.8 Å²	48.8	5%	0.048	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	147.2	-167.5	177	0	0	0	0	109.9	Q9 C29 I31 I40 E46 L47	Q9-V42 HydrophobicContact CG-CG1 4.17Å; C29-V42 PolarHBondContact N-O 2.85Å; C29-V42 PolarHBondContact O-N 3.17Å; I31-V42 HydrophobicContact CD1-CB 4.46Å; I31-V42 HydrophobicContact CD1-CG2 3.78Å; I31-V42 HydrophobicContact CG1-CG2 3.9Å; I40-V42 HydrophobicContact CD1-CG2 3.56Å; I40-V42 HydrophobicContact CG1-CG2 3.83Å; V42-E46 HydrophobicContact CG1-CB 3.67Å; V42-E46 HydrophobicContact CG1-CG 4.48Å; V42-L47 HydrophobicContact CB-CD2 4.47Å; V42-L47 HydrophobicContact CG1-CD1 4.46Å; V42-L47 HydrophobicContact CG1-CD2 3.81Å; V42-L47 HydrophobicContact CG1-CG 3.96Å
43	G	84.6	Confident	82.2	Confident	18 Å²	18	46.9 Å²	46.9	19%	0.186	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	145.3	176.1	0	0	0	0	0	113.1	S45 E46	G43-S45 PolarHBondContact O-N 2.89Å; G43-E46 PolarHBondContact O-N 2.56Å
44	L	80.9	Confident	81.6	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.037	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-55.2	-22.9	173.2	-73.3	155.8	0	0	0	113.9	C29 E46 L217 L218 A325	C29-L44 WeakPolarHBondContact SG-CD2 3.43Å; L44-E46 VanDerWaalsContact C-N 3.31Å; L44-L217 HydrophobicContact CD2-CB 3.88Å; L44-L217 HydrophobicContact CD2-CD1 4.34Å; L44-L217 PolarHBondContact O-N 3.5Å; L44-L218 HydrophobicContact CB-CD2 3.54Å; L44-L218 HydrophobicContact CB-CG 3.73Å; L44-L218 HydrophobicContact CD1-CD2 3.93Å; L44-L218 HydrophobicContact CG-CD2 4.36Å; L44-A325 HydrophobicContact CD1-CB 3.64Å; L44-A325 HydrophobicContact CD2-CB 3.69Å; L44-A325 HydrophobicContact CG-CB 4.33Å
45	S	81.7	Confident	80.9	Confident	61 Å²	61	48 Å²	48	43%	0.427	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-71.3	-18.7	174.3	45.4	0	0	0	0	114.3	G43 N216	G43-S45 PolarHBondContact O-N 2.89Å; S45-N216 PolarHBondContact O-ND2 2.83Å
46	E	84.2	Confident	80.4	Confident	82 Å²	82	48.8 Å²	48.8	38%	0.383	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-102.5	1.3	-178.5	-66.3	165.1	-123	0	0	112.4	Q9 I10 V42 G43 L44	Q9-E46 CarbonylContact C-O 3.6Å; Q9-E46 WeakPolarHBondContact CA-O 3.34Å; Q9-E46 HydrophobicContact CG-CB 4.43Å; Q9-E46 PolarHBondContact NE2-OE2 3.39Å; I10-E46 PolarHBondContact N-O 3.07Å; V42-E46 HydrophobicContact CG1-CB 3.67Å; V42-E46 HydrophobicContact CG1-CG 4.48Å; G43-E46 PolarHBondContact O-N 2.56Å; L44-E46 VanDerWaalsContact C-N 3.31Å
47	L	86.3	Confident	79.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	140.4	-175.9	-60.7	179.2	0	0	0	111.2	Q9 L21 C29 I31 V42 N216 L217	Q9-L47 HydrophobicContact CB-CD2 3.95Å; Q9-L47 HydrophobicContact CG-CD2 4.21Å; L21-L47 HydrophobicContact CD1-CD1 4.46Å; C29-L47 HydrophobicContact CB-CD1 3.52Å; I31-L47 HydrophobicContact CD1-CD2 4.17Å; I31-L47 HydrophobicContact CG2-CD1 3.76Å; I31-L47 HydrophobicContact CG2-CD2 4Å; V42-L47 HydrophobicContact CB-CD2 4.47Å; V42-L47 HydrophobicContact CG1-CD1 4.46Å; V42-L47 HydrophobicContact CG1-CD2 3.81Å; V42-L47 HydrophobicContact CG1-CG 3.96Å; L47-N216 CarbonylContact O-C 3.6Å; L47-N216 WeakPolarHBondContact O-CA 3.27Å; L47-L217 HydrophobicContact CB-CD1 3.64Å; L47-L217 HydrophobicContact CB-CG 3.86Å; L47-L217 HydrophobicContact CD1-CD1 4.06Å; L47-L217 PolarHBondContact O-N 2.8Å
48	Q	86.3	Confident	77.4	Confident	6 Å²	6	54 Å²	54	3%	0.028	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	160.6	164.1	63.4	172.2	29.5	0	0	110.2	V7 E8 K16 N215	V7-Q48 CarbonylContact C-O 3.49Å; V7-Q48 VanDerWaalsContact CA-O 3.26Å; V7-Q48 WeakPolarHBondContact CA-O 3.39Å; V7-Q48 WeakPolarHBondContact CB-O 3.33Å; E8-Q48 HydrophobicContact CB-CG 3.93Å; E8-Q48 PolarHBondContact N-O 2.79Å; E8-Q48 PolarHBondContact O-N 2.6Å; E8-Q48 PolarHBondContact OE2-NE2 2.76Å; K16-Q48 VanDerWaalsContact CD-NE2 3.34Å; K16-Q48 VanDerWaalsContact CE-NE2 3.25Å; Q48-N215 WeakPolarHBondContact CB-O 3.22Å
49	L	85.8	Confident	75.1	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	140.1	169.7	-68.2	178.9	0	0	0	110.4	I5 V7 A53 F54 W184 L217 I222 L223	I5-L49 HydrophobicContact CG2-CD2 3.69Å; V7-L49 HydrophobicContact CG1-CD2 4.34Å; L49-A53 HydrophobicContact CB-CB 4.04Å; L49-A53 HydrophobicContact CD2-CB 4.09Å; L49-A53 HydrophobicContact CG-CB 4.47Å; L49-F54 HydrophobicContact CB-CE2 4.32Å; L49-F54 HydrophobicContact CB-CZ 4.03Å; L49-F54 HydrophobicContact CD1-CE1 3.77Å; L49-F54 HydrophobicContact CD1-CE2 4.46Å; L49-F54 HydrophobicContact CD1-CZ 3.53Å; L49-F54 HydrophobicContact CG-CZ 4.44Å; L49-W184 PolarHBondContact O-NE1 3.38Å; L49-L217 HydrophobicContact CD2-CD2 3.73Å; L49-L217 HydrophobicContact CG-CD2 3.71Å; L49-I222 HydrophobicContact CD1-CG2 3.67Å; L49-I222 WeakPolarHBondContact CD1-O 3.44Å; L49-I222 HydrophobicContact CG-CG2 3.88Å; L49-L223 HydrophobicContact CD2-CD1 4.44Å
50	A	85.1	Confident	72.6	Confident	5 Å²	5	61.7 Å²	61.7	4%	0.041	32%	0.324	C	S	.	.			trans	-78.2	159.2	171.9	0	0	0	0	0	111.2	P6 E8 N52 A53	P6-A50 HydrophobicContact CB-CB 3.86Å; P6-A50 PolarHBondContact O-N 2.86Å; P6-A50 VanDerWaalsContact O-N 3.08Å; E8-A50 HydrophobicContact CG-CB 3.9Å; A50-N52 VanDerWaalsContact CB-OD1 3.25Å; A50-N52 WeakPolarHBondContact CB-OD1 3.33Å; A50-N52 PolarHBondContact O-N 2.93Å; A50-N52 VanDerWaalsContact O-N 3.1Å; A50-A53 WeakPolarHBondContact O-CB 3.46Å; A50-A53 PolarHBondContact O-N 2.9Å
51	P	77.8	Confident	69.7	Low	51 Å²	51	66.8 Å²	66.8	33%	0.331	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-29.1	-179.6	-25.2	32.7	0	0	0	114.6	W184	P51-W184 HydrophobicContact CB-CD2 4.26Å; P51-W184 HydrophobicContact CB-CE3 4.38Å; P51-W184 HydrophobicContact CG-CB 4.21Å; P51-W184 HydrophobicContact CG-CD2 3.78Å; P51-W184 HydrophobicContact CG-CE3 4.24Å; P51-W184 HydrophobicContact CG-CG 3.72Å
52	N	79.8	Confident	67	Low	94 Å²	94	67.6 Å²	67.6	50%	0.503	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	10.1	178.7	62.3	-24.2	0	0	0	114.2	P6 A50 F54	P6-N52 WeakPolarHBondContact CB-OD1 3.41Å; A50-N52 VanDerWaalsContact CB-OD1 3.25Å; A50-N52 WeakPolarHBondContact CB-OD1 3.33Å; A50-N52 PolarHBondContact O-N 2.93Å; A50-N52 VanDerWaalsContact O-N 3.1Å; N52-F54 PolarHBondContact O-N 2.89Å
53	A	77.8	Confident	64.3	Low	0 Å²	0	75.7 Å²	75.7	0%	0	40%	0.404	C	S	.	.	S	Bend	trans	-75.5	-6.7	-179.5	0	0	0	0	0	115.1	I5 P6 L49 A50	I5-A53 HydrophobicContact CG2-CB 4.11Å; P6-A53 HydrophobicContact CB-CB 4.4Å; P6-A53 WeakPolarHBondContact O-CB 3.16Å; L49-A53 HydrophobicContact CB-CB 4.04Å; L49-A53 HydrophobicContact CD2-CB 4.09Å; L49-A53 HydrophobicContact CG-CB 4.47Å; A50-A53 WeakPolarHBondContact O-CB 3.46Å; A50-A53 PolarHBondContact O-N 2.9Å
54	F	74	Confident	61.6	Low	34 Å²	34	81.1 Å²	81.1	15%	0.149	44%	0.44	C	S	.	.	S	Bend	trans	-109.8	-21.8	-165.7	-55.7	-87.3	0	0	0	114.7	L49 N52 W184 F188 A253 G358	L49-F54 HydrophobicContact CB-CE2 4.32Å; L49-F54 HydrophobicContact CB-CZ 4.03Å; L49-F54 HydrophobicContact CD1-CE1 3.77Å; L49-F54 HydrophobicContact CD1-CE2 4.46Å; L49-F54 HydrophobicContact CD1-CZ 3.53Å; L49-F54 HydrophobicContact CG-CZ 4.44Å; N52-F54 PolarHBondContact O-N 2.89Å; F54-W184 HydrophobicContact CE2-CH2 4.16Å; F54-W184 AromaticContact CE2-CZ2 3.68Å; F54-W184 HydrophobicContact CE2-CZ2 3.68Å; F54-W184 HydrophobicContact CZ-CZ2 4.2Å; F54-F188 HydrophobicContact CB-CE2 4.41Å; F54-F188 AromaticContact CD2-CD2 3.99Å; F54-F188 HydrophobicContact CD2-CD2 3.99Å; F54-F188 AromaticContact CD2-CE2 3.92Å; F54-F188 HydrophobicContact CD2-CE2 3.92Å; F54-F188 HydrophobicContact CE2-CD2 4.38Å; F54-F188 HydrophobicContact CG-CD2 4.15Å; F54-F188 HydrophobicContact CG-CE2 4.27Å; F54-A253 VanDerWaalsContact O-CB 3.32Å; F54-A253 WeakPolarHBondContact O-CB 3.47Å; F54-G358 WeakPolarHBondContact CD1-O 3.44Å; F54-G358 WeakPolarHBondContact CE1-O 3.23Å
55	S	65.5	Low	59.1	Low	77 Å²	77	83.7 Å²	83.7	54%	0.538	47%	0.467	S	S	.	.			trans	-144.9	150.7	-175.8	-60.6	0	0	0	0	111.1
56	I	59.1	Low	56.6	Low	75 Å²	75	86.4 Å²	86.4	39%	0.385	49%	0.486	S	S	.	.			trans	-91	120.1	173.2	-54.4	167.2	0	0	0	108.3	M1 E58	M1-I56 HydrophobicContact CE-CD1 3.57Å; M1-I56 HydrophobicContact CE-CG1 4.27Å; M1-I56 HydrophobicContact SD-CD1 4.39Å; I56-E58 PolarHBondContact O-N 2.89Å
57	N	47.3	Very low	54.1	Low	138 Å²	138	88.2 Å²	88.2	74%	0.738	51%	0.508	S	S	*	.			trans	-78.1	115.2	169.4	-78.7	-5.5	0	0	0	109.4	K59	N57-K59 PolarHBondContact O-N 2.86Å
58	E	38.1	Very low	51.4	Low	183 Å²	183	96.6 Å²	96.6	86%	0.855	55%	0.547	S	S	*	.	S	Bend	trans	-71.1	3.2	-172.7	-59.8	-179.6	131.9	0	0	115	I56 L60	I56-E58 PolarHBondContact O-N 2.89Å; E58-L60 PolarHBondContact O-N 2.93Å
59	K	33.8	Very low	48.6	Very low	128 Å²	128	103.6 Å²	103.6	56%	0.557	59%	0.585	S	S	*	*			trans	-77.4	20.4	-173.7	-114.6	-161.4	-176	-152.1	0	115.5	N57 E71	N57-K59 PolarHBondContact O-N 2.86Å; K59-E71 PolarHBondContact NZ-O 2.89Å
60	L	32.5	Very low	46	Very low	162 Å²	162	112.7 Å²	112.7	85%	0.848	63%	0.628	S	S	*	*	S	Bend	trans	-139.5	44.9	-173.4	-81.8	171.6	0	0	0	114.1	E58	E58-L60 PolarHBondContact O-N 2.93Å
61	D	28.1	Very low	43.2	Very low	153 Å²	153	120.4 Å²	120.4	82%	0.818	66%	0.663	S	S	*	*			trans	-149.5	22.9	164.9	-110.5	-27.7	0	0	0	113.1
62	V	30.3	Very low	40.7	Very low	138 Å²	138	124.6 Å²	124.6	84%	0.836	68%	0.68	S	S	*	*			trans	-91.9	126.7	172.6	-179.3	0	0	0	0	109.8
63	Q	31.4	Very low	38.2	Very low	177 Å²	177	124.2 Å²	124.2	83%	0.827	68%	0.682	S	S	*	*			trans	-70.3	147.4	-177.1	-65.9	178.4	-5.3	0	0	112.3	G65	Q63-G65 PolarHBondContact O-N 2.95Å; Q63-G65 VanDerWaalsContact O-N 3.09Å
64	S	28.1	Very low	35.7	Very low	133 Å²	133	130.4 Å²	130.4	93%	0.93	71%	0.711	S	S	*	*			trans	-57.1	108.8	178.4	51.3	0	0	0	0	112
65	G	28.1	Very low	33.5	Very low	60 Å²	60	136.4 Å²	136.4	62%	0.619	74%	0.744	S	S	*	*			trans	-147.5	30.8	-160.1	0	0	0	0	0	117.8	Q63	Q63-G65 PolarHBondContact O-N 2.95Å; Q63-G65 VanDerWaalsContact O-N 3.09Å
66	S	29.5	Very low	31.9	Very low	118 Å²	118	136 Å²	136	83%	0.825	74%	0.742	S	S	*	*			trans	68.2	169.9	167.6	78.4	0	0	0	0	118.7
67	S	32.3	Very low	30.7	Very low	121 Å²	121	138.8 Å²	138.8	85%	0.846	76%	0.757	S	S	*	*			trans	68.3	140.5	-176.7	64.1	0	0	0	0	117.4
68	E	29	Very low	31	Very low	175 Å²	175	137.3 Å²	137.3	82%	0.818	75%	0.746	S	S	*	*	S	Bend	trans	-96.1	158.2	-171.5	-58.9	158.7	141.9	0	0	110.9
69	N	26.8	Very low	32	Very low	154 Å²	154	136.2 Å²	136.2	82%	0.824	75%	0.746	S	S	*	*			trans	74.5	70.7	172.4	-41.3	-73.1	0	0	0	116.6
70	E	30.7	Very low	33.5	Very low	191 Å²	191	131.8 Å²	131.8	89%	0.893	73%	0.727	S	S	*	*			trans	-122.1	137.9	148.6	-75.7	-154.3	149.7	0	0	111
71	E	27.4	Very low	35.1	Very low	167 Å²	167	126.7 Å²	126.7	78%	0.78	70%	0.704	S	S	*	*			trans	-79	161	-169	-61.5	-179.4	130.1	0	0	113.1	K59	K59-E71 PolarHBondContact NZ-O 2.89Å
72	M	25.1	Very low	37	Very low	139 Å²	139	123.8 Å²	123.8	69%	0.685	69%	0.694	S	S	*	*			trans	-71.9	139.6	163.8	-79.8	-65.1	-177.6	0	0	109.4	H74	M72-H74 PolarHBondContact O-CD2 2.82Å; M72-H74 PolarHBondContact O-N 3.32Å
73	P	27.6	Very low	38.9	Very low	86 Å²	86	127 Å²	127	56%	0.558	69%	0.691	S	S	*	*			trans	-66.9	107	175.1	-13.5	28.6	0	0	0	108.7	N75	P73-N75 PolarHBondContact O-N 3.48Å
74	H	25.8	Very low	41.2	Very low	129 Å²	129	121.1 Å²	121.1	60%	0.597	67%	0.666	S	S	*	*			trans	-74.2	53.8	-176.6	-84	-87.8	0	0	0	113.5	M72	M72-H74 PolarHBondContact O-CD2 2.82Å; M72-H74 PolarHBondContact O-N 3.32Å
75	N	26.9	Very low	43.7	Very low	160 Å²	160	119 Å²	119	86%	0.856	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	94.9	162.1	-78.3	-22.8	0	0	0	107.5	P73	P73-N75 PolarHBondContact O-N 3.48Å
76	S	32.1	Very low	46.5	Very low	70 Å²	70	116.3 Å²	116.3	49%	0.49	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	cis	-138	138.4	28.1	43.9	0	0	0	0	114.8	H78	S76-H78 PolarHBondContact O-N 3.17Å; S76-H78 PolarHBondContact OG-CD2 2.87Å; S76-H78 PolarHBondContact OG-NE2 2.87Å
77	N	34.2	Very low	49.2	Very low	132 Å²	132	111.2 Å²	111.2	71%	0.706	58%	0.583	S	S	*	*			trans	-73.8	69.5	158.8	-76.4	-28.4	0	0	0	110.5	N79	N77-N79 PolarHBondContact O-N 3.49Å
78	H	53.3	Low	51.8	Low	108 Å²	108	105.5 Å²	105.5	50%	0.5	54%	0.543	S	S	.	.			trans	-72.1	105.7	167.6	-70.5	-41.3	0	0	0	109.8	S76 F80	S76-H78 PolarHBondContact O-N 3.17Å; S76-H78 PolarHBondContact OG-CD2 2.87Å; S76-H78 PolarHBondContact OG-NE2 2.87Å; H78-F80 HydrophobicContact CB-CD2 4.45Å; H78-F80 HydrophobicContact CB-CE2 4.18Å; H78-F80 HydrophobicContact CB-CZ 4.3Å; H78-F80 VanDerWaalsContact O-CD2 3.31Å; H78-F80 WeakPolarHBondContact O-CD2 3.44Å; H78-F80 PolarHBondContact O-N 3.37Å
79	N	58.3	Low	54.6	Low	159 Å²	159	99.6 Å²	99.6	85%	0.85	51%	0.514	S	S	*	.			trans	-68.8	81.5	165.5	-79.8	-23.7	0	0	0	109.5	N77 S81	N77-N79 PolarHBondContact O-N 3.49Å; N79-S81 PolarHBondContact O-N 3.05Å
80	F	66.1	Low	57.5	Low	36 Å²	36	92.7 Å²	92.7	16%	0.158	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-57.6	124.7	170.1	-62.6	-82.2	0	0	0	109.9	H78 V86 V126 I129 I180 V182	H78-F80 HydrophobicContact CB-CD2 4.45Å; H78-F80 HydrophobicContact CB-CE2 4.18Å; H78-F80 HydrophobicContact CB-CZ 4.3Å; H78-F80 VanDerWaalsContact O-CD2 3.31Å; H78-F80 WeakPolarHBondContact O-CD2 3.44Å; H78-F80 PolarHBondContact O-N 3.37Å; F80-V86 HydrophobicContact CD1-CG1 3.59Å; F80-V86 HydrophobicContact CE1-CG1 3.63Å; F80-V126 HydrophobicContact CB-CG2 4.21Å; F80-I129 HydrophobicContact CB-CD1 3.84Å; F80-I129 HydrophobicContact CD2-CD1 4.29Å; F80-I129 HydrophobicContact CG-CD1 4.49Å; F80-I180 HydrophobicContact CE1-CG2 4.45Å; F80-I180 HydrophobicContact CZ-CG2 4.21Å; F80-V182 HydrophobicContact CE1-CG2 3.73Å; F80-V182 HydrophobicContact CZ-CG2 4.21Å
81	S	66.2	Low	59.9	Low	54 Å²	54	87.9 Å²	87.9	38%	0.378	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-84.8	151.4	177.6	107.7	0	0	0	0	111.3	N79 R83 D84	N79-S81 PolarHBondContact O-N 3.05Å; S81-R83 PolarHBondContact O-N 3.15Å; S81-D84 WeakPolarHBondContact CB-OD1 3.06Å; S81-D84 VanDerWaalsContact N-CG 3.34Å; S81-D84 PolarHBondContact N-OD2 2.68Å; S81-D84 WeakPolarHBondContact O-CB 3.42Å; S81-D84 PolarHBondContact O-N 2.9Å; S81-D84 PolarHBondContact OG-OD1 3.1Å
82	P	67.6	Low	62.1	Low	93 Å²	93	81.1 Å²	81.1	60%	0.604	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	123.6	172.2	-25.5	35.9	0	0	0	111.6
83	R	70.9	Confident	64.2	Low	204 Å²	204	77.4 Å²	77.4	77%	0.77	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	5.9	-172	-52	176.6	173.9	-177.6	-2.8	116.8	S81 V126	S81-R83 PolarHBondContact O-N 3.15Å; R83-V126 VanDerWaalsContact CA-O 3.3Å; R83-V126 WeakPolarHBondContact CA-O 3.42Å; R83-V126 PolarHBondContact N-O 3.34Å
84	D	78.4	Confident	66.2	Low	55 Å²	55	76.1 Å²	76.1	29%	0.294	42%	0.418	S	S	.	.			trans	-59.3	134.9	168.4	-74.1	2.3	0	0	0	110.4	S81 R125 V126	S81-D84 WeakPolarHBondContact CB-OD1 3.06Å; S81-D84 VanDerWaalsContact N-CG 3.34Å; S81-D84 PolarHBondContact N-OD2 2.68Å; S81-D84 WeakPolarHBondContact O-CB 3.42Å; S81-D84 PolarHBondContact O-N 2.9Å; S81-D84 PolarHBondContact OG-OD1 3.1Å; D84-R125 VanDerWaalsContact O-CA 3.27Å; D84-R125 WeakPolarHBondContact O-CA 3.43Å; D84-V126 PolarHBondContact O-N 2.9Å
85	P	82.1	Confident	68.1	Low	89 Å²	89	70.8 Å²	70.8	58%	0.578	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	137.5	171.2	30.7	-33.8	0	0	0	109.1	P183	P85-P183 HydrophobicContact CB-CG 4.19Å; P85-P183 HydrophobicContact CG-CG 4.46Å; P85-P183 WeakPolarHBondContact O-CD 3.49Å; P85-P183 WeakPolarHBondContact O-CG 3.35Å
86	V	85.4	Confident	69.6	Low	2 Å²	2	65.3 Å²	65.3	1%	0.012	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	161	-179	-69.5	0	0	0	0	111.1	F80 V88 G124 V126 V136 I180 R181	F80-V86 HydrophobicContact CD1-CG1 3.59Å; F80-V86 HydrophobicContact CE1-CG1 3.63Å; V86-V88 HydrophobicContact CG2-CG2 3.86Å; V86-G124 PolarHBondContact N-O 2.67Å; V86-G124 CarbonylContact O-C 3.48Å; V86-G124 PolarHBondContact O-N 2.89Å; V86-G124 VanDerWaalsContact O-O 3.04Å; V86-V126 HydrophobicContact CB-CG2 4.46Å; V86-V126 HydrophobicContact CG1-CG2 3.74Å; V86-V126 HydrophobicContact CG2-CG2 3.87Å; V86-V136 HydrophobicContact CG2-CG1 4.46Å; V86-I180 HydrophobicContact CB-CG2 3.74Å; V86-I180 HydrophobicContact CG1-CG2 3.85Å; V86-I180 HydrophobicContact CG2-CG2 3.98Å; V86-R181 WeakPolarHBondContact CA-O 3.15Å; V86-R181 WeakPolarHBondContact CB-O 3.45Å
87	E	86.3	Confident	70.5	Confident	12 Å²	12	68.4 Å²	68.4	6%	0.056	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.8	163.7	-75.8	170.4	-152.8	0	0	109.3	K16 W121 W122 I180 R181 P183 W184	K16-E87 IonicContact NZ-OE1 3.76Å; K16-E87 PolarHBondContact NZ-OE1 2.87Å; K16-E87 IonicContact NZ-OE2 2.69Å; E87-W121 HydrophobicContact CB-CB 4.39Å; E87-W121 HydrophobicContact CB-CE3 4.19Å; E87-W122 WeakPolarHBondContact CA-O 3.37Å; E87-I180 WeakPolarHBondContact O-CA 3.44Å; E87-R181 HydrophobicContact CB-CG 3.76Å; E87-R181 PolarHBondContact N-O 2.89Å; E87-R181 PolarHBondContact O-N 3.23Å; E87-R181 IonicContact OE2-CZ 2.68Å; E87-R181 IonicContact OE2-NE 3.11Å; E87-R181 PolarHBondContact OE2-NE 2.78Å; E87-R181 IonicContact OE2-NH2 4Å; E87-R181 PolarHBondContact OE2-NH2 3.31Å; E87-P183 HydrophobicContact CG-CB 4.38Å; E87-P183 WeakPolarHBondContact OE1-CA 3.37Å; E87-W184 PolarHBondContact OE1-N 2.88Å
88	V	87.4	Confident	70.6	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.4	-171.3	-175.7	0	0	0	0	109.1	V86 L90 W121 W122 V136 V138 V175 I180	V86-V88 HydrophobicContact CG2-CG2 3.86Å; V88-L90 HydrophobicContact CG1-CD2 4.48Å; V88-W121 WeakPolarHBondContact O-CA 3.48Å; V88-W122 PolarHBondContact N-O 2.92Å; V88-W122 PolarHBondContact O-N 2.83Å; V88-V136 HydrophobicContact CG1-CG2 4.06Å; V88-V136 HydrophobicContact CG2-CB 4.2Å; V88-V136 HydrophobicContact CG2-CG1 4.16Å; V88-V136 HydrophobicContact CG2-CG2 4.3Å; V88-V138 HydrophobicContact CB-CG2 4.01Å; V88-V138 HydrophobicContact CG1-CG2 4Å; V88-V138 HydrophobicContact CG2-CG2 3.89Å; V88-V175 HydrophobicContact CG1-CB 4.25Å; V88-V175 HydrophobicContact CG1-CG1 3.9Å; V88-V175 HydrophobicContact CG1-CG2 3.87Å; V88-I180 HydrophobicContact CG1-CG1 4.41Å; V88-I180 HydrophobicContact CG2-CG1 4.39Å
89	W	88.8	Confident	69.5	Low	52 Å²	52	75.1 Å²	75.1	20%	0.197	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	129.6	174.4	-176	-97.9	0	0	0	110.3	P18 D91 G119 W121 E179	P18-W89 HydrophobicContact CG-CH2 4.04Å; P18-W89 HydrophobicContact CG-CZ3 3.65Å; W89-D91 PolarHBondContact NE1-OD1 2.9Å; W89-G119 VanDerWaalsContact CH2-C 3.44Å; W89-G119 WeakPolarHBondContact CH2-O 3.38Å; W89-W121 HydrophobicContact CB-CD2 4.41Å; W89-W121 HydrophobicContact CB-CE3 4.04Å; W89-W121 HydrophobicContact CB-CH2 4.1Å; W89-W121 HydrophobicContact CB-CZ2 4.47Å; W89-W121 HydrophobicContact CB-CZ3 3.87Å; W89-W121 AromaticContact CE3-CD1 3.77Å; W89-W121 AromaticContact CE3-CD2 3.88Å; W89-W121 HydrophobicContact CE3-CD2 3.88Å; W89-W121 AromaticContact CE3-CE2 3.65Å; W89-W121 AromaticContact CE3-CG 3.95Å; W89-W121 HydrophobicContact CE3-CG 3.95Å; W89-W121 HydrophobicContact CE3-CZ2 4.2Å; W89-W121 AromaticContact CE3-NE1 3.57Å; W89-W121 AromaticContact CZ3-CD1 3.83Å; W89-W121 HydrophobicContact CZ3-CG 4.39Å; W89-W121 AromaticContact CZ3-NE1 3.74Å; W89-E179 HydrophobicContact CB-CB 4.2Å; W89-E179 PolarHBondContact N-O 2.85Å
90	L	85.8	Confident	68.2	Low	8 Å²	8	72.5 Å²	72.5	4%	0.042	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	126.9	170	-61.6	175.2	0	0	0	109.6	V88 T95 G119 A120 W122 V138 A140 L142 T173 V175	V88-L90 HydrophobicContact CG1-CD2 4.48Å; L90-T95 HydrophobicContact CB-CG2 4.05Å; L90-T95 HydrophobicContact CD1-CG2 4.01Å; L90-G119 CarbonylContact O-C 3.41Å; L90-G119 WeakPolarHBondContact O-CA 3.44Å; L90-A120 PolarHBondContact N-O 3.43Å; L90-A120 PolarHBondContact O-N 2.83Å; L90-W122 HydrophobicContact CD1-CB 4.37Å; L90-W122 HydrophobicContact CD1-CG 3.99Å; L90-V138 HydrophobicContact CD1-CG1 4.09Å; L90-A140 HydrophobicContact CD1-CB 3.59Å; L90-L142 HydrophobicContact CD1-CD2 3.66Å; L90-T173 HydrophobicContact CD2-CG2 4.47Å; L90-V175 HydrophobicContact CD2-CG2 4.46Å
91	D	82.8	Confident	66.5	Low	90 Å²	90	77.3 Å²	77.3	48%	0.481	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	148.7	171.1	-63.3	-33.2	0	0	0	110.5	W89 G93 S94 P118	W89-D91 PolarHBondContact NE1-OD1 2.9Å; D91-G93 PolarHBondContact O-N 2.95Å; D91-G93 VanDerWaalsContact O-N 3.1Å; D91-S94 WeakPolarHBondContact O-CB 3.36Å; D91-S94 PolarHBondContact O-N 2.94Å; D91-P118 CarbonylContact C-O 3.58Å; D91-P118 WeakPolarHBondContact CA-O 3.47Å
92	S	72.8	Confident	64.9	Low	26 Å²	26	78.3 Å²	78.3	18%	0.182	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.7	-174.5	-73.6	0	0	0	0	114.2	S94 T95 A96 P117 P118 G119	S92-S94 VanDerWaalsContact C-N 3.29Å; S92-T95 PolarHBondContact O-N 2.78Å; S92-A96 PolarHBondContact O-N 3.09Å; S92-P117 WeakPolarHBondContact CB-O 3.39Å; S92-P117 PolarHBondContact OG-O 2.9Å; S92-P117 VanDerWaalsContact OG-O 3.12Å; S92-P118 PolarHBondContact N-O 3.02Å; S92-G119 PolarHBondContact OG-N 3.03Å
93	G	69.1	Low	63.3	Low	61 Å²	61	81.8 Å²	81.8	63%	0.629	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-28.4	166	0	0	0	0	0	113.6	D91	D91-G93 PolarHBondContact O-N 2.95Å; D91-G93 VanDerWaalsContact O-N 3.1Å
94	S	69.1	Low	61.7	Low	58 Å²	58	77.3 Å²	77.3	41%	0.406	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-21.9	177.3	-55.3	0	0	0	0	113.4	D91 S92 L142 Q143	D91-S94 WeakPolarHBondContact O-CB 3.36Å; D91-S94 PolarHBondContact O-N 2.94Å; S92-S94 VanDerWaalsContact C-N 3.29Å; S94-L142 WeakPolarHBondContact O-CA 3.17Å; S94-Q143 PolarHBondContact O-N 2.6Å
95	T	66.9	Low	59.5	Low	18 Å²	18	83 Å²	83	11%	0.11	47%	0.47	C	S	.	.	S	Bend	trans	-113	13.8	-173.5	65	0	0	0	0	113.7	L90 S92 K97 W122 P141 L142	L90-T95 HydrophobicContact CB-CG2 4.05Å; L90-T95 HydrophobicContact CD1-CG2 4.01Å; S92-T95 PolarHBondContact O-N 2.78Å; T95-K97 PolarHBondContact O-N 3.46Å; T95-K97 VanDerWaalsContact O-N 3.17Å; T95-W122 HydrophobicContact CG2-CZ2 3.97Å; T95-P141 WeakPolarHBondContact CA-O 3.19Å; T95-L142 HydrophobicContact CG2-CD2 4.5Å
96	A	57.8	Low	57.1	Low	45 Å²	45	85.3 Å²	85.3	37%	0.372	48%	0.482	S	S	.	.			trans	-76.5	100.7	-174.5	0	0	0	0	0	112.4	S92 K98	S92-A96 PolarHBondContact O-N 3.09Å; A96-K98 PolarHBondContact O-N 2.82Å
97	K	51.6	Low	54.8	Low	135 Å²	135	91 Å²	91	59%	0.587	52%	0.522	S	S	*	.			trans	-61.3	108.3	166.5	-71.9	173.9	-173.7	166	0	109.4	E13 T95 K99 P141	E13-K97 IonicContact OE1-NZ 2.68Å; E13-K97 PolarHBondContact OE1-NZ 3.1Å; E13-K97 IonicContact OE2-NZ 3.21Å; E13-K97 PolarHBondContact OE2-NZ 3.32Å; T95-K97 PolarHBondContact O-N 3.46Å; T95-K97 VanDerWaalsContact O-N 3.17Å; K97-K99 PolarHBondContact O-N 3.03Å; K97-P141 HydrophobicContact CD-CB 4.45Å; K97-P141 HydrophobicContact CG-CB 4.34Å
98	K	35.1	Very low	51.9	Low	188 Å²	188	94.5 Å²	94.5	82%	0.817	56%	0.561	S	S	*	*			trans	-59.3	102.2	179	-171.7	177.3	-176.5	178.9	0	110.3	A96 S100	A96-K98 PolarHBondContact O-N 2.82Å; K98-S100 PolarHBondContact O-N 3.17Å; K98-S100 VanDerWaalsContact O-N 3.14Å
99	K	31.3	Very low	49.3	Very low	193 Å²	193	99.5 Å²	99.5	84%	0.839	60%	0.597	S	S	*	*			trans	-56.2	117.2	-179.2	-170.6	177.8	-177.9	-177.7	0	109.7	K97 T101	K97-K99 PolarHBondContact O-N 3.03Å; K99-T101 PolarHBondContact O-N 3.14Å
100	S	31.1	Very low	46.7	Very low	103 Å²	103	103.6 Å²	103.6	72%	0.72	63%	0.627	S	S	*	*			trans	-63.6	117.6	-175.5	49.1	0	0	0	0	111	K98 A102	K98-S100 PolarHBondContact O-N 3.17Å; K98-S100 VanDerWaalsContact O-N 3.14Å; S100-A102 PolarHBondContact O-N 3.12Å
101	T	29.2	Very low	43.9	Very low	137 Å²	137	112.4 Å²	112.4	84%	0.84	67%	0.668	S	S	*	*			trans	-77.4	68.5	179.6	-37.3	0	0	0	0	110.4	K99	K99-T101 PolarHBondContact O-N 3.14Å
102	A	32.9	Very low	41.4	Very low	76 Å²	76	113.6 Å²	113.6	63%	0.628	68%	0.683	S	S	*	*			trans	-143.8	34.6	-172.8	0	0	0	0	0	112.8	S100	S100-A102 PolarHBondContact O-N 3.12Å
103	D	34.1	Very low	39.6	Very low	166 Å²	166	118.5 Å²	118.5	89%	0.888	71%	0.712	S	S	*	*			trans	-147.2	119.3	156.9	-89.8	-44.3	0	0	0	106.4
104	V	37.8	Very low	38.2	Very low	110 Å²	110	120.3 Å²	120.3	67%	0.667	72%	0.715	S	S	*	*			trans	-130.4	150.6	-168.3	166.5	0	0	0	0	109.6
105	E	32.7	Very low	37.5	Very low	175 Å²	175	124 Å²	124	82%	0.818	73%	0.729	S	S	*	*			trans	76.9	143.6	174.1	-78	154.9	-136.8	0	0	119.2
106	T	31.6	Very low	37.1	Very low	136 Å²	136	125.4 Å²	125.4	83%	0.834	74%	0.742	S	S	*	*			trans	78.1	59.9	166.5	-35.4	0	0	0	0	119
107	S	36.1	Very low	37.4	Very low	122 Å²	122	124.4 Å²	124.4	85%	0.853	73%	0.732	S	S	*	*				-169.1	133.7	130	28.9	0	0	0	0	111.3
108	G	26.1	Very low	38.2	Very low	85 Å²	85	120.1 Å²	120.1	88%	0.876	72%	0.718	S	S	*	*			trans	-112.7	108.4	179.2	0	0	0	0	0	111.8
109	S	32.2	Very low	40.5	Very low	106 Å²	106	111.1 Å²	111.1	74%	0.741	68%	0.679	S	S	*	*			trans	-163	125.5	168.1	52.7	0	0	0	0	112.5
110	V	34.8	Very low	43.1	Very low	138 Å²	138	102 Å²	102	84%	0.836	64%	0.639	S	S	*	*			trans	56.6	127.6	155.9	-170	0	0	0	0	118.1	S112	V110-S112 PolarHBondContact O-N 3.03Å; V110-S112 VanDerWaalsContact O-N 3.11Å
111	E	27.3	Very low	45.8	Very low	192 Å²	192	99 Å²	99	90%	0.897	61%	0.612	S	S	*	*			trans	-59.1	110.4	173.2	-63.1	174	127.2	0	0	111.3	V113	E111-V113 PolarHBondContact O-N 3.37Å
112	S	30.5	Very low	48.6	Very low	116 Å²	116	92.6 Å²	92.6	81%	0.811	57%	0.573	S	S	*	*			trans	-91.6	97.7	174.2	26.4	0	0	0	0	109.6	V110 S114	V110-S112 PolarHBondContact O-N 3.03Å; V110-S112 VanDerWaalsContact O-N 3.11Å; S112-S114 PolarHBondContact O-N 3.12Å
113	V	34.9	Very low	51.1	Low	128 Å²	128	90.7 Å²	90.7	78%	0.776	55%	0.554	S	S	*	*			trans	-50.6	124.6	170.9	-179.9	0	0	0	0	109.1	E111 I115	E111-V113 PolarHBondContact O-N 3.37Å; V113-I115 VanDerWaalsContact O-CG1 3.28Å; V113-I115 WeakPolarHBondContact O-CG1 3.37Å; V113-I115 PolarHBondContact O-N 3.44Å
114	S	39.8	Very low	53.6	Low	100 Å²	100	83.1 Å²	83.1	70%	0.699	52%	0.515	S	S	*	.			trans	-65.3	105.4	-171.8	56	0	0	0	0	112	S112 A116	S112-S114 PolarHBondContact O-N 3.12Å; S114-A116 PolarHBondContact O-N 3.33Å
115	I	54.4	Low	55.9	Low	135 Å²	135	81 Å²	81	69%	0.692	50%	0.495	S	S	*	.			trans	-78.4	53.8	-176.1	-39.4	177.7	0	0	0	111.1	V113	V113-I115 VanDerWaalsContact O-CG1 3.28Å; V113-I115 WeakPolarHBondContact O-CG1 3.37Å; V113-I115 PolarHBondContact O-N 3.44Å
116	A	58.4	Low	58.4	Low	48 Å²	48	72.8 Å²	72.8	40%	0.397	46%	0.457	S	S	.	.			trans	-94.3	139	172.1	0	0	0	0	0	110.3	N36 S114	N36-A116 PolarHBondContact ND2-O 2.78Å; S114-A116 PolarHBondContact O-N 3.33Å
117	P	62.7	Low	60.9	Low	24 Å²	24	68.6 Å²	68.6	16%	0.156	43%	0.429	C	S	.	.			trans	-63.2	167	167.1	30	-35.5	0	0	0	110.9	I17 S92 G119	I17-P117 HydrophobicContact CD1-CG 4.32Å; I17-P117 HydrophobicContact CG2-CB 3.71Å; I17-P117 HydrophobicContact CG2-CG 4.32Å; S92-P117 WeakPolarHBondContact CB-O 3.39Å; S92-P117 PolarHBondContact OG-O 2.9Å; S92-P117 VanDerWaalsContact OG-O 3.12Å; P117-G119 VanDerWaalsContact C-N 3.31Å
118	P	69.8	Low	63.3	Low	44 Å²	44	65.8 Å²	65.8	29%	0.286	41%	0.407	S	S	.	.	S	Bend	trans	-69.8	-31.1	176.9	31.8	-39.4	0	0	0	112.4	A35 D91 S92	A35-P118 HydrophobicContact CB-CB 3.79Å; A35-P118 HydrophobicContact CB-CG 3.6Å; D91-P118 CarbonylContact C-O 3.58Å; D91-P118 WeakPolarHBondContact CA-O 3.47Å; S92-P118 PolarHBondContact N-O 3.02Å
119	G	82.2	Confident	66	Low	0 Å²	0	65 Å²	65	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.5	175.2	-166.7	0	0	0	0	0	110.3	W89 L90 S92 P117	W89-G119 VanDerWaalsContact CH2-C 3.44Å; W89-G119 WeakPolarHBondContact CH2-O 3.38Å; L90-G119 CarbonylContact O-C 3.41Å; L90-G119 WeakPolarHBondContact O-CA 3.44Å; S92-G119 PolarHBondContact OG-N 3.03Å; P117-G119 VanDerWaalsContact C-N 3.31Å
120	A	86	Confident	68.3	Low	1 Å²	1	67.1 Å²	67.1	1%	0.008	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	162.4	179.3	0	0	0	0	0	111.7	Q15 I17 L90 W122	Q15-A120 HydrophobicContact CB-CB 3.99Å; I17-A120 HydrophobicContact CG1-CB 4Å; L90-A120 PolarHBondContact N-O 3.43Å; L90-A120 PolarHBondContact O-N 2.83Å; A120-W122 VanDerWaalsContact O-CD1 3.24Å
121	W	88.3	Confident	70.3	Confident	40 Å²	40	64.4 Å²	64.4	15%	0.152	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.2	167.3	-63.8	98.2	0	0	0	110.2	Q15 K16 E87 V88 W89 E179 R181	Q15-W121 WeakPolarHBondContact CA-O 3.5Å; K16-W121 HydrophobicContact CB-CB 4.13Å; K16-W121 PolarHBondContact N-O 2.71Å; K16-W121 PolarHBondContact O-N 3.1Å; E87-W121 HydrophobicContact CB-CB 4.39Å; E87-W121 HydrophobicContact CB-CE3 4.19Å; V88-W121 WeakPolarHBondContact O-CA 3.48Å; W89-W121 HydrophobicContact CB-CD2 4.41Å; W89-W121 HydrophobicContact CB-CE3 4.04Å; W89-W121 HydrophobicContact CB-CH2 4.1Å; W89-W121 HydrophobicContact CB-CZ2 4.47Å; W89-W121 HydrophobicContact CB-CZ3 3.87Å; W89-W121 AromaticContact CE3-CD1 3.77Å; W89-W121 AromaticContact CE3-CD2 3.88Å; W89-W121 HydrophobicContact CE3-CD2 3.88Å; W89-W121 AromaticContact CE3-CE2 3.65Å; W89-W121 AromaticContact CE3-CG 3.95Å; W89-W121 HydrophobicContact CE3-CG 3.95Å; W89-W121 HydrophobicContact CE3-CZ2 4.2Å; W89-W121 AromaticContact CE3-NE1 3.57Å; W89-W121 AromaticContact CZ3-CD1 3.83Å; W89-W121 HydrophobicContact CZ3-CG 4.39Å; W89-W121 AromaticContact CZ3-NE1 3.74Å; W121-E179 WeakPolarHBondContact CZ3-O 3.34Å; W121-R181 HydrophobicContact CD2-CG 4.36Å; W121-R181 HydrophobicContact CE3-CG 3.81Å; W121-R181 HydrophobicContact CH2-CB 4.35Å; W121-R181 HydrophobicContact CH2-CG 4.14Å; W121-R181 HydrophobicContact CZ3-CB 4.15Å; W121-R181 HydrophobicContact CZ3-CG 3.68Å
122	W	88.3	Confident	73	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.008	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	144.4	-179.8	-66	84.7	0	0	0	111.3	E13 Q15 E87 V88 L90 T95 A120 V138 A140 P141 L168	E13-W122 HydrophobicContact CB-CH2 4.08Å; E13-W122 HydrophobicContact CB-CZ3 3.89Å; Q15-W122 HydrophobicContact CB-CD2 3.93Å; Q15-W122 HydrophobicContact CB-CE3 3.96Å; Q15-W122 HydrophobicContact CB-CH2 3.8Å; Q15-W122 HydrophobicContact CB-CZ2 3.75Å; Q15-W122 HydrophobicContact CB-CZ3 3.9Å; Q15-W122 HydrophobicContact CG-CH2 4.26Å; Q15-W122 HydrophobicContact CG-CZ2 4.34Å; E87-W122 WeakPolarHBondContact CA-O 3.37Å; V88-W122 PolarHBondContact N-O 2.92Å; V88-W122 PolarHBondContact O-N 2.83Å; L90-W122 HydrophobicContact CD1-CB 4.37Å; L90-W122 HydrophobicContact CD1-CG 3.99Å; T95-W122 HydrophobicContact CG2-CZ2 3.97Å; A120-W122 VanDerWaalsContact O-CD1 3.24Å; W122-V138 HydrophobicContact CB-CG1 3.68Å; W122-A140 HydrophobicContact CB-CB 4.31Å; W122-A140 HydrophobicContact CD2-CB 3.62Å; W122-A140 HydrophobicContact CE3-CB 3.65Å; W122-A140 HydrophobicContact CG-CB 3.94Å; W122-A140 HydrophobicContact CZ3-CB 4.2Å; W122-P141 HydrophobicContact CH2-CG 3.98Å; W122-L168 HydrophobicContact CE3-CD1 4.43Å; W122-L168 HydrophobicContact CZ3-CD1 4.06Å
123	P	86	Confident	75.6	Confident	36 Å²	36	57.4 Å²	57.4	23%	0.234	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	136.1	176.2	28.5	-33.1	0	0	0	111.2	A139 L163	P123-A139 HydrophobicContact CG-CB 4.46Å; P123-A139 PolarHBondContact O-N 2.75Å; P123-L163 HydrophobicContact CG-CD1 3.97Å
124	G	85.7	Confident	78	Confident	7 Å²	7	51.3 Å²	51.3	7%	0.072	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	-167.6	177.5	0	0	0	0	0	113.3	V86 E137	V86-G124 PolarHBondContact N-O 2.67Å; V86-G124 CarbonylContact O-C 3.48Å; V86-G124 PolarHBondContact O-N 2.89Å; V86-G124 VanDerWaalsContact O-O 3.04Å; G124-E137 CarbonylContact C-O 3.58Å; G124-E137 WeakPolarHBondContact CA-O 3.08Å
125	R	85.7	Confident	80.2	Confident	67 Å²	67	49.5 Å²	49.5	25%	0.253	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	144.3	174.6	64.2	-170.2	-171.6	-83.2	1.5	111.8	D84 V136 E137 Y170	D84-R125 VanDerWaalsContact O-CA 3.27Å; D84-R125 WeakPolarHBondContact O-CA 3.43Å; R125-V136 CarbonylContact O-C 3.59Å; R125-V136 WeakPolarHBondContact O-CA 3.45Å; R125-E137 IonicContact CZ-OE1 3.03Å; R125-E137 IonicContact CZ-OE2 3.16Å; R125-E137 PolarHBondContact N-O 3.27Å; R125-E137 IonicContact NE-OE2 3.63Å; R125-E137 VanDerWaalsContact NH1-CD 3.29Å; R125-E137 IonicContact NH1-OE1 3.39Å; R125-E137 PolarHBondContact NH1-OE1 3.3Å; R125-E137 IonicContact NH1-OE2 3.7Å; R125-E137 PolarHBondContact NH1-OE2 2.96Å; R125-E137 IonicContact NH2-OE1 2.72Å; R125-E137 PolarHBondContact NH2-OE1 3.12Å; R125-E137 IonicContact NH2-OE2 2.69Å; R125-E137 PolarHBondContact NH2-OE2 3.22Å; R125-E137 PolarHBondContact O-N 3.43Å; R125-Y170 VanDerWaalsContact NH1-CD1 3.32Å
126	V	86	Confident	81.8	Confident	1 Å²	1	43 Å²	43	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	131.8	176	176.6	0	0	0	0	109.7	F80 R83 D84 V86 I129 V136	F80-V126 HydrophobicContact CB-CG2 4.21Å; R83-V126 VanDerWaalsContact CA-O 3.3Å; R83-V126 WeakPolarHBondContact CA-O 3.42Å; R83-V126 PolarHBondContact N-O 3.34Å; D84-V126 PolarHBondContact O-N 2.9Å; V86-V126 HydrophobicContact CB-CG2 4.46Å; V86-V126 HydrophobicContact CG1-CG2 3.74Å; V86-V126 HydrophobicContact CG2-CG2 3.87Å; V126-I129 HydrophobicContact CG1-CD1 3.99Å; V126-I129 HydrophobicContact CG1-CG1 3.64Å; V126-V136 HydrophobicContact CG2-CG1 4.35Å
127	L	84.4	Confident	83.2	Confident	48 Å²	48	41.9 Å²	41.9	25%	0.251	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-52.2	171.2	-61.8	-179.5	0	0	0	110.8	H135 E137	L127-H135 WeakPolarHBondContact CA-O 3.44Å; L127-H135 HydrophobicContact CB-CB 4.46Å; L127-H135 WeakPolarHBondContact CB-O 3.48Å; L127-H135 PolarHBondContact N-O 3.2Å; L127-E137 HydrophobicContact CD1-CB 4.06Å
128	T	85.3	Confident	84.3	Confident	64 Å²	64	40.7 Å²	40.7	39%	0.393	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	151.8	175	50.2	0	0	0	0	110.8	A134 H135	T128-A134 CarbonylContact O-C 3.59Å; T128-A134 WeakPolarHBondContact O-CA 3.43Å; T128-H135 PolarHBondContact N-O 3.05Å; T128-H135 PolarHBondContact O-N 3.04Å; T128-H135 WeakPolarHBondContact OG1-CB 3.48Å
129	I	83.4	Confident	84.9	Confident	69 Å²	69	38.7 Å²	38.7	35%	0.354	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.1	171.9	-58.2	-173.1	0	0	0	108.7	F80 V126 F133 A134 V177	F80-I129 HydrophobicContact CB-CD1 3.84Å; F80-I129 HydrophobicContact CD2-CD1 4.29Å; F80-I129 HydrophobicContact CG-CD1 4.49Å; V126-I129 HydrophobicContact CG1-CD1 3.99Å; V126-I129 HydrophobicContact CG1-CG1 3.64Å; I129-F133 WeakPolarHBondContact CA-O 3.43Å; I129-A134 HydrophobicContact CD1-CB 4.45Å; I129-A134 HydrophobicContact CG1-CB 3.9Å; I129-V177 HydrophobicContact CG2-CG2 3.74Å
130	Q	80.8	Confident	84.7	Confident	150 Å²	150	38.7 Å²	38.7	70%	0.701	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-148.8	130.3	-179.6	-66.8	-173.4	-19.1	0	0	110.4	G132 F133	Q130-G132 VanDerWaalsContact C-N 3.32Å; Q130-G132 PolarHBondContact O-N 2.85Å; Q130-F133 PolarHBondContact N-O 2.84Å; Q130-F133 PolarHBondContact O-N 2.84Å; Q130-F133 VanDerWaalsContact O-O 3.04Å
131	G	77.1	Confident	83.9	Confident	80 Å²	80	39.6 Å²	39.6	83%	0.825	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	29.6	168	0	0	0	0	0	116.4	F133	G131-F133 VanDerWaalsContact C-N 3.31Å
132	G	82.7	Confident	82.9	Confident	49 Å²	49	39.7 Å²	39.7	51%	0.505	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-2.7	-176.5	0	0	0	0	0	114.9	Q130 V177	Q130-G132 VanDerWaalsContact C-N 3.32Å; Q130-G132 PolarHBondContact O-N 2.85Å; G132-V177 WeakPolarHBondContact O-CG2 3.38Å; G132-V177 PolarHBondContact O-N 3.05Å
133	F	85.8	Confident	81.6	Confident	113 Å²	113	45 Å²	45	50%	0.496	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	155.4	171.4	-62.9	-90.6	0	0	0	110.9	I129 Q130 G131 V175 K176	I129-F133 WeakPolarHBondContact CA-O 3.43Å; Q130-F133 PolarHBondContact N-O 2.84Å; Q130-F133 PolarHBondContact O-N 2.84Å; Q130-F133 VanDerWaalsContact O-O 3.04Å; G131-F133 VanDerWaalsContact C-N 3.31Å; F133-V175 WeakPolarHBondContact CA-O 3.44Å; F133-K176 HydrophobicContact CD1-CG 4.21Å; F133-K176 HydrophobicContact CE1-CG 3.93Å
134	A	84.5	Confident	80	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.3	174.1	0	0	0	0	0	110.2	T128 I129 V136 V175 V177 I180	T128-A134 CarbonylContact O-C 3.59Å; T128-A134 WeakPolarHBondContact O-CA 3.43Å; I129-A134 HydrophobicContact CD1-CB 4.45Å; I129-A134 HydrophobicContact CG1-CB 3.9Å; A134-V136 HydrophobicContact CB-CG1 4.33Å; A134-V175 PolarHBondContact N-O 2.92Å; A134-V175 PolarHBondContact O-N 3.49Å; A134-V177 HydrophobicContact CB-CG2 4.31Å; A134-I180 HydrophobicContact CB-CD1 3.38Å
135	H	87.1	Confident	78	Confident	61 Å²	61	61 Å²	61	28%	0.282	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	121.9	168.3	179.6	-148.9	0	0	0	107.7	L127 T128 S172 L174	L127-H135 WeakPolarHBondContact CA-O 3.44Å; L127-H135 HydrophobicContact CB-CB 4.46Å; L127-H135 WeakPolarHBondContact CB-O 3.48Å; L127-H135 PolarHBondContact N-O 3.2Å; T128-H135 PolarHBondContact N-O 3.05Å; T128-H135 PolarHBondContact O-N 3.04Å; T128-H135 WeakPolarHBondContact OG1-CB 3.48Å; H135-S172 WeakPolarHBondContact NE2-CB 3.49Å; H135-L174 HydrophobicContact CB-CD2 3.88Å
136	V	87.4	Confident	75.7	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.3	-169.2	-78.4	0	0	0	0	112.2	V86 V88 R125 V126 A134 V138 S172 T173 V175 I180	V86-V136 HydrophobicContact CG2-CG1 4.46Å; V88-V136 HydrophobicContact CG1-CG2 4.06Å; V88-V136 HydrophobicContact CG2-CB 4.2Å; V88-V136 HydrophobicContact CG2-CG1 4.16Å; V88-V136 HydrophobicContact CG2-CG2 4.3Å; R125-V136 CarbonylContact O-C 3.59Å; R125-V136 WeakPolarHBondContact O-CA 3.45Å; V126-V136 HydrophobicContact CG2-CG1 4.35Å; A134-V136 HydrophobicContact CB-CG1 4.33Å; V136-V138 HydrophobicContact CB-CG2 3.94Å; V136-V138 HydrophobicContact CG2-CG2 3.7Å; V136-V138 PolarHBondContact O-N 2.59Å; V136-S172 WeakPolarHBondContact O-CA 3.36Å; V136-T173 HydrophobicContact CG2-CG2 3.85Å; V136-T173 WeakPolarHBondContact CG2-O 3.49Å; V136-T173 PolarHBondContact N-O 3.39Å; V136-T173 PolarHBondContact O-N 3.49Å; V136-V175 HydrophobicContact CG2-CB 4.08Å; V136-V175 HydrophobicContact CG2-CG2 3.83Å; V136-I180 HydrophobicContact CG1-CD1 3.63Å
137	E	87.4	Confident	73.2	Confident	23 Å²	23	67.1 Å²	67.1	11%	0.107	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	86.4	166.9	166.1	-66.7	162.4	0	0	112.3	G124 R125 L127 Y170 R171	G124-E137 CarbonylContact C-O 3.58Å; G124-E137 WeakPolarHBondContact CA-O 3.08Å; R125-E137 IonicContact CZ-OE1 3.03Å; R125-E137 IonicContact CZ-OE2 3.16Å; R125-E137 PolarHBondContact N-O 3.27Å; R125-E137 IonicContact NE-OE2 3.63Å; R125-E137 VanDerWaalsContact NH1-CD 3.29Å; R125-E137 IonicContact NH1-OE1 3.39Å; R125-E137 PolarHBondContact NH1-OE1 3.3Å; R125-E137 IonicContact NH1-OE2 3.7Å; R125-E137 PolarHBondContact NH1-OE2 2.96Å; R125-E137 IonicContact NH2-OE1 2.72Å; R125-E137 PolarHBondContact NH2-OE1 3.12Å; R125-E137 IonicContact NH2-OE2 2.69Å; R125-E137 PolarHBondContact NH2-OE2 3.22Å; R125-E137 PolarHBondContact O-N 3.43Å; L127-E137 HydrophobicContact CD1-CB 4.06Å; E137-Y170 HydrophobicContact CG-CD1 4.03Å; E137-Y170 HydrophobicContact CG-CG 4.46Å; E137-Y170 WeakPolarHBondContact O-CD1 3.33Å; E137-Y170 WeakPolarHBondContact O-CE1 3.32Å; E137-Y170 WeakPolarHBondContact OE1-CB 3.31Å; E137-R171 WeakPolarHBondContact CB-O 3.35Å
138	V	85.3	Confident	71	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	139.8	-174.6	-168.8	0	0	0	0	112.1	V88 L90 W122 V136 A140 Y170 R171 T173	V88-V138 HydrophobicContact CB-CG2 4.01Å; V88-V138 HydrophobicContact CG1-CG2 4Å; V88-V138 HydrophobicContact CG2-CG2 3.89Å; L90-V138 HydrophobicContact CD1-CG1 4.09Å; W122-V138 HydrophobicContact CB-CG1 3.68Å; V136-V138 HydrophobicContact CB-CG2 3.94Å; V136-V138 HydrophobicContact CG2-CG2 3.7Å; V136-V138 PolarHBondContact O-N 2.59Å; V138-A140 HydrophobicContact CG1-CB 3.96Å; V138-Y170 CarbonylContact O-C 3.5Å; V138-Y170 WeakPolarHBondContact O-CA 3.32Å; V138-R171 PolarHBondContact N-O 2.87Å; V138-R171 VanDerWaalsContact N-O 3.12Å; V138-R171 PolarHBondContact O-N 3.36Å; V138-T173 HydrophobicContact CG2-CG2 3.83Å
139	A	83.7	Confident	68.4	Low	1 Å²	1	77.3 Å²	77.3	1%	0.008	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	88.9	168.6	0	0	0	0	0	110.1	P123 L168 Y170	P123-A139 HydrophobicContact CG-CB 4.46Å; P123-A139 PolarHBondContact O-N 2.75Å; A139-L168 HydrophobicContact CB-CB 4.17Å; A139-L168 HydrophobicContact CB-CD1 4.44Å; A139-L168 WeakPolarHBondContact O-CD1 3.47Å; A139-Y170 HydrophobicContact CB-CD1 4.1Å; A139-Y170 HydrophobicContact CB-CD2 4.02Å; A139-Y170 HydrophobicContact CB-CE1 3.86Å; A139-Y170 HydrophobicContact CB-CE2 3.77Å; A139-Y170 HydrophobicContact CB-CG 4.2Å
140	A	77.5	Confident	66	Low	0 Å²	0	80.8 Å²	80.8	0%	0	44%	0.444	C	S	.	.	S	Bend	trans	-148.8	154.1	-179.6	0	0	0	0	0	110.9	L90 W122 V138 L142	L90-A140 HydrophobicContact CD1-CB 3.59Å; W122-A140 HydrophobicContact CB-CB 4.31Å; W122-A140 HydrophobicContact CD2-CB 3.62Å; W122-A140 HydrophobicContact CE3-CB 3.65Å; W122-A140 HydrophobicContact CG-CB 3.94Å; W122-A140 HydrophobicContact CZ3-CB 4.2Å; V138-A140 HydrophobicContact CG1-CB 3.96Å; A140-L142 HydrophobicContact CB-CD2 4.12Å; A140-L142 HydrophobicContact CB-CG 4.49Å; A140-L142 PolarHBondContact O-N 2.86Å
141	P	70.4	Confident	63.7	Low	20 Å²	20	82.2 Å²	82.2	13%	0.13	45%	0.448	C	S	.	.			trans	-77.8	67.3	176.8	34.9	-37.6	0	0	0	111.6	E13 T95 K97 W122	E13-P141 WeakPolarHBondContact OE2-CG 3.43Å; T95-P141 WeakPolarHBondContact CA-O 3.19Å; K97-P141 HydrophobicContact CD-CB 4.45Å; K97-P141 HydrophobicContact CG-CB 4.34Å; W122-P141 HydrophobicContact CH2-CG 3.98Å
142	L	65.5	Low	61.6	Low	42 Å²	42	84.8 Å²	84.8	22%	0.22	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-63.8	140.6	179.2	-59.7	-171.4	0	0	0	111.7	L90 S94 T95 A140 R171 T173	L90-L142 HydrophobicContact CD1-CD2 3.66Å; S94-L142 WeakPolarHBondContact O-CA 3.17Å; T95-L142 HydrophobicContact CG2-CD2 4.5Å; A140-L142 HydrophobicContact CB-CD2 4.12Å; A140-L142 HydrophobicContact CB-CG 4.49Å; A140-L142 PolarHBondContact O-N 2.86Å; L142-R171 HydrophobicContact CD1-CB 3.7Å; L142-R171 HydrophobicContact CG-CB 4.24Å; L142-T173 HydrophobicContact CD1-CG2 4.25Å
143	Q	61.6	Low	59.2	Low	113 Å²	113	88.4 Å²	88.4	53%	0.528	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-70.4	131.3	177.7	-174.8	170.4	-23.7	0	0	111.8	S94 Y145	S94-Q143 PolarHBondContact O-N 2.6Å; Q143-Y145 PolarHBondContact O-N 3Å
144	E	52.5	Low	56.5	Low	146 Å²	146	86.5 Å²	86.5	68%	0.682	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-72.2	127.1	-179.1	-64.3	-172.2	151.4	0	0	112.2	T146	E144-T146 PolarHBondContact O-N 3.24Å
145	Y	44.7	Very low	53.9	Low	233 Å²	233	95.8 Å²	95.8	91%	0.914	51%	0.511	S	S	*	.			trans	-80.6	81.7	175.8	-121.1	-89.6	0	0	0	110.1	Q143 G147	Q143-Y145 PolarHBondContact O-N 3Å; Y145-G147 PolarHBondContact O-N 3.3Å
146	T	36.1	Very low	51.3	Low	136 Å²	136	97.2 Å²	97.2	83%	0.834	53%	0.533	S	S	*	.			trans	-72.5	73.9	177.9	59.1	0	0	0	0	111.1	E144	E144-T146 PolarHBondContact O-N 3.24Å
147	G	34.6	Very low	48.7	Very low	62 Å²	62	104.9 Å²	104.9	64%	0.639	57%	0.571	S	S	*	*			trans	-122.3	-11.4	-172.6	0	0	0	0	0	116.5	Y145	Y145-G147 PolarHBondContact O-N 3.3Å
148	V	38.3	Very low	46.5	Very low	122 Å²	122	106.3 Å²	106.3	74%	0.739	58%	0.582	S	S	*	*	S	Bend	trans	-141.4	132.7	177.2	-177	0	0	0	0	109.2	D150	V148-D150 PolarHBondContact O-N 3.06Å; V148-D150 VanDerWaalsContact O-N 3.12Å
149	E	30.6	Very low	44.5	Very low	203 Å²	203	112.6 Å²	112.6	95%	0.949	61%	0.611	S	S	*	*			trans	-78.5	82.8	169.3	-72.3	-163.6	147.6	0	0	110.8
150	D	33.3	Very low	42.5	Very low	142 Å²	142	117.2 Å²	117.2	76%	0.759	64%	0.635	S	S	*	*			trans	-103.1	133.4	163.5	-98.9	-51.7	0	0	0	111	V148	V148-D150 PolarHBondContact O-N 3.06Å; V148-D150 VanDerWaalsContact O-N 3.12Å
151	K	31.2	Very low	41	Very low	180 Å²	180	121.2 Å²	121.2	78%	0.783	66%	0.655	S	S	*	*			trans	-61.5	150.2	-179.2	-81.6	172.1	176.7	166.6	0	110.8	T153	K151-T153 VanDerWaalsContact C-N 3.26Å; K151-T153 PolarHBondContact O-N 3.31Å; K151-T153 PolarHBondContact O-OG1 3.11Å
152	P	32.9	Very low	39.7	Very low	134 Å²	134	122.6 Å²	122.6	87%	0.87	67%	0.673	S	S	*	*			trans	-66.9	86.7	174.9	29.2	-35.4	0	0	0	110.2	A154	P152-A154 PolarHBondContact O-N 3.34Å
153	T	32.7	Very low	39	Very low	126 Å²	126	122.7 Å²	122.7	77%	0.773	67%	0.674	S	S	*	*			trans	-71.1	119.1	172.6	-48.3	0	0	0	0	106.9	K151	K151-T153 VanDerWaalsContact C-N 3.26Å; K151-T153 PolarHBondContact O-N 3.31Å; K151-T153 PolarHBondContact O-OG1 3.11Å
154	A	30.3	Very low	38.6	Very low	73 Å²	73	120.7 Å²	120.7	60%	0.603	68%	0.684	S	S	*	*	S	Bend	trans	-58.6	165	172.2	0	0	0	0	0	110.7	P152	P152-A154 PolarHBondContact O-N 3.34Å
155	H	29.3	Very low	38.5	Very low	195 Å²	195	119.5 Å²	119.5	90%	0.903	69%	0.691	S	S	*	*			trans	89.7	40.3	-179.1	-46.1	-70	0	0	0	117.9
156	A	32.9	Very low	38.9	Very low	90 Å²	90	110.2 Å²	110.2	74%	0.744	66%	0.659	S	S	*	*			trans	-149.1	99	143.5	0	0	0	0	0	110.8
157	M	32.1	Very low	39.9	Very low	162 Å²	162	107.6 Å²	107.6	80%	0.798	64%	0.642	S	S	*	*			trans	-69	127.6	159.3	-78.8	-172.6	71.2	0	0	107.3
158	P	40.8	Very low	41.3	Very low	52 Å²	52	105 Å²	105	34%	0.338	61%	0.614	S	S	.	*			trans	-61	143.9	171.1	27.6	-33.8	0	0	0	108.9	L160	P158-L160 VanDerWaalsContact C-N 3.35Å; P158-L160 HydrophobicContact CG-CD2 4.28Å; P158-L160 HydrophobicContact CG-CG 4.33Å; P158-L160 PolarHBondContact O-N 2.99Å
159	H	43.1	Very low	42.8	Very low	133 Å²	133	101 Å²	101	62%	0.616	59%	0.59	S	S	*	*			trans	-68.5	97.1	172.8	-67.1	-57.1	0	0	0	108.7	Y170	H159-Y170 WeakPolarHBondContact O-CD2 3.31Å
160	L	43.1	Very low	44.6	Very low	97 Å²	97	92.9 Å²	92.9	51%	0.508	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83	117.9	176.8	-66.4	169.2	0	0	0	108.4	P158 V167	P158-L160 VanDerWaalsContact C-N 3.35Å; P158-L160 HydrophobicContact CG-CD2 4.28Å; P158-L160 HydrophobicContact CG-CG 4.33Å; P158-L160 PolarHBondContact O-N 2.99Å; L160-V167 HydrophobicContact CB-CG1 3.66Å; L160-V167 HydrophobicContact CD2-CG1 3.75Å; L160-V167 HydrophobicContact CG-CG1 4.14Å
161	I	45.2	Very low	46.6	Very low	84 Å²	84	90.6 Å²	90.6	43%	0.431	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130.4	169.6	-61	-172.2	0	0	0	107.5	L163 Y170	I161-L163 PolarHBondContact O-N 3.08Å; I161-Y170 HydrophobicContact CB-CE2 4.07Å; I161-Y170 HydrophobicContact CD1-CE2 3.71Å; I161-Y170 HydrophobicContact CG1-CD2 4.44Å; I161-Y170 HydrophobicContact CG1-CE2 3.89Å
162	G	42.4	Very low	49.1	Very low	49 Å²	49	85.7 Å²	85.7	51%	0.505	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	109	169.7	0	0	0	0	0	109.9
163	L	51.4	Low	51.6	Low	45 Å²	45	81.1 Å²	81.1	24%	0.236	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	95.6	164.8	-68.5	172.7	0	0	0	106.4	H14 P123 I161 S165 V166	H14-L163 HydrophobicContact CB-CD1 4.43Å; H14-L163 PolarHBondContact CD2-O 2.89Å; H14-L163 PolarHBondContact NE2-O 2.99Å; P123-L163 HydrophobicContact CG-CD1 3.97Å; I161-L163 PolarHBondContact O-N 3.08Å; L163-S165 PolarHBondContact O-N 3.48Å; L163-V166 PolarHBondContact N-O 2.92Å; L163-V166 PolarHBondContact O-N 3.27Å
164	G	53.8	Low	54.1	Low	71 Å²	71	81.1 Å²	81.1	73%	0.732	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	-123.4	-168.6	0	0	0	0	0	111.5
165	S	49.9	Very low	56.8	Low	121 Å²	121	78 Å²	78	85%	0.846	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-9.2	175.2	53.1	0	0	0	0	114.1	L163	L163-S165 PolarHBondContact O-N 3.48Å
166	V	53.5	Low	59.5	Low	38 Å²	38	73.4 Å²	73.4	23%	0.23	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.8	-176.6	-174.8	0	0	0	0	109.9	S12 E13 L163 L168	S12-V166 WeakPolarHBondContact O-CG2 3.25Å; E13-V166 HydrophobicContact CG-CG1 4.34Å; L163-V166 PolarHBondContact N-O 2.92Å; L163-V166 PolarHBondContact O-N 3.27Å; V166-L168 HydrophobicContact CG1-CD2 3.78Å; V166-L168 HydrophobicContact CG1-CG 3.99Å
167	V	57.5	Low	61.9	Low	80 Å²	80	71.6 Å²	71.6	49%	0.485	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	98.9	177.7	-169.9	0	0	0	0	108.4	L160	L160-V167 HydrophobicContact CB-CG1 3.66Å; L160-V167 HydrophobicContact CD2-CG1 3.75Å; L160-V167 HydrophobicContact CG-CG1 4.14Å
168	L	63.6	Low	64.5	Low	7 Å²	7	69.6 Å²	69.6	4%	0.037	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	139.4	178.8	-65.5	-178.9	0	0	0	111.1	E13 W122 A139 V166 Y170	E13-L168 HydrophobicContact CB-CD1 4.32Å; E13-L168 HydrophobicContact CB-CD2 4.38Å; E13-L168 WeakPolarHBondContact O-CD1 3.26Å; E13-L168 WeakPolarHBondContact OE2-CD2 3.33Å; W122-L168 HydrophobicContact CE3-CD1 4.43Å; W122-L168 HydrophobicContact CZ3-CD1 4.06Å; A139-L168 HydrophobicContact CB-CB 4.17Å; A139-L168 HydrophobicContact CB-CD1 4.44Å; A139-L168 WeakPolarHBondContact O-CD1 3.47Å; V166-L168 HydrophobicContact CG1-CD2 3.78Å; V166-L168 HydrophobicContact CG1-CG 3.99Å; L168-Y170 PolarHBondContact O-N 2.87Å
169	P	68.7	Low	66.6	Low	38 Å²	38	69.5 Å²	69.5	25%	0.247	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	123.8	170.1	30.8	-31.6	0	0	0	109.5
170	Y	68.5	Low	68.6	Low	34 Å²	34	63.9 Å²	63.9	13%	0.133	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	138.2	164.5	-87.6	-91.1	0	0	0	110.7	R125 E137 V138 A139 H159 I161 L168	R125-Y170 VanDerWaalsContact NH1-CD1 3.32Å; E137-Y170 HydrophobicContact CG-CD1 4.03Å; E137-Y170 HydrophobicContact CG-CG 4.46Å; E137-Y170 WeakPolarHBondContact O-CD1 3.33Å; E137-Y170 WeakPolarHBondContact O-CE1 3.32Å; E137-Y170 WeakPolarHBondContact OE1-CB 3.31Å; V138-Y170 CarbonylContact O-C 3.5Å; V138-Y170 WeakPolarHBondContact O-CA 3.32Å; A139-Y170 HydrophobicContact CB-CD1 4.1Å; A139-Y170 HydrophobicContact CB-CD2 4.02Å; A139-Y170 HydrophobicContact CB-CE1 3.86Å; A139-Y170 HydrophobicContact CB-CE2 3.77Å; A139-Y170 HydrophobicContact CB-CG 4.2Å; H159-Y170 WeakPolarHBondContact O-CD2 3.31Å; I161-Y170 HydrophobicContact CB-CE2 4.07Å; I161-Y170 HydrophobicContact CD1-CE2 3.71Å; I161-Y170 HydrophobicContact CG1-CD2 4.44Å; I161-Y170 HydrophobicContact CG1-CE2 3.89Å; L168-Y170 PolarHBondContact O-N 2.87Å
171	R	76.6	Confident	70.6	Confident	94 Å²	94	61.1 Å²	61.1	36%	0.355	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	130	-177.9	-71.6	-68.8	-177.2	-91.6	5.2	111.3	E137 V138 L142	E137-R171 WeakPolarHBondContact CB-O 3.35Å; V138-R171 PolarHBondContact N-O 2.87Å; V138-R171 VanDerWaalsContact N-O 3.12Å; V138-R171 PolarHBondContact O-N 3.36Å; L142-R171 HydrophobicContact CD1-CB 3.7Å; L142-R171 HydrophobicContact CG-CB 4.24Å
172	S	82.1	Confident	72.3	Confident	77 Å²	77	60.7 Å²	60.7	54%	0.538	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	128.1	173.6	48.3	0	0	0	0	112	H135 V136	H135-S172 WeakPolarHBondContact NE2-CB 3.49Å; V136-S172 WeakPolarHBondContact O-CA 3.36Å
173	T	85.1	Confident	74.1	Confident	37 Å²	37	60 Å²	60	23%	0.227	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	163.3	170.5	-175.6	0	0	0	0	111.4	L90 V136 V138 L142 V175	L90-T173 HydrophobicContact CD2-CG2 4.47Å; V136-T173 HydrophobicContact CG2-CG2 3.85Å; V136-T173 WeakPolarHBondContact CG2-O 3.49Å; V136-T173 PolarHBondContact N-O 3.39Å; V136-T173 PolarHBondContact O-N 3.49Å; V138-T173 HydrophobicContact CG2-CG2 3.83Å; L142-T173 HydrophobicContact CD1-CG2 4.25Å; T173-V175 HydrophobicContact CG2-CG2 3.92Å
174	L	86.6	Confident	75.2	Confident	126 Å²	126	59.5 Å²	59.5	66%	0.66	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	124	177.2	-78.8	165	0	0	0	109.1	H135	H135-L174 HydrophobicContact CB-CD2 3.88Å
175	V	86	Confident	75.9	Confident	9 Å²	9	61 Å²	61	6%	0.055	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.5	-169.4	174.3	0	0	0	0	108.7	V88 L90 F133 A134 V136 T173 E179 I180	V88-V175 HydrophobicContact CG1-CB 4.25Å; V88-V175 HydrophobicContact CG1-CG1 3.9Å; V88-V175 HydrophobicContact CG1-CG2 3.87Å; L90-V175 HydrophobicContact CD2-CG2 4.46Å; F133-V175 WeakPolarHBondContact CA-O 3.44Å; A134-V175 PolarHBondContact N-O 2.92Å; A134-V175 PolarHBondContact O-N 3.49Å; V136-V175 HydrophobicContact CG2-CB 4.08Å; V136-V175 HydrophobicContact CG2-CG2 3.83Å; T173-V175 HydrophobicContact CG2-CG2 3.92Å; V175-E179 HydrophobicContact CG1-CB 3.31Å; V175-E179 HydrophobicContact CG1-CG 4.39Å; V175-I180 HydrophobicContact CB-CD1 4.49Å; V175-I180 HydrophobicContact CG1-CD1 4.33Å; V175-I180 HydrophobicContact CG1-CG1 4.03Å
176	K	86.7	Confident	76.5	Confident	97 Å²	97	55.4 Å²	55.4	42%	0.422	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	150.9	176.8	-56.4	-174.4	-158.4	76.2	0	110.1	F133 T178 E179	F133-K176 HydrophobicContact CD1-CG 4.21Å; F133-K176 HydrophobicContact CE1-CG 3.93Å; K176-T178 WeakPolarHBondContact CB-OG1 3.5Å; K176-T178 PolarHBondContact O-N 2.86Å; K176-T178 VanDerWaalsContact O-N 3.14Å; K176-E179 HydrophobicContact CB-CG 4.3Å; K176-E179 WeakPolarHBondContact CB-OE2 3.4Å; K176-E179 WeakPolarHBondContact CD-OE1 3.37Å; K176-E179 WeakPolarHBondContact CG-OE2 3.47Å; K176-E179 PolarHBondContact N-OE2 3.02Å; K176-E179 IonicContact NZ-OE1 2.78Å; K176-E179 PolarHBondContact NZ-OE1 3.46Å; K176-E179 IonicContact NZ-OE2 3.7Å; K176-E179 WeakPolarHBondContact O-CB 3.44Å; K176-E179 PolarHBondContact O-N 3.12Å
177	V	84	Confident	76.8	Confident	52 Å²	52	58.5 Å²	58.5	32%	0.315	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-60.9	-24.8	175.2	172	0	0	0	0	112.1	I129 G132 A134 E179	I129-V177 HydrophobicContact CG2-CG2 3.74Å; G132-V177 WeakPolarHBondContact O-CG2 3.38Å; G132-V177 PolarHBondContact O-N 3.05Å; A134-V177 HydrophobicContact CB-CG2 4.31Å; V177-E179 VanDerWaalsContact C-N 3.28Å; V177-E179 PolarHBondContact O-N 3.16Å
178	T	85.1	Confident	76.6	Confident	120 Å²	120	61.4 Å²	61.4	74%	0.736	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-71.4	-16.6	173	53.2	0	0	0	0	114.7	K176 I180	K176-T178 WeakPolarHBondContact CB-OG1 3.5Å; K176-T178 PolarHBondContact O-N 2.86Å; K176-T178 VanDerWaalsContact O-N 3.14Å; T178-I180 VanDerWaalsContact C-N 3.34Å
179	E	85.9	Confident	75.3	Confident	50 Å²	50	65.6 Å²	65.6	23%	0.234	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-99	17.1	-177.7	-73.5	149.7	-166.5	0	0	111.2	W89 W121 V175 K176 V177	W89-E179 HydrophobicContact CB-CB 4.2Å; W89-E179 PolarHBondContact N-O 2.85Å; W121-E179 WeakPolarHBondContact CZ3-O 3.34Å; V175-E179 HydrophobicContact CG1-CB 3.31Å; V175-E179 HydrophobicContact CG1-CG 4.39Å; K176-E179 HydrophobicContact CB-CG 4.3Å; K176-E179 WeakPolarHBondContact CB-OE2 3.4Å; K176-E179 WeakPolarHBondContact CD-OE1 3.37Å; K176-E179 WeakPolarHBondContact CG-OE2 3.47Å; K176-E179 PolarHBondContact N-OE2 3.02Å; K176-E179 IonicContact NZ-OE1 2.78Å; K176-E179 PolarHBondContact NZ-OE1 3.46Å; K176-E179 IonicContact NZ-OE2 3.7Å; K176-E179 WeakPolarHBondContact O-CB 3.44Å; K176-E179 PolarHBondContact O-N 3.12Å; V177-E179 VanDerWaalsContact C-N 3.28Å; V177-E179 PolarHBondContact O-N 3.16Å
180	I	85.1	Confident	73.4	Confident	15 Å²	15	69.6 Å²	69.6	8%	0.077	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.9	-175.9	-63.1	173.2	0	0	0	109.6	F80 V86 E87 V88 A134 V136 V175 T178	F80-I180 HydrophobicContact CE1-CG2 4.45Å; F80-I180 HydrophobicContact CZ-CG2 4.21Å; V86-I180 HydrophobicContact CB-CG2 3.74Å; V86-I180 HydrophobicContact CG1-CG2 3.85Å; V86-I180 HydrophobicContact CG2-CG2 3.98Å; E87-I180 WeakPolarHBondContact O-CA 3.44Å; V88-I180 HydrophobicContact CG1-CG1 4.41Å; V88-I180 HydrophobicContact CG2-CG1 4.39Å; A134-I180 HydrophobicContact CB-CD1 3.38Å; V136-I180 HydrophobicContact CG1-CD1 3.63Å; V175-I180 HydrophobicContact CB-CD1 4.49Å; V175-I180 HydrophobicContact CG1-CD1 4.33Å; V175-I180 HydrophobicContact CG1-CG1 4.03Å; T178-I180 VanDerWaalsContact C-N 3.34Å
181	R	85.1	Confident	71.3	Confident	39 Å²	39	74.8 Å²	74.8	15%	0.147	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	157.8	175	69	-174.7	-168.4	179.6	5.8	112.3	E8 V86 E87 W121	E8-R181 VanDerWaalsContact CD-NH2 3.26Å; E8-R181 IonicContact OE1-CZ 3.7Å; E8-R181 VanDerWaalsContact OE1-CZ 3.26Å; E8-R181 IonicContact OE1-NH1 2.86Å; E8-R181 PolarHBondContact OE1-NH1 2.72Å; E8-R181 IonicContact OE1-NH2 2.9Å; E8-R181 PolarHBondContact OE1-NH2 3.33Å; E8-R181 IonicContact OE2-CZ 2.68Å; E8-R181 IonicContact OE2-NH2 2.56Å; E8-R181 PolarHBondContact OE2-NH2 2.95Å; V86-R181 WeakPolarHBondContact CA-O 3.15Å; V86-R181 WeakPolarHBondContact CB-O 3.45Å; E87-R181 HydrophobicContact CB-CG 3.76Å; E87-R181 PolarHBondContact N-O 2.89Å; E87-R181 PolarHBondContact O-N 3.23Å; E87-R181 IonicContact OE2-CZ 2.68Å; E87-R181 IonicContact OE2-NE 3.11Å; E87-R181 PolarHBondContact OE2-NE 2.78Å; E87-R181 IonicContact OE2-NH2 4Å; E87-R181 PolarHBondContact OE2-NH2 3.31Å; W121-R181 HydrophobicContact CD2-CG 4.36Å; W121-R181 HydrophobicContact CE3-CG 3.81Å; W121-R181 HydrophobicContact CH2-CB 4.35Å; W121-R181 HydrophobicContact CH2-CG 4.14Å; W121-R181 HydrophobicContact CZ3-CB 4.15Å; W121-R181 HydrophobicContact CZ3-CG 3.68Å
182	V	81.1	Confident	69	Low	75 Å²	75	78.9 Å²	78.9	46%	0.455	43%	0.427	S	S	.	.			trans	-59	139.3	165.1	-179.6	0	0	0	0	108.3	F80 W184	F80-V182 HydrophobicContact CE1-CG2 3.73Å; F80-V182 HydrophobicContact CZ-CG2 4.21Å; V182-W184 PolarHBondContact O-N 3.25Å
183	P	79.3	Confident	66.5	Low	35 Å²	35	81.8 Å²	81.8	23%	0.227	44%	0.441	C	S	.	.			trans	-56.5	132	-178.3	-25.3	35.7	0	0	0	111.5	P85 E87 N185	P85-P183 HydrophobicContact CB-CG 4.19Å; P85-P183 HydrophobicContact CG-CG 4.46Å; P85-P183 WeakPolarHBondContact O-CD 3.49Å; P85-P183 WeakPolarHBondContact O-CG 3.35Å; E87-P183 HydrophobicContact CG-CB 4.38Å; E87-P183 WeakPolarHBondContact OE1-CA 3.37Å; P183-N185 PolarHBondContact O-OD1 3.5Å
184	W	75.5	Confident	63.8	Low	34 Å²	34	89.2 Å²	89.2	13%	0.129	47%	0.474	C	S	.	.			trans	-90.6	115	-174.6	177.9	-121	0	0	0	111.1	K16 L49 P51 F54 E87 V182 F188	K16-W184 PolarHBondContact NZ-O 3.27Å; L49-W184 PolarHBondContact O-NE1 3.38Å; P51-W184 HydrophobicContact CB-CD2 4.26Å; P51-W184 HydrophobicContact CB-CE3 4.38Å; P51-W184 HydrophobicContact CG-CB 4.21Å; P51-W184 HydrophobicContact CG-CD2 3.78Å; P51-W184 HydrophobicContact CG-CE3 4.24Å; P51-W184 HydrophobicContact CG-CG 3.72Å; F54-W184 HydrophobicContact CE2-CH2 4.16Å; F54-W184 AromaticContact CE2-CZ2 3.68Å; F54-W184 HydrophobicContact CE2-CZ2 3.68Å; F54-W184 HydrophobicContact CZ-CZ2 4.2Å; E87-W184 PolarHBondContact OE1-N 2.88Å; V182-W184 PolarHBondContact O-N 3.25Å; W184-F188 AromaticContact CH2-CD2 3.92Å; W184-F188 HydrophobicContact CH2-CD2 3.92Å; W184-F188 HydrophobicContact CH2-CE2 4.14Å
185	N	68.9	Low	61.1	Low	102 Å²	102	90.3 Å²	90.3	55%	0.545	48%	0.48	S	S	.	.			trans	-95	11.7	-172.4	-61.2	-16.6	0	0	0	113.6	P183 K187 N215	P183-N185 PolarHBondContact O-OD1 3.5Å; N185-K187 PolarHBondContact O-N 3.21Å; N185-N215 PolarHBondContact O-ND2 3.27Å; N185-N215 PolarHBondContact O-OD1 3.23Å
186	G	61.1	Low	58.4	Low	4 Å²	4	101.3 Å²	101.3	4%	0.041	52%	0.521	C	S	.	.	S	Bend	trans	67.5	-1.4	178.8	0	0	0	0	0	116.6
187	K	61.2	Low	55.7	Low	103 Å²	103	100.7 Å²	100.7	45%	0.448	53%	0.529	S	S	.	.			trans	-131.8	134.8	-172.8	-60.3	172.9	-173.8	177	0	110.4	N185 E213 N215	N185-K187 PolarHBondContact O-N 3.21Å; K187-E213 IonicContact NZ-OE2 3.73Å; K187-E213 PolarHBondContact NZ-OE2 3.33Å; K187-N215 VanDerWaalsContact CE-OD1 3.31Å; K187-N215 WeakPolarHBondContact CE-OD1 3.32Å
188	F	53.1	Low	53.4	Low	142 Å²	142	106.8 Å²	106.8	62%	0.623	55%	0.553	S	S	*	*			trans	-86.1	133	165.3	-103.9	-86.9	0	0	0	110.1	F54 W184	F54-F188 HydrophobicContact CB-CE2 4.41Å; F54-F188 AromaticContact CD2-CD2 3.99Å; F54-F188 HydrophobicContact CD2-CD2 3.99Å; F54-F188 AromaticContact CD2-CE2 3.92Å; F54-F188 HydrophobicContact CD2-CE2 3.92Å; F54-F188 HydrophobicContact CE2-CD2 4.38Å; F54-F188 HydrophobicContact CG-CD2 4.15Å; F54-F188 HydrophobicContact CG-CE2 4.27Å; W184-F188 AromaticContact CH2-CD2 3.92Å; W184-F188 HydrophobicContact CH2-CD2 3.92Å; W184-F188 HydrophobicContact CH2-CE2 4.14Å
189	S	36.7	Very low	50.7	Low	95 Å²	95	108.1 Å²	108.1	66%	0.664	56%	0.562	S	S	*	*			trans	-77.9	121.6	167.3	47.1	0	0	0	0	110	D191	S189-D191 PolarHBondContact O-N 3.17Å
190	C	28.3	Very low	48	Very low	122 Å²	122	109.2 Å²	109.2	82%	0.824	59%	0.586	S	S	*	*			trans	-97	75.3	-175.5	-163	0	0	0	0	111.3	H192	C190-H192 VanDerWaalsContact C-N 3.34Å; C190-H192 PolarHBondContact O-N 3.26Å
191	D	24.8	Very low	45.3	Very low	142 Å²	142	115.2 Å²	115.2	76%	0.759	62%	0.624	S	S	*	*			trans	-80.8	70.4	-179	-74.1	-34.7	0	0	0	112.7	S189	S189-D191 PolarHBondContact O-N 3.17Å
192	H	28.3	Very low	42.4	Very low	181 Å²	181	121.3 Å²	121.3	84%	0.838	66%	0.658	S	S	*	*			trans	-148	78.1	166.7	-87.8	-36.5	0	0	0	114	C190	C190-H192 VanDerWaalsContact C-N 3.34Å; C190-H192 PolarHBondContact O-N 3.26Å
193	T	29.4	Very low	39.9	Very low	137 Å²	137	124 Å²	124	84%	0.84	68%	0.676	S	S	*	*			trans	-154.9	93.9	149.1	13.4	0	0	0	0	110.5	D195	T193-D195 PolarHBondContact O-N 3.37Å; T193-D195 VanDerWaalsContact O-N 3.12Å
194	E	28.4	Very low	37.3	Very low	194 Å²	194	127.8 Å²	127.8	91%	0.907	70%	0.703	S	S	*	*			trans	-74.8	92.5	165.3	-74.3	-158.8	123.6	0	0	109.9
195	D	29.8	Very low	35	Very low	149 Å²	149	129.6 Å²	129.6	80%	0.797	73%	0.732	S	S	*	*			trans	-123.1	79	166.8	-141.9	-24.3	0	0	0	111.1	T193 S197	T193-D195 PolarHBondContact O-N 3.37Å; T193-D195 VanDerWaalsContact O-N 3.12Å; D195-S197 PolarHBondContact O-N 3.14Å
196	R	28.3	Very low	33	Very low	240 Å²	240	133.9 Å²	133.9	91%	0.906	75%	0.746	S	S	*	*			trans	-85.4	63	-163	-171	-169.9	160.1	173.7	-4.2	113
197	S	30.1	Very low	31.4	Very low	84 Å²	84	142.2 Å²	142.2	59%	0.587	79%	0.788	S	S	*	*			trans	-161.2	96.5	159.9	57.9	0	0	0	0	116.8	D195	D195-S197 PolarHBondContact O-N 3.14Å
198	Q	35.6	Very low	29.7	Very low	179 Å²	179	145 Å²	145	84%	0.836	80%	0.8	S	S	*	*				174.6	109.2	118.2	-94.1	154.5	91.7	0	0	113.6	G200	Q198-G200 PolarHBondContact O-N 2.73Å
199	T	28.5	Very low	28.4	Very low	148 Å²	148	143.5 Å²	143.5	91%	0.908	80%	0.798	S	S	*	*			trans	18.4	92	144.6	53.3	0	0	0	0	118.5
200	G	28.9	Very low	27.9	Very low	73 Å²	73	147 Å²	147	75%	0.753	81%	0.81	S	S	*	*			trans	-138.3	119.2	165.4	0	0	0	0	0	110.7	Q198	Q198-G200 PolarHBondContact O-N 2.73Å
201	T	28.6	Very low	27.9	Very low	142 Å²	142	147.3 Å²	147.3	87%	0.871	81%	0.807	S	S	*	*			trans	-43.2	134.7	-168.2	-54.1	0	0	0	0	116.7
202	L	25.3	Very low	28.6	Very low	166 Å²	166	147 Å²	147	87%	0.869	81%	0.81	S	S	*	*			trans	-62.4	129.5	173.7	-66.1	163.3	0	0	0	113.1
203	T	28.2	Very low	29.6	Very low	133 Å²	133	144.2 Å²	144.2	82%	0.816	80%	0.798	S	S	*	*			trans	-138	105.4	152.7	52.7	0	0	0	0	110.6	G205	T203-G205 PolarHBondContact O-N 2.88Å; T203-G205 VanDerWaalsContact O-N 3.1Å
204	S	24.8	Very low	30.9	Very low	114 Å²	114	141.4 Å²	141.4	80%	0.797	78%	0.783	S	S	*	*			trans	-71.9	98.7	168.7	-177.5	0	0	0	0	109	F206	S204-F206 PolarHBondContact O-N 3.41Å
205	G	25.9	Very low	32.8	Very low	71 Å²	71	133.3 Å²	133.3	73%	0.732	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-72	117.3	-178.5	0	0	0	0	0	112	T203	T203-G205 PolarHBondContact O-N 2.88Å; T203-G205 VanDerWaalsContact O-N 3.1Å
206	F	26.7	Very low	35.1	Very low	193 Å²	193	127.7 Å²	127.7	85%	0.846	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-66.2	146.2	176.6	-84	-108.6	0	0	0	111.9	S204 K208	S204-F206 PolarHBondContact O-N 3.41Å; F206-K208 PolarHBondContact O-N 2.91Å; F206-K208 VanDerWaalsContact O-N 3.15Å
207	I	28.6	Very low	37.5	Very low	179 Å²	179	116.4 Å²	116.4	92%	0.918	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-58.4	116.2	166.8	-62.2	171.3	0	0	0	108.7
208	K	24.4	Very low	39.5	Very low	161 Å²	161	117.8 Å²	117.8	70%	0.7	67%	0.674	S	S	*	*			trans	-155.2	147	170.6	-140.1	-174.3	162.5	-108	0	111.8	F206	F206-K208 PolarHBondContact O-N 2.91Å; F206-K208 VanDerWaalsContact O-N 3.15Å
209	D	26.1	Very low	41.4	Very low	111 Å²	111	111.6 Å²	111.6	59%	0.594	65%	0.649	S	S	*	*	S	Bend	trans	65.2	70.8	161.2	-53	-34.4	0	0	0	118.1	V211	D209-V211 PolarHBondContact O-N 2.75Å; D209-V211 VanDerWaalsContact O-N 3.12Å
210	N	26.3	Very low	43.4	Very low	169 Å²	169	110.3 Å²	110.3	90%	0.904	64%	0.641	S	S	*	*			trans	33.9	63.4	137.3	-70.6	-4	0	0	0	119.3
211	V	28	Very low	45.4	Very low	128 Å²	128	108.9 Å²	108.9	78%	0.776	63%	0.626	S	S	*	*			trans	-127.3	108.8	155.2	-176.5	0	0	0	0	108.7	D209 E213	D209-V211 PolarHBondContact O-N 2.75Å; D209-V211 VanDerWaalsContact O-N 3.12Å; V211-E213 PolarHBondContact O-N 3.28Å
212	V	40.6	Very low	47.9	Very low	136 Å²	136	102.6 Å²	102.6	82%	0.824	59%	0.587	S	S	*	*			trans	-76.7	110.1	168.5	178.6	0	0	0	0	107	S214	V212-S214 PolarHBondContact O-N 2.91Å; V212-S214 VanDerWaalsContact O-N 3.11Å
213	E	48.7	Very low	50.7	Low	122 Å²	122	94.7 Å²	94.7	57%	0.57	55%	0.545	S	S	*	.			trans	-61.7	113.7	168	-70.2	-167.4	160.2	0	0	109	K187 V211 N215	K187-E213 IonicContact NZ-OE2 3.73Å; K187-E213 PolarHBondContact NZ-OE2 3.33Å; V211-E213 PolarHBondContact O-N 3.28Å; E213-N215 PolarHBondContact O-N 2.78Å; E213-N215 PolarHBondContact O-ND2 3.03Å
214	S	57.3	Low	53.4	Low	77 Å²	77	90.2 Å²	90.2	54%	0.538	52%	0.515	S	S	.	.			trans	-60.1	125	170.3	-55.7	0	0	0	0	109.1	V212 V219	V212-S214 PolarHBondContact O-N 2.91Å; V212-S214 VanDerWaalsContact O-N 3.11Å; S214-V219 WeakPolarHBondContact O-CG2 3.36Å
215	N	68.2	Low	56.4	Low	25 Å²	25	84.9 Å²	84.9	13%	0.134	48%	0.477	C	S	.	.			trans	-105.9	32.5	179.9	-67.2	-59.6	0	0	0	111.8	Q48 N185 K187 E213 I222	Q48-N215 WeakPolarHBondContact CB-O 3.22Å; N185-N215 PolarHBondContact O-ND2 3.27Å; N185-N215 PolarHBondContact O-OD1 3.23Å; K187-N215 VanDerWaalsContact CE-OD1 3.31Å; K187-N215 WeakPolarHBondContact CE-OD1 3.32Å; E213-N215 PolarHBondContact O-N 2.78Å; E213-N215 PolarHBondContact O-ND2 3.03Å; N215-I222 HydrophobicContact CB-CD1 4.27Å; N215-I222 WeakPolarHBondContact O-CD1 3.45Å
216	N	78	Confident	59.3	Low	31 Å²	31	81.5 Å²	81.5	17%	0.166	44%	0.443	C	S	.	.	S	Bend	trans	-85.6	157.9	-167.5	-45.6	2.3	0	0	0	109.8	S45 L47 L218 V219	S45-N216 PolarHBondContact O-ND2 2.83Å; L47-N216 CarbonylContact O-C 3.6Å; L47-N216 WeakPolarHBondContact O-CA 3.27Å; N216-L218 PolarHBondContact O-N 3.22Å; N216-V219 WeakPolarHBondContact O-CB 3.46Å; N216-V219 WeakPolarHBondContact O-CG2 3.46Å; N216-V219 PolarHBondContact O-N 2.81Å
217	L	78.4	Confident	62	Low	3 Å²	3	72.3 Å²	72.3	2%	0.016	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-11	-174.4	-61.3	-175.1	0	0	0	115.2	V7 L21 L44 L47 L49 V219 I222 L223	V7-L217 HydrophobicContact CG1-CD1 4.25Å; L21-L217 HydrophobicContact CD2-CD1 4.14Å; L44-L217 HydrophobicContact CD2-CB 3.88Å; L44-L217 HydrophobicContact CD2-CD1 4.34Å; L44-L217 PolarHBondContact O-N 3.5Å; L47-L217 HydrophobicContact CB-CD1 3.64Å; L47-L217 HydrophobicContact CB-CG 3.86Å; L47-L217 HydrophobicContact CD1-CD1 4.06Å; L47-L217 PolarHBondContact O-N 2.8Å; L49-L217 HydrophobicContact CD2-CD2 3.73Å; L49-L217 HydrophobicContact CG-CD2 3.71Å; L217-V219 VanDerWaalsContact C-N 3.3Å; L217-I222 HydrophobicContact CD2-CG2 4.32Å; L217-L223 HydrophobicContact CD2-CB 4.48Å
218	L	73.4	Confident	64.7	Low	112 Å²	112	63.9 Å²	63.9	59%	0.586	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-17.8	170.6	-68.7	175.9	0	0	0	114.1	L44 N216	L44-L218 HydrophobicContact CB-CD2 3.54Å; L44-L218 HydrophobicContact CB-CG 3.73Å; L44-L218 HydrophobicContact CD1-CD2 3.93Å; L44-L218 HydrophobicContact CG-CD2 4.36Å; N216-L218 PolarHBondContact O-N 3.22Å
219	V	74.1	Confident	67.4	Low	50 Å²	50	56.2 Å²	56.2	30%	0.303	33%	0.326	S	S	.	.	S	Bend	trans	-76.5	129	-175.8	178.7	0	0	0	0	110.8	S214 N216 L217 G221 I222	S214-V219 WeakPolarHBondContact O-CG2 3.36Å; N216-V219 WeakPolarHBondContact O-CB 3.46Å; N216-V219 WeakPolarHBondContact O-CG2 3.46Å; N216-V219 PolarHBondContact O-N 2.81Å; L217-V219 VanDerWaalsContact C-N 3.3Å; V219-G221 PolarHBondContact O-N 3.23Å; V219-I222 HydrophobicContact CB-CD1 3.76Å; V219-I222 HydrophobicContact CB-CG1 3.99Å; V219-I222 HydrophobicContact CG1-CD1 4.05Å; V219-I222 HydrophobicContact CG1-CG1 4.09Å; V219-I222 HydrophobicContact CG2-CD1 4.34Å; V219-I222 PolarHBondContact O-N 2.73Å
220	T	71	Confident	70.1	Confident	121 Å²	121	51 Å²	51	74%	0.742	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	126.5	176.5	49.6	0	0	0	0	110.9	T327	T220-T327 VanDerWaalsContact CA-OG1 3.3Å; T220-T327 WeakPolarHBondContact CA-OG1 3.35Å
221	G	71.5	Confident	72.8	Confident	42 Å²	42	42.9 Å²	42.9	43%	0.433	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	-1.8	-178.1	0	0	0	0	0	115.9	V219 H224 T327	V219-G221 PolarHBondContact O-N 3.23Å; G221-H224 PolarHBondContact O-NE2 3.46Å; G221-T327 PolarHBondContact N-OG1 3.03Å
222	I	80.4	Confident	75.3	Confident	11 Å²	11	38.3 Å²	38.3	6%	0.056	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-59.1	171.2	-62.3	-169	0	0	0	110.7	L49 N215 L217 V219	L49-I222 HydrophobicContact CD1-CG2 3.67Å; L49-I222 WeakPolarHBondContact CD1-O 3.44Å; L49-I222 HydrophobicContact CG-CG2 3.88Å; N215-I222 HydrophobicContact CB-CD1 4.27Å; N215-I222 WeakPolarHBondContact O-CD1 3.45Å; L217-I222 HydrophobicContact CD2-CG2 4.32Å; V219-I222 HydrophobicContact CB-CD1 3.76Å; V219-I222 HydrophobicContact CB-CG1 3.99Å; V219-I222 HydrophobicContact CG1-CD1 4.05Å; V219-I222 HydrophobicContact CG1-CG1 4.09Å; V219-I222 HydrophobicContact CG2-CD1 4.34Å; V219-I222 PolarHBondContact O-N 2.73Å
223	L	84.4	Confident	77.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-97.5	124.9	174.4	-172.5	68.8	0	0	0	109.4	I5 I24 L49 L217 A325 G326 T327 W356	I5-L223 HydrophobicContact CD1-CD1 3.96Å; I24-L223 HydrophobicContact CD1-CD2 4.17Å; L49-L223 HydrophobicContact CD2-CD1 4.44Å; L217-L223 HydrophobicContact CD2-CB 4.48Å; L223-A325 HydrophobicContact CD2-CB 4.38Å; L223-G326 CarbonylContact O-C 3.6Å; L223-G326 VanDerWaalsContact O-CA 3.22Å; L223-G326 WeakPolarHBondContact O-CA 3.28Å; L223-T327 PolarHBondContact O-N 2.69Å; L223-W356 HydrophobicContact CD1-CB 4.25Å
224	H	85.5	Confident	78.9	Confident	38 Å²	38	28.8 Å²	28.8	18%	0.176	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	142.2	175	-65.1	-79.2	0	0	0	110.9	G221 T327 W356 S357 S360 I363	G221-H224 PolarHBondContact O-NE2 3.46Å; H224-T327 WeakPolarHBondContact CA-O 3.29Å; H224-W356 VanDerWaalsContact O-CA 3.27Å; H224-W356 WeakPolarHBondContact O-CA 3.19Å; H224-S357 PolarHBondContact N-O 2.98Å; H224-S357 PolarHBondContact O-N 3.49Å; H224-S360 WeakPolarHBondContact NE2-CB 3.41Å; H224-I363 HydrophobicContact CB-CB 4.36Å; H224-I363 HydrophobicContact CB-CG1 3.7Å
225	R	86.9	Confident	80.3	Confident	3 Å²	3	28.8 Å²	28.8	1%	0.011	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.7	178.8	174.6	170.8	50.9	107.4	-6.2	110.7	S227 N320 I324 A325 T327 L328 S329 I355	R225-S227 PolarHBondContact NH1-OG 3.41Å; R225-N320 PolarHBondContact NH2-OD1 3.45Å; R225-I324 PolarHBondContact NH2-O 3.11Å; R225-I324 VanDerWaalsContact NH2-O 3.14Å; R225-A325 WeakPolarHBondContact CD-O 3.2Å; R225-A325 PolarHBondContact NE-O 3.41Å; R225-T327 PolarHBondContact N-O 2.85Å; R225-L328 CarbonylContact O-C 3.55Å; R225-L328 WeakPolarHBondContact O-CA 3.45Å; R225-S329 PolarHBondContact O-N 3.32Å; R225-I355 CarbonylContact C-O 3.6Å; R225-I355 WeakPolarHBondContact CA-O 3.25Å
226	H	86.8	Confident	81	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	150.7	161.5	-178.4	57	0	0	0	108.9	S329 I355 I363 T367 E370	H226-S329 PolarHBondContact ND1-OG 3.3Å; H226-I355 PolarHBondContact N-O 2.97Å; H226-I355 PolarHBondContact O-N 3.26Å; H226-I363 HydrophobicContact CB-CD1 4.3Å; H226-I363 HydrophobicContact CB-CG2 4.02Å; H226-T367 HydrophobicContact CB-CG2 4.5Å; H226-T367 VanDerWaalsContact CE1-CG2 3.47Å; H226-T367 WeakPolarHBondContact CE1-CG2 3.42Å; H226-E370 IonicContact CE1-OE2 3.24Å; H226-E370 IonicContact NE2-OE2 3.6Å; H226-E370 PolarHBondContact NE2-OE2 3.39Å
227	S	84.4	Confident	81.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	120.4	-169.1	-55.7	0	0	0	0	109.1	R225 I333 L353 H354	R225-S227 PolarHBondContact NH1-OG 3.41Å; S227-I333 WeakPolarHBondContact O-CA 3.49Å; S227-L353 WeakPolarHBondContact CA-O 3.27Å; S227-H354 WeakPolarHBondContact CB-ND1 3.38Å; S227-H354 PolarHBondContact OG-CE1 3.35Å; S227-H354 VanDerWaalsContact OG-CE1 3.32Å; S227-H354 PolarHBondContact OG-ND1 3.38Å
228	I	85	Confident	81.8	Confident	1 Å²	1	34 Å²	34	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.5	-168.5	-58.6	167.6	0	0	0	108.5	I230 L339 L353 I355 E370 I374	I228-I230 HydrophobicContact CG2-CG2 4.09Å; I228-L339 HydrophobicContact CG2-CD1 3.93Å; I228-L353 HydrophobicContact CB-CB 4.39Å; I228-L353 PolarHBondContact N-O 3.47Å; I228-L353 PolarHBondContact O-N 3.29Å; I228-I355 HydrophobicContact CD1-CD1 3.76Å; I228-E370 HydrophobicContact CD1-CB 3.71Å; I228-E370 HydrophobicContact CG1-CB 4.27Å; I228-I374 HydrophobicContact CG2-CD1 3.53Å; I228-I374 HydrophobicContact CG2-CG1 4.24Å
229	C	81.1	Confident	82.4	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.007	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	124	172.1	-69	0	0	0	0	110.6	P336 L350	C229-P336 HydrophobicContact CB-CB 4.29Å; C229-L350 HydrophobicContact CB-CD1 4.31Å
230	I	83.1	Confident	83	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	150.7	173.5	70.6	172.6	0	0	0	111.4	I228 L234 A238 L350 V351 L353 I374	I228-I230 HydrophobicContact CG2-CG2 4.09Å; I230-L234 HydrophobicContact CD1-CB 4.33Å; I230-A238 HydrophobicContact CD1-CB 3.53Å; I230-L350 CarbonylContact O-C 3.58Å; I230-L350 WeakPolarHBondContact O-CA 3.49Å; I230-V351 HydrophobicContact CD1-CG2 4.13Å; I230-V351 HydrophobicContact CG1-CG2 3.54Å; I230-V351 PolarHBondContact N-O 2.95Å; I230-V351 PolarHBondContact O-N 2.71Å; I230-L353 HydrophobicContact CD1-CB 4.31Å; I230-L353 HydrophobicContact CG2-CB 4.31Å; I230-I374 HydrophobicContact CG2-CD1 4.2Å; I230-I374 HydrophobicContact CG2-CG1 3.97Å
231	P	81.6	Confident	83.6	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	137.7	176.2	-21.7	34.4	0	0	0	111.8	Y233 L234 L340 L350	P231-Y233 HydrophobicContact CB-CD1 3.5Å; P231-Y233 VanDerWaalsContact CB-CD1 3.5Å; P231-Y233 HydrophobicContact CB-CE1 3.31Å; P231-Y233 HydrophobicContact CG-CD1 4.49Å; P231-Y233 HydrophobicContact CG-CE1 3.84Å; P231-Y233 PolarHBondContact O-N 3.45Å; P231-L234 WeakPolarHBondContact O-CB 3.21Å; P231-L234 PolarHBondContact O-N 3.36Å; P231-L340 HydrophobicContact CG-CD1 4.16Å; P231-L340 HydrophobicContact CG-CD2 3.97Å; P231-L350 HydrophobicContact CB-CD2 4.46Å; P231-L350 HydrophobicContact CG-CD2 4.49Å
232	A	81.1	Confident	84.3	Confident	32 Å²	32	33 Å²	33	26%	0.264	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-58.8	-24.4	-176	0	0	0	0	0	114.2	L234 Y235 P349 V351	A232-L234 PolarHBondContact O-N 3.14Å; A232-Y235 WeakPolarHBondContact O-CB 3.48Å; A232-Y235 PolarHBondContact O-N 3.05Å; A232-P349 HydrophobicContact CB-CB 4.47Å; A232-P349 HydrophobicContact CB-CG 3.92Å; A232-P349 VanDerWaalsContact CB-O 3.28Å; A232-P349 WeakPolarHBondContact CB-O 3.38Å; A232-P349 PolarHBondContact N-O 2.93Å; A232-V351 HydrophobicContact CB-CG1 4.09Å
233	Y	79.6	Confident	84.6	Confident	58 Å²	58	32.9 Å²	32.9	23%	0.227	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-65.1	-23.4	175	77.7	-97.4	0	0	0	112.8	P231 Y235 P344 F381	P231-Y233 HydrophobicContact CB-CD1 3.5Å; P231-Y233 VanDerWaalsContact CB-CD1 3.5Å; P231-Y233 HydrophobicContact CB-CE1 3.31Å; P231-Y233 HydrophobicContact CG-CD1 4.49Å; P231-Y233 HydrophobicContact CG-CE1 3.84Å; P231-Y233 PolarHBondContact O-N 3.45Å; Y233-Y235 VanDerWaalsContact C-N 3.33Å; Y233-P344 WeakPolarHBondContact CE1-O 3.41Å; Y233-P344 PolarHBondContact OH-O 3.36Å; Y233-P344 VanDerWaalsContact OH-O 3.11Å; Y233-F381 AromaticContact CD2-CD1 3.74Å; Y233-F381 HydrophobicContact CD2-CD1 3.74Å; Y233-F381 HydrophobicContact CD2-CD2 4.29Å; Y233-F381 AromaticContact CD2-CE1 3.52Å; Y233-F381 HydrophobicContact CD2-CE1 3.52Å; Y233-F381 HydrophobicContact CD2-CE2 4.09Å; Y233-F381 HydrophobicContact CD2-CG 4.13Å; Y233-F381 AromaticContact CD2-CZ 3.71Å; Y233-F381 HydrophobicContact CD2-CZ 3.71Å; Y233-F381 AromaticContact CE2-CD1 3.71Å; Y233-F381 HydrophobicContact CE2-CD1 3.71Å; Y233-F381 AromaticContact CE2-CE1 3.9Å; Y233-F381 HydrophobicContact CE2-CE1 3.9Å; Y233-F381 HydrophobicContact CE2-CG 4.16Å; Y233-F381 VanDerWaalsContact O-CE2 3.25Å; Y233-F381 WeakPolarHBondContact O-CE2 3.5Å
234	L	85.5	Confident	84.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-79.2	-12.4	172.4	-62.9	-175.8	0	0	0	113.2	I230 P231 A232 R236 L237 A238 I374 L377 F381	I230-L234 HydrophobicContact CD1-CB 4.33Å; P231-L234 WeakPolarHBondContact O-CB 3.21Å; P231-L234 PolarHBondContact O-N 3.36Å; A232-L234 PolarHBondContact O-N 3.14Å; L234-R236 VanDerWaalsContact C-N 3.33Å; L234-R236 PolarHBondContact O-N 3.14Å; L234-L237 WeakPolarHBondContact O-CA 3.22Å; L234-L237 PolarHBondContact O-N 2.79Å; L234-A238 PolarHBondContact O-N 2.92Å; L234-I374 HydrophobicContact CD1-CG2 4.33Å; L234-L377 HydrophobicContact CD1-CB 4.19Å; L234-F381 HydrophobicContact CD2-CB 3.68Å; L234-F381 HydrophobicContact CD2-CD2 4.33Å; L234-F381 HydrophobicContact CD2-CG 3.96Å
235	Y	86	Confident	85	Confident	77 Å²	77	33.6 Å²	33.6	30%	0.302	18%	0.175	S	C	.	.	H	α-helix	trans	-52.3	-47.3	-176.7	172.4	-103.1	0	0	0	112.5	A232 Y233 L237 A238 A239 C259 D260 S261	A232-Y235 WeakPolarHBondContact O-CB 3.48Å; A232-Y235 PolarHBondContact O-N 3.05Å; Y233-Y235 VanDerWaalsContact C-N 3.33Å; Y235-L237 PolarHBondContact O-N 2.9Å; Y235-L237 VanDerWaalsContact O-N 3.07Å; Y235-A238 PolarHBondContact O-N 3.22Å; Y235-A238 VanDerWaalsContact O-N 3.13Å; Y235-A239 HydrophobicContact CE2-CB 4.18Å; Y235-A239 VanDerWaalsContact O-CB 3.3Å; Y235-A239 WeakPolarHBondContact O-CB 3.39Å; Y235-A239 PolarHBondContact O-N 3.13Å; Y235-C259 HydrophobicContact CD2-CB 4.34Å; Y235-C259 HydrophobicContact CE2-CB 4.41Å; Y235-D260 WeakPolarHBondContact CD2-O 3.48Å; Y235-D260 WeakPolarHBondContact CE2-O 3.37Å; Y235-S261 WeakPolarHBondContact OH-CB 3.32Å
236	R	83.8	Confident	85	Confident	151 Å²	151	36.8 Å²	36.8	57%	0.57	20%	0.195	S	C	*	.	H	α-helix	trans	-59.3	-25	179.8	-60.9	-168.5	-166	-163.3	7.7	113.1	L234 G393 D394	L234-R236 VanDerWaalsContact C-N 3.33Å; L234-R236 PolarHBondContact O-N 3.14Å; R236-G393 PolarHBondContact NH1-O 3.06Å; R236-G393 PolarHBondContact NH2-O 3.38Å; R236-D394 IonicContact NH2-OD1 2.73Å; R236-D394 PolarHBondContact NH2-OD1 2.94Å
237	L	86	Confident	85.1	Confident	16 Å²	16	37 Å²	37	8%	0.084	20%	0.196	C	C	.	.	H	α-helix	trans	-91.9	-37.2	176.1	-174.6	66	0	0	0	112.4	L234 Y235 N240 S243 L377 R380 F381 L384	L234-L237 WeakPolarHBondContact O-CA 3.22Å; L234-L237 PolarHBondContact O-N 2.79Å; Y235-L237 PolarHBondContact O-N 2.9Å; Y235-L237 VanDerWaalsContact O-N 3.07Å; L237-N240 PolarHBondContact O-N 3.33Å; L237-S243 VanDerWaalsContact O-CB 3.23Å; L237-S243 WeakPolarHBondContact O-CB 3.27Å; L237-S243 PolarHBondContact O-OG 3Å; L237-L377 HydrophobicContact CD2-CB 4.34Å; L237-L377 HydrophobicContact CD2-CD2 3.91Å; L237-L377 VanDerWaalsContact CD2-O 3.23Å; L237-L377 WeakPolarHBondContact CD2-O 3.43Å; L237-L377 HydrophobicContact CG-CD2 4.02Å; L237-R380 HydrophobicContact CD1-CG 4.23Å; L237-R380 HydrophobicContact CD2-CB 3.97Å; L237-R380 HydrophobicContact CD2-CG 3.97Å; L237-F381 HydrophobicContact CD2-CB 4.12Å; L237-L384 HydrophobicContact CD1-CD1 3.91Å
238	A	86.8	Confident	85.2	Confident	2 Å²	2	37 Å²	37	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-79.2	-14.1	179.2	0	0	0	0	0	114.1	I230 L234 Y235 N240 H244 C259 L377	I230-A238 HydrophobicContact CD1-CB 3.53Å; L234-A238 PolarHBondContact O-N 2.92Å; Y235-A238 PolarHBondContact O-N 3.22Å; Y235-A238 VanDerWaalsContact O-N 3.13Å; A238-N240 VanDerWaalsContact C-N 3.33Å; A238-H244 PolarHBondContact O-NE2 3.11Å; A238-C259 HydrophobicContact CB-CB 4.22Å; A238-L377 HydrophobicContact CB-CD1 4.49Å
239	A	86.6	Confident	85.3	Confident	50 Å²	50	43.4 Å²	43.4	41%	0.413	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.3	170.5	0	0	0	0	0	112.9	Y235 P241	Y235-A239 HydrophobicContact CE2-CB 4.18Å; Y235-A239 VanDerWaalsContact O-CB 3.3Å; Y235-A239 WeakPolarHBondContact O-CB 3.39Å; Y235-A239 PolarHBondContact O-N 3.13Å; A239-P241 WeakPolarHBondContact O-CD 3.48Å
240	N	86	Confident	85.6	Confident	58 Å²	58	49.8 Å²	49.8	31%	0.31	25%	0.252	S	S	.	.	S	Bend	trans	-84.4	118.2	173.6	-179.9	-5.4	0	0	0	110	L237 A238 E242 S243	L237-N240 PolarHBondContact O-N 3.33Å; A238-N240 VanDerWaalsContact C-N 3.33Å; N240-E242 PolarHBondContact ND2-OE2 3.37Å; N240-E242 VanDerWaalsContact ND2-OE2 3.13Å; N240-E242 PolarHBondContact O-N 3.27Å; N240-E242 WeakPolarHBondContact OD1-CB 3.44Å; N240-E242 WeakPolarHBondContact OD1-CG 3.27Å; N240-E242 PolarHBondContact OD1-N 3.39Å; N240-S243 VanDerWaalsContact O-CB 3.27Å; N240-S243 WeakPolarHBondContact O-CB 3.3Å; N240-S243 PolarHBondContact O-N 3.24Å; N240-S243 VanDerWaalsContact O-N 3.09Å; N240-S243 PolarHBondContact O-OG 3.01Å
241	P	84.3	Confident	85.8	Confident	70 Å²	70	49.9 Å²	49.9	46%	0.455	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-58.3	-30.4	178.4	23.9	-34.7	0	0	0	113.7	L3 A239 S243 H244	L3-P241 HydrophobicContact CD1-CB 3.78Å; L3-P241 WeakPolarHBondContact CD1-O 3.21Å; L3-P241 HydrophobicContact CG-CB 4.33Å; A239-P241 WeakPolarHBondContact O-CD 3.48Å; P241-S243 PolarHBondContact O-N 3.05Å; P241-S243 VanDerWaalsContact O-N 3.17Å; P241-H244 PolarHBondContact O-N 3.4Å
242	E	85.3	Confident	85.9	Confident	124 Å²	124	51.2 Å²	51.2	58%	0.579	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-59.5	-29.9	178.1	-61.6	179.4	143.9	0	0	112.8	N240 H244 S245	N240-E242 PolarHBondContact ND2-OE2 3.37Å; N240-E242 VanDerWaalsContact ND2-OE2 3.13Å; N240-E242 PolarHBondContact O-N 3.27Å; N240-E242 WeakPolarHBondContact OD1-CB 3.44Å; N240-E242 WeakPolarHBondContact OD1-CG 3.27Å; N240-E242 PolarHBondContact OD1-N 3.39Å; E242-H244 PolarHBondContact O-N 3.28Å; E242-H244 VanDerWaalsContact O-N 3.14Å; E242-S245 WeakPolarHBondContact O-CB 3.3Å; E242-S245 PolarHBondContact O-N 3.02Å; E242-S245 PolarHBondContact O-OG 3.08Å
243	S	87.4	Confident	86.1	Confident	9 Å²	9	49.8 Å²	49.8	6%	0.063	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-63.1	-15.2	176.2	-62.3	0	0	0	0	113.5	L237 N240 P241 H373	L237-S243 VanDerWaalsContact O-CB 3.23Å; L237-S243 WeakPolarHBondContact O-CB 3.27Å; L237-S243 PolarHBondContact O-OG 3Å; N240-S243 VanDerWaalsContact O-CB 3.27Å; N240-S243 WeakPolarHBondContact O-CB 3.3Å; N240-S243 PolarHBondContact O-N 3.24Å; N240-S243 VanDerWaalsContact O-N 3.09Å; N240-S243 PolarHBondContact O-OG 3.01Å; P241-S243 PolarHBondContact O-N 3.05Å; P241-S243 VanDerWaalsContact O-N 3.17Å; S243-H373 PolarHBondContact O-CE1 2.89Å
244	H	89.7	Confident	86.5	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-114.5	3.1	-178.4	-47.6	-36.5	0	0	0	113.8	L3 A238 P241 E242 T246 L247 A248 I257 H373	L3-H244 HydrophobicContact CD1-CB 3.93Å; A238-H244 PolarHBondContact O-NE2 3.11Å; P241-H244 PolarHBondContact O-N 3.4Å; E242-H244 PolarHBondContact O-N 3.28Å; E242-H244 VanDerWaalsContact O-N 3.14Å; H244-T246 VanDerWaalsContact C-N 3.3Å; H244-T246 PolarHBondContact O-N 3.03Å; H244-L247 PolarHBondContact O-N 3.28Å; H244-L247 VanDerWaalsContact O-N 3.08Å; H244-A248 PolarHBondContact O-N 2.88Å; H244-I257 HydrophobicContact CB-CB 4.42Å; H244-I257 HydrophobicContact CB-CD1 3.7Å; H244-I257 HydrophobicContact CB-CG2 4.27Å; H244-I257 WeakPolarHBondContact CD2-CG2 3.34Å; H244-H373 AromaticContact CE1-NE2 3.61Å; H244-H373 AromaticContact CG-NE2 3.82Å; H244-H373 AromaticContact ND1-CE1 3.27Å; H244-H373 PolarHBondContact ND1-CE1 3.47Å; H244-H373 VanDerWaalsContact ND1-CE1 3.27Å; H244-H373 AromaticContact ND1-NE2 2.98Å; H244-H373 PolarHBondContact ND1-NE2 2.88Å
245	S	86.9	Confident	86.7	Confident	53 Å²	53	47.7 Å²	47.7	37%	0.371	25%	0.248	S	C	.	.	H	α-helix	trans	-53	-42.5	178.2	55.5	0	0	0	0	113.4	E242 K249	E242-S245 WeakPolarHBondContact O-CB 3.3Å; E242-S245 PolarHBondContact O-N 3.02Å; E242-S245 PolarHBondContact O-OG 3.08Å; S245-K249 WeakPolarHBondContact O-CG 3.35Å; S245-K249 PolarHBondContact O-N 2.87Å; S245-K249 VanDerWaalsContact O-N 3.11Å
246	T	87.2	Confident	86.9	Confident	70 Å²	70	44.2 Å²	44.2	43%	0.429	24%	0.235	S	C	.	.	H	α-helix	trans	-62.2	-45.3	175.4	-55.3	0	0	0	0	112.4	H244 K249 F250	H244-T246 VanDerWaalsContact C-N 3.3Å; H244-T246 PolarHBondContact O-N 3.03Å; T246-K249 PolarHBondContact O-N 2.73Å; T246-F250 HydrophobicContact CG2-CD2 3.96Å; T246-F250 HydrophobicContact CG2-CE2 3.65Å; T246-F250 WeakPolarHBondContact O-CD2 3.41Å; T246-F250 PolarHBondContact O-N 2.93Å
247	L	88.8	Confident	87.2	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-47.4	179.7	178.3	61.5	0	0	0	110.9	H244 K249 F250 C251 I257 I355 L369 H373	H244-L247 PolarHBondContact O-N 3.28Å; H244-L247 VanDerWaalsContact O-N 3.08Å; L247-K249 VanDerWaalsContact C-N 3.31Å; L247-K249 PolarHBondContact O-N 2.87Å; L247-F250 PolarHBondContact O-N 2.93Å; L247-F250 VanDerWaalsContact O-N 3.13Å; L247-C251 PolarHBondContact O-N 2.68Å; L247-C251 PolarHBondContact O-SG 3.02Å; L247-I257 HydrophobicContact CD2-CD1 4.28Å; L247-I355 HydrophobicContact CD2-CD1 3.76Å; L247-L369 HydrophobicContact CD1-CB 3.6Å; L247-L369 HydrophobicContact CD1-CD1 4.03Å; L247-L369 HydrophobicContact CD1-CG 4.49Å; L247-H373 HydrophobicContact CD2-CB 4.35Å
248	A	87.9	Confident	87.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-34.6	179.4	0	0	0	0	0	113.2	M1 L3 H244 C251 C255 I257	M1-A248 HydrophobicContact CE-CB 4.37Å; M1-A248 HydrophobicContact SD-CB 4.49Å; L3-A248 HydrophobicContact CD2-CB 3.27Å; H244-A248 PolarHBondContact O-N 2.88Å; A248-C251 WeakPolarHBondContact O-CB 3.29Å; A248-C251 PolarHBondContact O-N 3.06Å; A248-C255 HydrophobicContact CB-CB 4.37Å; A248-I257 HydrophobicContact CB-CD1 4.37Å
249	K	87.3	Confident	87.3	Confident	135 Å²	135	39.6 Å²	39.6	59%	0.587	22%	0.22	S	C	*	.	H	α-helix	trans	-60.1	-48.4	170.7	-77.6	-174.5	174	-162.9	0	111.5	M1 S245 T246 L247 C251 G252	M1-K249 HydrophobicContact SD-CG 3.95Å; S245-K249 WeakPolarHBondContact O-CG 3.35Å; S245-K249 PolarHBondContact O-N 2.87Å; S245-K249 VanDerWaalsContact O-N 3.11Å; T246-K249 PolarHBondContact O-N 2.73Å; L247-K249 VanDerWaalsContact C-N 3.31Å; L247-K249 PolarHBondContact O-N 2.87Å; K249-C251 VanDerWaalsContact C-N 3.29Å; K249-C251 PolarHBondContact O-N 2.83Å; K249-G252 PolarHBondContact O-N 3.33Å; K249-G252 VanDerWaalsContact O-N 3.17Å
250	F	87.1	Confident	87.1	Confident	136 Å²	136	39.8 Å²	39.8	60%	0.596	21%	0.214	S	C	*	.	H	α-helix	trans	-67.3	-26	178.9	-74.8	-62.2	0	0	0	114.1	T246 L247 G252 L369	T246-F250 HydrophobicContact CG2-CD2 3.96Å; T246-F250 HydrophobicContact CG2-CE2 3.65Å; T246-F250 WeakPolarHBondContact O-CD2 3.41Å; T246-F250 PolarHBondContact O-N 2.93Å; L247-F250 PolarHBondContact O-N 2.93Å; L247-F250 VanDerWaalsContact O-N 3.13Å; F250-G252 PolarHBondContact O-N 3.23Å; F250-L369 HydrophobicContact CB-CD1 3.47Å; F250-L369 VanDerWaalsContact CB-CD1 3.47Å; F250-L369 HydrophobicContact CG-CD1 4.22Å
251	C	87.1	Confident	86.5	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-62	-27.5	172.5	-68.6	0	0	0	0	113.1	L247 A248 K249 A253 C255 A362 R365	L247-C251 PolarHBondContact O-N 2.68Å; L247-C251 PolarHBondContact O-SG 3.02Å; A248-C251 WeakPolarHBondContact O-CB 3.29Å; A248-C251 PolarHBondContact O-N 3.06Å; K249-C251 VanDerWaalsContact C-N 3.29Å; K249-C251 PolarHBondContact O-N 2.83Å; C251-A253 PolarHBondContact O-N 2.83Å; C251-C255 VanDerWaalsContact CB-SG 3.54Å; C251-A362 HydrophobicContact CB-CB 4.06Å; C251-A362 WeakPolarHBondContact O-CA 3.49Å; C251-A362 WeakPolarHBondContact O-CB 3.31Å; C251-R365 WeakPolarHBondContact O-CD 3.49Å
252	G	84.3	Confident	85.9	Confident	29 Å²	29	44 Å²	44	30%	0.299	24%	0.235	S	C	.	.			trans	72.4	6.7	175.3	0	0	0	0	0	116	K249 F250	K249-G252 PolarHBondContact O-N 3.33Å; K249-G252 VanDerWaalsContact O-N 3.17Å; F250-G252 PolarHBondContact O-N 3.23Å
253	A	84.8	Confident	84.9	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.008	23%	0.228	C	C	.	.	S	Bend	trans	-142.1	163.1	174.4	0	0	0	0	0	110.3	F54 C251 C255 A362	F54-A253 VanDerWaalsContact O-CB 3.32Å; F54-A253 WeakPolarHBondContact O-CB 3.47Å; C251-A253 PolarHBondContact O-N 2.83Å; A253-C255 PolarHBondContact O-N 3.13Å; A253-C255 PolarHBondContact O-SG 3.37Å; A253-A362 HydrophobicContact CB-CB 3.71Å
254	P	87.5	Confident	83.9	Confident	15 Å²	15	43.3 Å²	43.3	10%	0.097	24%	0.236	C	C	.	.			trans	-52.2	127.2	170.1	-26.2	35.1	0	0	0	112	P6 S357	P6-P254 HydrophobicContact CG-CG 4.34Å; P254-S357 WeakPolarHBondContact O-CB 3.33Å; P254-S357 PolarHBondContact O-OG 3.46Å
255	C	89.3	Confident	82.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	131.4	-178.1	-66.6	0	0	0	0	109.9	L3 A248 C251 A253 W356	L3-C255 CarbonylContact C-O 3.53Å; L3-C255 VanDerWaalsContact C-O 3.27Å; L3-C255 VanDerWaalsContact CA-O 3.3Å; L3-C255 WeakPolarHBondContact CA-O 3.32Å; A248-C255 HydrophobicContact CB-CB 4.37Å; C251-C255 VanDerWaalsContact CB-SG 3.54Å; A253-C255 PolarHBondContact O-N 3.13Å; A253-C255 PolarHBondContact O-SG 3.37Å; C255-W356 VanDerWaalsContact CA-O 3.27Å; C255-W356 WeakPolarHBondContact CA-O 3.3Å
256	L	90.1	Very high	81.1	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.4	165.4	171.6	63.6	0	0	0	108	L3 I5 L21 V22 I24 I355 W356	L3-L256 VanDerWaalsContact O-CD1 3.31Å; L3-L256 WeakPolarHBondContact O-CD1 3.21Å; I5-L256 HydrophobicContact CD1-CB 3.9Å; I5-L256 HydrophobicContact CG1-CB 3.99Å; L21-L256 HydrophobicContact CG-CD2 4.2Å; V22-L256 VanDerWaalsContact O-CD1 3.29Å; V22-L256 WeakPolarHBondContact O-CD1 3.39Å; I24-L256 HydrophobicContact CD1-CD2 3.94Å; I24-L256 HydrophobicContact CG1-CD2 3.83Å; L256-I355 WeakPolarHBondContact O-CA 3.11Å; L256-W356 HydrophobicContact CB-CB 4.47Å; L256-W356 HydrophobicContact CB-CE3 4.4Å; L256-W356 HydrophobicContact CD2-CE3 4.07Å; L256-W356 HydrophobicContact CD2-CZ3 4.39Å; L256-W356 HydrophobicContact CG-CE3 3.97Å; L256-W356 HydrophobicContact CG-CZ3 4.36Å; L256-W356 PolarHBondContact N-O 3.46Å; L256-W356 PolarHBondContact O-N 3.34Å
257	I	90.8	Very high	79.6	Confident	11 Å²	11	42.8 Å²	42.8	6%	0.056	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.6	178.6	-51.5	177.2	0	0	0	108.6	L3 H244 L247 A248 L353 H354 I355	L3-I257 HydrophobicContact CD1-CB 4.18Å; L3-I257 HydrophobicContact CD1-CD1 4.38Å; L3-I257 HydrophobicContact CD1-CG1 4.43Å; H244-I257 HydrophobicContact CB-CB 4.42Å; H244-I257 HydrophobicContact CB-CD1 3.7Å; H244-I257 HydrophobicContact CB-CG2 4.27Å; H244-I257 WeakPolarHBondContact CD2-CG2 3.34Å; L247-I257 HydrophobicContact CD2-CD1 4.28Å; A248-I257 HydrophobicContact CB-CD1 4.37Å; I257-L353 HydrophobicContact CG2-CD1 3.78Å; I257-L353 HydrophobicContact CG2-CG 4.25Å; I257-H354 WeakPolarHBondContact CA-O 3.47Å; I257-I355 HydrophobicContact CD1-CG1 4.5Å; I257-I355 HydrophobicContact CG1-CG1 4.21Å; I257-I355 HydrophobicContact CG1-CG2 4.24Å; I257-I355 HydrophobicContact CG2-CG1 4.12Å
258	Q	88.5	Confident	77.9	Confident	48 Å²	48	47.2 Å²	47.2	22%	0.224	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.2	-175.9	-162.4	-177.8	-75.1	0	0	108.9	I24 H354 W356	I24-Q258 PolarHBondContact O-NE2 2.88Å; I24-Q258 PolarHBondContact O-OE1 3.1Å; Q258-H354 PolarHBondContact N-O 2.81Å; Q258-H354 PolarHBondContact O-N 2.94Å; Q258-W356 HydrophobicContact CB-CH2 4.17Å; Q258-W356 HydrophobicContact CB-CZ3 3.66Å
259	C	86	Confident	76.5	Confident	13 Å²	13	52.3 Å²	52.3	9%	0.088	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.8	171.5	-165.7	0	0	0	0	109.4	Y235 A238 L353	Y235-C259 HydrophobicContact CD2-CB 4.34Å; Y235-C259 HydrophobicContact CE2-CB 4.41Å; A238-C259 HydrophobicContact CB-CB 4.22Å; C259-L353 HydrophobicContact CB-CD1 3.92Å
260	D	81.8	Confident	75.1	Confident	53 Å²	53	45.9 Å²	45.9	28%	0.283	26%	0.256	S	S	.	.			trans	-71.9	142.8	173.6	-81.2	10.5	0	0	0	110.2	Y235 L352 H354	Y235-D260 WeakPolarHBondContact CD2-O 3.48Å; Y235-D260 WeakPolarHBondContact CE2-O 3.37Å; D260-L352 PolarHBondContact N-O 3.47Å; D260-H354 IonicContact OD1-CD2 2.92Å; D260-H354 IonicContact OD2-NE2 2.83Å
261	S	74	Confident	73.7	Confident	76 Å²	76	45.2 Å²	45.2	53%	0.531	25%	0.253	S	S	.	.	S	Bend	trans	-83	-22.2	-179.6	59.4	0	0	0	0	113.8	Y235	Y235-S261 WeakPolarHBondContact OH-CB 3.32Å
262	E	70.8	Confident	72.3	Confident	141 Å²	141	49.9 Å²	49.9	66%	0.659	28%	0.278	S	S	*	.	S	Bend	trans	-87.7	135.9	-178.8	-67	-61.8	151.2	0	0	110.9	F264	E262-F264 PolarHBondContact O-N 3.44Å; E262-F264 VanDerWaalsContact O-N 3.15Å
263	P	65.4	Low	71	Confident	68 Å²	68	49.5 Å²	49.5	44%	0.442	27%	0.268	S	S	.	.			trans	-71	110.1	176	29.2	-33.3	0	0	0	110.6	L265 P349 L350	P263-L265 PolarHBondContact O-N 2.99Å; P263-P349 HydrophobicContact CB-CB 3.9Å; P263-L350 CarbonylContact C-O 3.53Å; P263-L350 WeakPolarHBondContact CA-O 3.4Å
264	F	65.5	Low	69.7	Low	51 Å²	51	50.9 Å²	50.9	22%	0.224	28%	0.276	C	S	.	.	S	Bend	trans	-64.5	-37.3	179	176.3	-109.8	0	0	0	112.9	E262 M318 M319 V321 L350 L352	E262-F264 PolarHBondContact O-N 3.44Å; E262-F264 VanDerWaalsContact O-N 3.15Å; F264-M318 WeakPolarHBondContact CE2-O 3.3Å; F264-M318 VanDerWaalsContact CZ-O 3.29Å; F264-M318 WeakPolarHBondContact CZ-O 3.44Å; F264-M319 HydrophobicContact CE1-CE 4.27Å; F264-M319 HydrophobicContact CE1-SD 3.95Å; F264-M319 HydrophobicContact CZ-SD 3.79Å; F264-V321 HydrophobicContact CE2-CG2 4.31Å; F264-L350 PolarHBondContact N-O 2.85Å; F264-L352 HydrophobicContact CB-CD1 3.9Å; F264-L352 HydrophobicContact CB-CG 3.8Å; F264-L352 HydrophobicContact CD1-CD1 4.04Å; F264-L352 HydrophobicContact CD1-CD2 4.19Å; F264-L352 HydrophobicContact CD1-CG 4.09Å; F264-L352 HydrophobicContact CD2-CD1 3.68Å; F264-L352 HydrophobicContact CD2-CG 4.46Å; F264-L352 HydrophobicContact CE2-CD1 4.29Å; F264-L352 HydrophobicContact CG-CD1 3.57Å; F264-L352 HydrophobicContact CG-CD2 4.44Å; F264-L352 HydrophobicContact CG-CG 3.84Å
265	L	61.7	Low	67.9	Low	24 Å²	24	52.3 Å²	52.3	13%	0.126	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-122	120.9	173.9	-74.6	171	0	0	0	110.7	P263 F269 I273 W307 P349 L350	P263-L265 PolarHBondContact O-N 2.99Å; L265-F269 HydrophobicContact CD2-CB 4.26Å; L265-I273 HydrophobicContact CD1-CD1 4.28Å; L265-W307 HydrophobicContact CD1-CH2 4.43Å; L265-W307 HydrophobicContact CD1-CZ3 4.43Å; L265-P349 WeakPolarHBondContact O-CA 3.5Å; L265-L350 HydrophobicContact CB-CB 4.36Å; L265-L350 HydrophobicContact CD1-CD1 4.3Å; L265-L350 PolarHBondContact N-O 2.75Å; L265-L350 PolarHBondContact O-N 2.86Å; L265-L350 VanDerWaalsContact O-N 3.08Å
266	P	58	Low	65.8	Low	69 Å²	69	57.7 Å²	57.7	45%	0.448	32%	0.322	S	S	.	.			trans	-57.9	143.4	167.6	-24	34.4	0	0	0	111.3	T268 F269 A270	P266-T268 PolarHBondContact O-N 3.37Å; P266-F269 PolarHBondContact O-N 2.87Å; P266-A270 PolarHBondContact O-N 2.81Å
267	G	54.7	Low	63.5	Low	20 Å²	20	67 Å²	67	21%	0.206	36%	0.362	C	S	.	.	H	α-helix	trans	-58.8	-20.2	-175.3	0	0	0	0	0	115	A270 K271	G267-A270 PolarHBondContact O-N 2.92Å; G267-K271 WeakPolarHBondContact O-CG 3.34Å; G267-K271 PolarHBondContact O-N 3.04Å
268	T	53.7	Low	61	Low	97 Å²	97	75.4 Å²	75.4	60%	0.595	40%	0.401	S	S	*	.	H	α-helix	trans	-63	-42.4	170.5	45.9	0	0	0	0	112.5	P266 L272	P266-T268 PolarHBondContact O-N 3.37Å; T268-L272 VanDerWaalsContact O-CG 3.31Å; T268-L272 WeakPolarHBondContact O-CG 3.32Å; T268-L272 PolarHBondContact O-N 3.27Å
269	F	57.6	Low	58.2	Low	106 Å²	106	77.1 Å²	77.1	47%	0.465	43%	0.432	S	S	.	.	H	α-helix	trans	-73.9	-38.7	174.1	-77.3	-82.5	0	0	0	111.6	L265 P266 K271 L272 I273	L265-F269 HydrophobicContact CD2-CB 4.26Å; P266-F269 PolarHBondContact O-N 2.87Å; F269-K271 PolarHBondContact O-N 3.17Å; F269-L272 PolarHBondContact O-N 2.85Å; F269-I273 WeakPolarHBondContact O-CD1 3.39Å; F269-I273 VanDerWaalsContact O-CG1 3.3Å; F269-I273 WeakPolarHBondContact O-CG1 3.2Å; F269-I273 PolarHBondContact O-N 3.43Å
270	A	57.9	Low	55.6	Low	1 Å²	1	81.8 Å²	81.8	1%	0.008	47%	0.465	C	S	.	.	H	α-helix	trans	-56.6	-48.6	175.9	0	0	0	0	0	111.7	P266 G267 L272 I273 L274 G348 L350	P266-A270 PolarHBondContact O-N 2.81Å; G267-A270 PolarHBondContact O-N 2.92Å; A270-L272 VanDerWaalsContact C-N 3.35Å; A270-L272 PolarHBondContact O-N 2.92Å; A270-I273 PolarHBondContact O-N 3Å; A270-L274 HydrophobicContact CB-CD1 4.43Å; A270-L274 WeakPolarHBondContact O-CB 3.27Å; A270-L274 WeakPolarHBondContact O-CG 3.39Å; A270-L274 PolarHBondContact O-N 2.99Å; A270-G348 WeakPolarHBondContact CB-O 3.37Å; A270-L350 HydrophobicContact CB-CD1 4.28Å; A270-L350 HydrophobicContact CB-CG 4.14Å
271	K	57.4	Low	53	Low	122 Å²	122	88 Å²	88	53%	0.53	50%	0.498	S	S	.	.	H	α-helix	trans	-58.1	-41.1	174.7	-77.2	-175.4	174.3	-166.7	0	113.7	G267 F269 I273 G275 N347	G267-K271 WeakPolarHBondContact O-CG 3.34Å; G267-K271 PolarHBondContact O-N 3.04Å; F269-K271 PolarHBondContact O-N 3.17Å; K271-I273 VanDerWaalsContact C-N 3.27Å; K271-I273 PolarHBondContact O-N 3Å; K271-G275 PolarHBondContact O-N 3.17Å; K271-G275 VanDerWaalsContact O-N 3.08Å; K271-N347 HydrophobicContact CG-CB 3.9Å
272	L	58	Low	51.1	Low	99 Å²	99	87.2 Å²	87.2	52%	0.518	50%	0.502	S	S	.	.	H	α-helix	trans	-69.2	-25	179.3	-71.4	169.5	0	0	0	113.1	T268 F269 A270 Y305	T268-L272 VanDerWaalsContact O-CG 3.31Å; T268-L272 WeakPolarHBondContact O-CG 3.32Å; T268-L272 PolarHBondContact O-N 3.27Å; F269-L272 PolarHBondContact O-N 2.85Å; A270-L272 VanDerWaalsContact C-N 3.35Å; A270-L272 PolarHBondContact O-N 2.92Å; L272-Y305 HydrophobicContact CD2-CE1 4.4Å
273	I	57.9	Low	49.1	Very low	20 Å²	20	87 Å²	87	10%	0.103	52%	0.516	C	S	.	.	H	α-helix	trans	-85.6	-43.6	176.4	-64.9	160.7	0	0	0	110.3	L265 F269 A270 K271 G275 L302 W307 P336 N337	L265-I273 HydrophobicContact CD1-CD1 4.28Å; F269-I273 WeakPolarHBondContact O-CD1 3.39Å; F269-I273 VanDerWaalsContact O-CG1 3.3Å; F269-I273 WeakPolarHBondContact O-CG1 3.2Å; F269-I273 PolarHBondContact O-N 3.43Å; A270-I273 PolarHBondContact O-N 3Å; K271-I273 VanDerWaalsContact C-N 3.27Å; K271-I273 PolarHBondContact O-N 3Å; I273-G275 VanDerWaalsContact C-N 3.34Å; I273-G275 PolarHBondContact O-N 3.27Å; I273-L302 HydrophobicContact CG1-CD2 4.47Å; I273-W307 HydrophobicContact CD1-CZ3 4.15Å; I273-W307 HydrophobicContact CG2-CE3 4.28Å; I273-P336 HydrophobicContact CG2-CG 4Å; I273-N337 PolarHBondContact O-ND2 3.09Å; I273-N337 PolarHBondContact O-OD1 3.14Å; I273-N337 VanDerWaalsContact O-OD1 3.06Å
274	L	57.3	Low	47.4	Very low	31 Å²	31	86.8 Å²	86.8	16%	0.162	53%	0.526	C	S	.	.	H	α-helix	trans	-74.6	-15.8	-177.7	-72.8	160.5	0	0	0	114.8	A270 N337 L340 A346	A270-L274 HydrophobicContact CB-CD1 4.43Å; A270-L274 WeakPolarHBondContact O-CB 3.27Å; A270-L274 WeakPolarHBondContact O-CG 3.39Å; A270-L274 PolarHBondContact O-N 2.99Å; L274-N337 VanDerWaalsContact CA-OD1 3.28Å; L274-N337 WeakPolarHBondContact CA-OD1 3.17Å; L274-N337 WeakPolarHBondContact CD2-OD1 3.29Å; L274-N337 PolarHBondContact N-OD1 3.16Å; L274-L340 HydrophobicContact CD2-CB 4.26Å; L274-A346 VanDerWaalsContact CD1-C 3.41Å; L274-A346 HydrophobicContact CD1-CB 3.87Å; L274-A346 WeakPolarHBondContact CD1-O 3.37Å; L274-A346 HydrophobicContact CD2-CB 4.41Å
275	G	49.4	Very low	45.7	Very low	45 Å²	45	96.2 Å²	96.2	46%	0.464	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	82.1	26.7	155.5	0	0	0	0	0	117	K271 I273 K277	K271-G275 PolarHBondContact O-N 3.17Å; K271-G275 VanDerWaalsContact O-N 3.08Å; I273-G275 VanDerWaalsContact C-N 3.34Å; I273-G275 PolarHBondContact O-N 3.27Å; G275-K277 PolarHBondContact O-N 3.09Å
276	D	45.9	Very low	44.4	Very low	112 Å²	112	103.7 Å²	103.7	60%	0.599	59%	0.594	S	S	*	*			trans	-61.2	97.6	170.8	-92.5	-25.1	0	0	0	111.3	E278 N347	D276-E278 PolarHBondContact O-N 3.44Å; D276-E278 VanDerWaalsContact O-N 3.07Å; D276-N347 PolarHBondContact OD2-ND2 3.46Å
277	K	42.1	Very low	42.9	Very low	201 Å²	201	104.9 Å²	104.9	87%	0.874	60%	0.604	S	S	*	*			trans	-80.2	79.5	174.6	-67.8	-177.4	-178.3	175	0	110.6	G275 G279	G275-K277 PolarHBondContact O-N 3.09Å; K277-G279 PolarHBondContact O-N 3.19Å
278	E	37.1	Very low	41.8	Very low	186 Å²	186	110 Å²	110	87%	0.869	63%	0.634	S	S	*	*			trans	-56.7	125.8	164.4	-73.1	-168.3	146.6	0	0	110	D276 S280	D276-E278 PolarHBondContact O-N 3.44Å; D276-E278 VanDerWaalsContact O-N 3.07Å; E278-S280 PolarHBondContact O-N 2.9Å; E278-S280 VanDerWaalsContact O-N 3.16Å
279	G	29.7	Very low	40.8	Very low	85 Å²	85	111.9 Å²	111.9	88%	0.876	64%	0.644	S	S	*	*			trans	-76.6	103.3	-168.3	0	0	0	0	0	113.1	K277	K277-G279 PolarHBondContact O-N 3.19Å
280	S	32.4	Very low	39.4	Very low	111 Å²	111	114.5 Å²	114.5	78%	0.776	66%	0.658	S	S	*	*			trans	-118.5	106.8	169.1	-171.4	0	0	0	0	111.6	E278 G282	E278-S280 PolarHBondContact O-N 2.9Å; E278-S280 VanDerWaalsContact O-N 3.16Å; S280-G282 VanDerWaalsContact C-N 3.27Å; S280-G282 PolarHBondContact O-N 2.79Å
281	N	27.2	Very low	38.3	Very low	182 Å²	182	119.3 Å²	119.3	97%	0.973	70%	0.697	S	S	*	*			trans	-76.3	76.9	172.3	-75	-38.5	0	0	0	110.1
282	G	32.9	Very low	36.9	Very low	60 Å²	60	119.6 Å²	119.6	62%	0.619	71%	0.705	S	S	*	*			trans	-126.5	98.4	-175.4	0	0	0	0	0	113.7	S280 G284	S280-G282 VanDerWaalsContact C-N 3.27Å; S280-G282 PolarHBondContact O-N 2.79Å; G282-G284 PolarHBondContact O-N 2.97Å
283	S	28.8	Very low	35.8	Very low	138 Å²	138	126.5 Å²	126.5	97%	0.965	73%	0.726	S	S	*	*			trans	-71.4	95.8	171.5	171.4	0	0	0	0	110.8
284	G	31.5	Very low	34.3	Very low	62 Å²	62	129.1 Å²	129.1	64%	0.639	76%	0.758	S	S	*	*			trans	-137.5	93.2	-175.7	0	0	0	0	0	113.9	G282 H286	G282-G284 PolarHBondContact O-N 2.97Å; G284-H286 PolarHBondContact O-N 3.13Å
285	R	27.9	Very low	32.9	Very low	249 Å²	249	133 Å²	133	94%	0.94	79%	0.788	S	S	*	*			trans	-81.7	93.5	-177.8	-177.4	-165.4	-169.7	-169.7	5.7	111.6
286	H	34.9	Very low	31.8	Very low	182 Å²	182	139.1 Å²	139.1	84%	0.843	81%	0.806	S	S	*	*			trans	-125.6	143.9	175.1	-77.1	-82.1	0	0	0	113.9	G284	G284-H286 PolarHBondContact O-N 3.13Å
287	S	27.6	Very low	30.9	Very low	93 Å²	93	138.9 Å²	138.9	65%	0.65	81%	0.813	S	S	*	*			trans	-99	152.2	-174.7	49.7	0	0	0	0	112.4
288	P	31.6	Very low	30.3	Very low	129 Å²	129	134.6 Å²	134.6	84%	0.838	81%	0.806	S	S	*	*			trans	-66.9	138.8	171.4	30	-34.5	0	0	0	110.7
289	V	31.9	Very low	30.1	Very low	135 Å²	135	129.8 Å²	129.8	82%	0.818	79%	0.793	S	S	*	*			trans	-110.3	132.1	175.1	176	0	0	0	0	108.5
290	H	29	Very low	30.5	Very low	162 Å²	162	129 Å²	129	75%	0.75	77%	0.768	S	S	*	*			trans	-66.4	144.6	175	-87.6	-112.5	0	0	0	111.9	D292	H290-D292 IonicContact ND1-OD1 3.84Å
291	A	33.3	Very low	30.5	Very low	101 Å²	101	128.5 Å²	128.5	84%	0.835	76%	0.764	S	S	*	*			trans	-143	99.2	160.5	0	0	0	0	0	108.4
292	D	28.2	Very low	31.2	Very low	129 Å²	129	123.2 Å²	123.2	69%	0.69	74%	0.735	S	S	*	*			trans	-81.3	118.3	-179.4	-57.7	-58.7	0	0	0	111.1	H290	H290-D292 IonicContact ND1-OD1 3.84Å
293	Y	36	Very low	31.5	Very low	244 Å²	244	125 Å²	125	96%	0.957	74%	0.738	S	S	*	*			trans	-144.9	138	147.3	-86.1	-69.3	0	0	0	108.8
294	G	25.9	Very low	32.2	Very low	75 Å²	75	123 Å²	123	77%	0.773	72%	0.72	S	S	*	*			trans	-95.7	-172.9	-158.4	0	0	0	0	0	116.9
295	S	28.7	Very low	33.1	Very low	113 Å²	113	128.1 Å²	128.1	79%	0.79	72%	0.721	S	S	*	*			trans	100.7	100.8	177.3	-159.4	0	0	0	0	116.3
296	M	24.7	Very low	34.4	Very low	172 Å²	172	120.6 Å²	120.6	85%	0.847	70%	0.703	S	S	*	*			trans	51.4	93.8	140.3	-55.7	-58.2	156.2	0	0	119.6
297	S	27.7	Very low	35.6	Very low	108 Å²	108	113.7 Å²	113.7	76%	0.755	67%	0.669	S	S	*	*			trans	-163.5	142.7	146.3	-83.8	0	0	0	0	111.8	S299	S297-S299 PolarHBondContact O-N 2.65Å; S297-S299 VanDerWaalsContact O-N 3.12Å
298	P	28.9	Very low	37.2	Very low	111 Å²	111	110.1 Å²	110.1	72%	0.721	64%	0.644	S	S	*	*			trans	-81.1	82.1	170.8	33.4	-32.8	0	0	0	110.1	L300	P298-L300 PolarHBondContact O-N 2.92Å
299	S	34.1	Very low	38.5	Very low	85 Å²	85	107 Å²	107	59%	0.594	63%	0.626	S	S	*	*			trans	-72.7	125	-177.6	41	0	0	0	0	112.8	S297 C301	S297-S299 PolarHBondContact O-N 2.65Å; S297-S299 VanDerWaalsContact O-N 3.12Å; S299-C301 PolarHBondContact O-N 2.68Å; S299-C301 VanDerWaalsContact O-N 3.1Å
300	L	36.4	Very low	39.9	Very low	68 Å²	68	103.2 Å²	103.2	36%	0.356	60%	0.603	S	S	.	*			trans	-70.5	99	159	-76.8	-173.9	0	0	0	109.1	P298 L302 L312 A316 M318 M319	P298-L300 PolarHBondContact O-N 2.92Å; L300-L302 VanDerWaalsContact C-N 3.3Å; L300-L302 PolarHBondContact O-N 2.93Å; L300-L312 HydrophobicContact CD2-CD2 3.91Å; L300-A316 HydrophobicContact CD1-CB 3.71Å; L300-A316 HydrophobicContact CD2-CB 4.23Å; L300-A316 HydrophobicContact CG-CB 4.2Å; L300-M318 HydrophobicContact CB-SD 4.34Å; L300-M319 HydrophobicContact CD1-CG 4.19Å
301	C	33.4	Very low	41.3	Very low	101 Å²	101	99.5 Å²	99.5	68%	0.682	60%	0.596	S	S	*	*			trans	-68.7	87	169.2	-69.3	0	0	0	0	110.1	S299 S303	S299-C301 PolarHBondContact O-N 2.68Å; S299-C301 VanDerWaalsContact O-N 3.1Å; C301-S303 PolarHBondContact O-N 3.38Å
302	L	40.9	Very low	42.6	Very low	71 Å²	71	98.2 Å²	98.2	37%	0.372	57%	0.574	S	S	.	*			trans	-74.4	45.5	178.7	-155.2	80.7	0	0	0	112.6	I273 L300 T304	I273-L302 HydrophobicContact CG1-CD2 4.47Å; L300-L302 VanDerWaalsContact C-N 3.3Å; L300-L302 PolarHBondContact O-N 2.93Å; L302-T304 PolarHBondContact O-N 3.21Å; L302-T304 VanDerWaalsContact O-N 3.1Å
303	S	40.2	Very low	44.2	Very low	97 Å²	97	92.1 Å²	92.1	68%	0.678	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-0.3	-172.1	56.5	0	0	0	0	114.9	C301	C301-S303 PolarHBondContact O-N 3.38Å
304	T	43.8	Very low	45.2	Very low	95 Å²	95	83.3 Å²	83.3	58%	0.583	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	4	-173.5	52.8	0	0	0	0	114.3	L302 T306	L302-T304 PolarHBondContact O-N 3.21Å; L302-T304 VanDerWaalsContact O-N 3.1Å; T304-T306 PolarHBondContact O-N 3.47Å; T304-T306 PolarHBondContact O-OG1 3.42Å
305	Y	49.7	Very low	46.7	Very low	170 Å²	170	87.5 Å²	87.5	67%	0.667	52%	0.515	S	S	*	.			trans	49.9	29.1	178.8	-58.4	-88.7	0	0	0	114.5	L272	L272-Y305 HydrophobicContact CD2-CE1 4.4Å
306	T	54.8	Low	47.9	Very low	91 Å²	91	82.6 Å²	82.6	56%	0.558	48%	0.482	S	S	*	.	S	Bend	trans	-122.8	136.7	-174.1	-56.1	0	0	0	0	108.9	T304	T304-T306 PolarHBondContact O-N 3.47Å; T304-T306 PolarHBondContact O-OG1 3.42Å
307	W	61.5	Low	49.3	Very low	37 Å²	37	77.2 Å²	77.2	14%	0.14	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-62.8	133.1	178.1	-166.2	-111.4	0	0	0	110.6	L265 I273 M319 I333 D335 P336	L265-W307 HydrophobicContact CD1-CH2 4.43Å; L265-W307 HydrophobicContact CD1-CZ3 4.43Å; I273-W307 HydrophobicContact CD1-CZ3 4.15Å; I273-W307 HydrophobicContact CG2-CE3 4.28Å; W307-M319 HydrophobicContact CH2-CE 3.5Å; W307-M319 VanDerWaalsContact CH2-CE 3.5Å; W307-M319 HydrophobicContact CZ2-CE 3.54Å; W307-M319 HydrophobicContact CZ3-CE 4.25Å; W307-I333 HydrophobicContact CZ2-CB 4.34Å; W307-I333 HydrophobicContact CZ2-CG2 3.94Å; W307-I333 PolarHBondContact NE1-O 3.1Å; W307-D335 HydrophobicContact CB-CB 4.19Å; W307-D335 WeakPolarHBondContact CB-OD2 3.22Å; W307-D335 HydrophobicContact CD2-CB 4.43Å; W307-D335 HydrophobicContact CG-CB 3.84Å; W307-P336 HydrophobicContact CE3-CG 4.08Å; W307-P336 HydrophobicContact CH2-CG 3.95Å; W307-P336 HydrophobicContact CZ3-CG 3.73Å
308	P	59.8	Low	50.4	Low	18 Å²	18	77.4 Å²	77.4	12%	0.117	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-63.1	147.8	-179.6	24.3	-33.9	0	0	0	112	L312 I313	P308-L312 HydrophobicContact CB-CB 4.48Å; P308-L312 HydrophobicContact CB-CD2 3.61Å; P308-I313 HydrophobicContact CB-CG1 4Å; P308-I313 HydrophobicContact CG-CD1 4.14Å; P308-I313 HydrophobicContact CG-CG1 3.65Å; P308-I313 WeakPolarHBondContact O-CD1 3.33Å
309	S	60.1	Low	51.5	Low	65 Å²	65	72.9 Å²	72.9	46%	0.455	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-65.3	152.5	177.5	65.4	0	0	0	0	111.5	S311 L312 I313	S309-S311 PolarHBondContact O-N 3.25Å; S309-S311 VanDerWaalsContact O-N 3.11Å; S309-L312 WeakPolarHBondContact O-CA 3.5Å; S309-L312 PolarHBondContact O-N 3.26Å; S309-I313 PolarHBondContact O-N 3.24Å
310	P	61.3	Low	52.7	Low	54 Å²	54	70.8 Å²	70.8	35%	0.351	41%	0.406	S	S	.	.	H	α-helix	trans	-53.2	-35.9	-179.2	-30.9	37.3	0	0	0	114.5	I313 S314 P330	P310-I313 PolarHBondContact O-N 3.38Å; P310-S314 WeakPolarHBondContact O-CB 3.45Å; P310-S314 PolarHBondContact O-N 3.34Å; P310-P330 WeakPolarHBondContact CB-O 3.38Å
311	S	57.5	Low	53.6	Low	84 Å²	84	69.7 Å²	69.7	59%	0.587	40%	0.402	S	S	*	.	H	α-helix	trans	-62.2	-40.9	174.1	-46.4	0	0	0	0	112.7	S309 Q315	S309-S311 PolarHBondContact O-N 3.25Å; S309-S311 VanDerWaalsContact O-N 3.11Å; S311-Q315 WeakPolarHBondContact O-CG 3.41Å; S311-Q315 PolarHBondContact O-N 3.33Å
312	L	60.5	Low	54.2	Low	74 Å²	74	69 Å²	69	39%	0.387	40%	0.397	S	S	.	.	H	α-helix	trans	-78	-33.6	179.7	-165.2	141.1	0	0	0	111.4	L300 P308 S309 Q315 A316	L300-L312 HydrophobicContact CD2-CD2 3.91Å; P308-L312 HydrophobicContact CB-CB 4.48Å; P308-L312 HydrophobicContact CB-CD2 3.61Å; S309-L312 WeakPolarHBondContact O-CA 3.5Å; S309-L312 PolarHBondContact O-N 3.26Å; L312-Q315 PolarHBondContact O-N 3.11Å; L312-A316 VanDerWaalsContact O-CB 3.25Å; L312-A316 WeakPolarHBondContact O-CB 3.39Å; L312-A316 PolarHBondContact O-N 3.48Å
313	I	61.8	Low	55	Low	1 Å²	1	72.7 Å²	72.7	1%	0.005	41%	0.407	C	S	.	.	H	α-helix	trans	-57.8	-48	168.4	-70.6	174.7	0	0	0	110.9	P308 S309 P310 Q315 A316 M319 N320 L328 I333	P308-I313 HydrophobicContact CB-CG1 4Å; P308-I313 HydrophobicContact CG-CD1 4.14Å; P308-I313 HydrophobicContact CG-CG1 3.65Å; P308-I313 WeakPolarHBondContact O-CD1 3.33Å; S309-I313 PolarHBondContact O-N 3.24Å; P310-I313 PolarHBondContact O-N 3.38Å; I313-Q315 PolarHBondContact O-N 2.96Å; I313-A316 PolarHBondContact O-N 3.45Å; I313-M319 HydrophobicContact CG1-CE 4.47Å; I313-M319 HydrophobicContact CG2-CB 3.98Å; I313-N320 WeakPolarHBondContact O-CB 3.32Å; I313-N320 PolarHBondContact O-N 2.94Å; I313-L328 HydrophobicContact CG2-CD2 4.09Å; I313-I333 HydrophobicContact CD1-CB 4.34Å; I313-I333 WeakPolarHBondContact CD1-O 3.43Å; I313-I333 HydrophobicContact CG2-CB 4.11Å; I313-I333 HydrophobicContact CG2-CD1 4.25Å; I313-I333 HydrophobicContact CG2-CG1 3.87Å
314	S	57.1	Low	56	Low	59 Å²	59	69.5 Å²	69.5	41%	0.413	38%	0.382	S	S	.	.	H	α-helix	trans	-62.5	-29.3	-179.8	-168.9	0	0	0	0	113.1	P310 N320	P310-S314 WeakPolarHBondContact O-CB 3.45Å; P310-S314 PolarHBondContact O-N 3.34Å; S314-N320 PolarHBondContact O-ND2 2.54Å
315	Q	57.1	Low	56.9	Low	163 Å²	163	65.5 Å²	65.5	76%	0.762	36%	0.358	S	S	*	.	H	α-helix	trans	-89.7	-23.7	178.6	-69.1	174.1	2	0	0	113.9	S311 L312 I313 A317	S311-Q315 WeakPolarHBondContact O-CG 3.41Å; S311-Q315 PolarHBondContact O-N 3.33Å; L312-Q315 PolarHBondContact O-N 3.11Å; I313-Q315 PolarHBondContact O-N 2.96Å; Q315-A317 PolarHBondContact O-N 3.35Å
316	A	55.3	Low	57.6	Low	10 Å²	10	58.4 Å²	58.4	8%	0.083	34%	0.337	C	S	.	.			trans	-79.3	112.9	-175.8	0	0	0	0	0	111.7	L300 L312 I313 M318 M319 N320	L300-A316 HydrophobicContact CD1-CB 3.71Å; L300-A316 HydrophobicContact CD2-CB 4.23Å; L300-A316 HydrophobicContact CG-CB 4.2Å; L312-A316 VanDerWaalsContact O-CB 3.25Å; L312-A316 WeakPolarHBondContact O-CB 3.39Å; L312-A316 PolarHBondContact O-N 3.48Å; I313-A316 PolarHBondContact O-N 3.45Å; A316-M318 PolarHBondContact O-N 3.14Å; A316-M319 HydrophobicContact CB-CB 4.2Å; A316-M319 HydrophobicContact CB-CG 4.16Å; A316-M319 PolarHBondContact O-N 2.93Å; A316-N320 PolarHBondContact O-N 2.86Å
317	A	53.1	Low	58.3	Low	59 Å²	59	56.3 Å²	56.3	49%	0.488	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-17.4	177.4	0	0	0	0	0	114.7	Q315	Q315-A317 PolarHBondContact O-N 3.35Å
318	M	51.3	Low	58.7	Low	112 Å²	112	55.4 Å²	55.4	55%	0.552	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-35.4	170.6	-66	-178.8	70	0	0	113	F264 L300 A316	F264-M318 WeakPolarHBondContact CE2-O 3.3Å; F264-M318 VanDerWaalsContact CZ-O 3.29Å; F264-M318 WeakPolarHBondContact CZ-O 3.44Å; L300-M318 HydrophobicContact CB-SD 4.34Å; A316-M318 PolarHBondContact O-N 3.14Å
319	M	52.2	Low	59.2	Low	17 Å²	17	54.9 Å²	54.9	8%	0.084	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-51.3	-173.9	-59.7	-67.1	-69.1	0	0	111.3	F264 L300 W307 I313 A316 V321 I333	F264-M319 HydrophobicContact CE1-CE 4.27Å; F264-M319 HydrophobicContact CE1-SD 3.95Å; F264-M319 HydrophobicContact CZ-SD 3.79Å; L300-M319 HydrophobicContact CD1-CG 4.19Å; W307-M319 HydrophobicContact CH2-CE 3.5Å; W307-M319 VanDerWaalsContact CH2-CE 3.5Å; W307-M319 HydrophobicContact CZ2-CE 3.54Å; W307-M319 HydrophobicContact CZ3-CE 4.25Å; I313-M319 HydrophobicContact CG1-CE 4.47Å; I313-M319 HydrophobicContact CG2-CB 3.98Å; A316-M319 HydrophobicContact CB-CB 4.2Å; A316-M319 HydrophobicContact CB-CG 4.16Å; A316-M319 PolarHBondContact O-N 2.93Å; M319-V321 VanDerWaalsContact C-N 3.32Å; M319-V321 PolarHBondContact O-N 3.23Å; M319-I333 HydrophobicContact CB-CD1 4.37Å; M319-I333 HydrophobicContact CE-CD1 4.24Å; M319-I333 WeakPolarHBondContact O-CD1 3.32Å
320	N	58.3	Low	59.3	Low	40 Å²	40	57.8 Å²	57.8	21%	0.214	34%	0.336	C	S	.	.	S	Bend	trans	-89.1	75.8	166.1	-171.3	26.5	0	0	0	108.7	R225 I313 S314 A316 P322	R225-N320 PolarHBondContact NH2-OD1 3.45Å; I313-N320 WeakPolarHBondContact O-CB 3.32Å; I313-N320 PolarHBondContact O-N 2.94Å; S314-N320 PolarHBondContact O-ND2 2.54Å; A316-N320 PolarHBondContact O-N 2.86Å; N320-P322 VanDerWaalsContact O-N 3.17Å
321	V	55.8	Low	59.1	Low	45 Å²	45	56.8 Å²	56.8	27%	0.273	33%	0.332	S	S	.	.			trans	-51.8	120.7	178	179.1	0	0	0	0	108.8	F264 M319 Y323 I324	F264-V321 HydrophobicContact CE2-CG2 4.31Å; M319-V321 VanDerWaalsContact C-N 3.32Å; M319-V321 PolarHBondContact O-N 3.23Å; V321-Y323 HydrophobicContact CG1-CD2 4.27Å; V321-Y323 PolarHBondContact O-N 3.18Å; V321-I324 HydrophobicContact CB-CD1 3.97Å; V321-I324 HydrophobicContact CB-CG1 4.21Å; V321-I324 PolarHBondContact O-N 2.89Å
322	P	47.4	Very low	59.5	Low	88 Å²	88	52.8 Å²	52.8	57%	0.571	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	15.7	-161.7	28.2	-37	0	0	0	115.3	N320	N320-P322 VanDerWaalsContact O-N 3.17Å
323	Y	55.9	Low	59.8	Low	147 Å²	147	49.4 Å²	49.4	58%	0.576	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	1.5	-177.7	-54.2	-66.5	0	0	0	113.4	K26 V321	K26-Y323 CarbonylContact C-O 3.53Å; K26-Y323 WeakPolarHBondContact CA-O 3.25Å; K26-Y323 VanDerWaalsContact O-O 3.04Å; V321-Y323 HydrophobicContact CG1-CD2 4.27Å; V321-Y323 PolarHBondContact O-N 3.18Å
324	I	62.4	Low	60.1	Low	31 Å²	31	50.1 Å²	50.1	16%	0.159	29%	0.292	C	S	.	.	S	Bend	trans	-96.2	119.2	-179.5	-50.3	176.6	0	0	0	110.3	R225 V321 W356	R225-I324 PolarHBondContact NH2-O 3.11Å; R225-I324 VanDerWaalsContact NH2-O 3.14Å; V321-I324 HydrophobicContact CB-CD1 3.97Å; V321-I324 HydrophobicContact CB-CG1 4.21Å; V321-I324 PolarHBondContact O-N 2.89Å; I324-W356 HydrophobicContact CG2-CZ2 4.05Å
325	A	62.8	Low	60.5	Low	10 Å²	10	49 Å²	49	8%	0.083	28%	0.281	C	S	.	.			trans	-58.6	154.5	-176.2	0	0	0	0	0	114.7	I24 L44 L223 R225 W356	I24-A325 HydrophobicContact CD1-CB 4.48Å; I24-A325 HydrophobicContact CG2-CB 3.92Å; L44-A325 HydrophobicContact CD1-CB 3.64Å; L44-A325 HydrophobicContact CD2-CB 3.69Å; L44-A325 HydrophobicContact CG-CB 4.33Å; L223-A325 HydrophobicContact CD2-CB 4.38Å; R225-A325 WeakPolarHBondContact CD-O 3.2Å; R225-A325 PolarHBondContact NE-O 3.41Å; A325-W356 PolarHBondContact O-NE1 3.16Å
326	G	63	Low	60.9	Low	22 Å²	22	41.3 Å²	41.3	23%	0.227	25%	0.245	C	C	.	.	S	Bend	trans	85.9	146.1	173.5	0	0	0	0	0	114.5	L223 L328	L223-G326 CarbonylContact O-C 3.6Å; L223-G326 VanDerWaalsContact O-CA 3.22Å; L223-G326 WeakPolarHBondContact O-CA 3.28Å; G326-L328 PolarHBondContact O-N 2.88Å
327	T	69.6	Low	61.2	Low	46 Å²	46	42.7 Å²	42.7	28%	0.282	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	119.2	177.5	-59.8	0	0	0	0	110	T220 G221 L223 H224 R225	T220-T327 VanDerWaalsContact CA-OG1 3.3Å; T220-T327 WeakPolarHBondContact CA-OG1 3.35Å; G221-T327 PolarHBondContact N-OG1 3.03Å; L223-T327 PolarHBondContact O-N 2.69Å; H224-T327 WeakPolarHBondContact CA-O 3.29Å; R225-T327 PolarHBondContact N-O 2.85Å
328	L	71.5	Confident	61.8	Low	19 Å²	19	45.2 Å²	45.2	10%	0.099	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	138.9	179.9	-170.3	63.8	0	0	0	111.1	R225 I313 G326	R225-L328 CarbonylContact O-C 3.55Å; R225-L328 WeakPolarHBondContact O-CA 3.45Å; I313-L328 HydrophobicContact CG2-CD2 4.09Å; G326-L328 PolarHBondContact O-N 2.88Å
329	S	70.3	Confident	62.4	Low	7 Å²	7	40 Å²	40	5%	0.049	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	152.6	178.9	65.6	0	0	0	0	112.1	R225 H226 A331 G332	R225-S329 PolarHBondContact O-N 3.32Å; H226-S329 PolarHBondContact ND1-OG 3.3Å; S329-A331 PolarHBondContact O-N 2.77Å; S329-G332 PolarHBondContact O-N 2.87Å; S329-G332 PolarHBondContact OG-O 3.23Å
330	P	61.3	Low	63.1	Low	125 Å²	125	39.2 Å²	39.2	81%	0.812	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.3	-20.6	175.2	-26.1	35.6	0	0	0	114.9	P310 G332	P310-P330 WeakPolarHBondContact CB-O 3.38Å; P330-G332 VanDerWaalsContact C-N 3.25Å; P330-G332 PolarHBondContact O-N 3.42Å
331	A	57	Low	63.5	Low	33 Å²	33	41.3 Å²	41.3	27%	0.273	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-10.9	172.2	0	0	0	0	0	113.7	S329 T334 T367	S329-A331 PolarHBondContact O-N 2.77Å; A331-T334 HydrophobicContact CB-CG2 4.16Å; A331-T367 HydrophobicContact CB-CG2 4.15Å
332	G	65.7	Low	63.6	Low	1 Å²	1	43.2 Å²	43.2	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	69.5	-129.3	-178.6	0	0	0	0	0	112.5	S329 P330	S329-G332 PolarHBondContact O-N 2.87Å; S329-G332 PolarHBondContact OG-O 3.23Å; P330-G332 VanDerWaalsContact C-N 3.25Å; P330-G332 PolarHBondContact O-N 3.42Å
333	I	67.3	Low	64.4	Low	2 Å²	2	40.2 Å²	40.2	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	124.8	162.1	-58.6	178.1	0	0	0	105.4	S227 W307 I313 M319 L352	S227-I333 WeakPolarHBondContact O-CA 3.49Å; W307-I333 HydrophobicContact CZ2-CB 4.34Å; W307-I333 HydrophobicContact CZ2-CG2 3.94Å; W307-I333 PolarHBondContact NE1-O 3.1Å; I313-I333 HydrophobicContact CD1-CB 4.34Å; I313-I333 WeakPolarHBondContact CD1-O 3.43Å; I313-I333 HydrophobicContact CG2-CB 4.11Å; I313-I333 HydrophobicContact CG2-CD1 4.25Å; I313-I333 HydrophobicContact CG2-CG1 3.87Å; M319-I333 HydrophobicContact CB-CD1 4.37Å; M319-I333 HydrophobicContact CE-CD1 4.24Å; M319-I333 WeakPolarHBondContact O-CD1 3.32Å; I333-L352 HydrophobicContact CD1-CD2 4.45Å; I333-L352 HydrophobicContact CG2-CD2 4.45Å
334	T	67.5	Low	64.7	Low	17 Å²	17	36.8 Å²	36.8	10%	0.104	24%	0.243	C	C	.	.			trans	-75.1	148.6	-173.4	35.8	0	0	0	0	111.8	A331 P336 L339 E370	A331-T334 HydrophobicContact CB-CG2 4.16Å; T334-P336 WeakPolarHBondContact O-CD 3.46Å; T334-L339 WeakPolarHBondContact OG1-CD1 3.34Å; T334-E370 WeakPolarHBondContact CB-OE1 3.37Å; T334-E370 WeakPolarHBondContact CB-OE2 3.35Å; T334-E370 VanDerWaalsContact CG2-OE1 3.32Å; T334-E370 WeakPolarHBondContact CG2-OE1 3.33Å; T334-E370 WeakPolarHBondContact CG2-OE2 3.43Å; T334-E370 PolarHBondContact OG1-OE2 2.84Å
335	D	65.7	Low	64.5	Low	35 Å²	35	37.5 Å²	37.5	19%	0.187	26%	0.258	C	S	.	.			trans	-67.6	119	-168.9	-174.7	-12.6	0	0	0	110.7	W307 N337 I338 L339	W307-D335 HydrophobicContact CB-CB 4.19Å; W307-D335 WeakPolarHBondContact CB-OD2 3.22Å; W307-D335 HydrophobicContact CD2-CB 4.43Å; W307-D335 HydrophobicContact CG-CB 3.84Å; D335-N337 PolarHBondContact O-N 2.99Å; D335-N337 VanDerWaalsContact O-N 3.09Å; D335-N337 VanDerWaalsContact OD1-CB 3.26Å; D335-N337 WeakPolarHBondContact OD1-CB 3.2Å; D335-N337 PolarHBondContact OD1-N 3.42Å; D335-I338 HydrophobicContact CB-CB 4.4Å; D335-I338 HydrophobicContact CB-CD1 3.93Å; D335-I338 HydrophobicContact CB-CG1 3.97Å; D335-I338 PolarHBondContact O-N 2.95Å; D335-L339 PolarHBondContact O-N 3.13Å
336	P	65.5	Low	64.3	Low	1 Å²	1	37.4 Å²	37.4	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-58.5	-22.9	177.3	25.2	-34.7	0	0	0	112.5	C229 I273 W307 T334 L339 L340 L350	C229-P336 HydrophobicContact CB-CB 4.29Å; I273-P336 HydrophobicContact CG2-CG 4Å; W307-P336 HydrophobicContact CE3-CG 4.08Å; W307-P336 HydrophobicContact CH2-CG 3.95Å; W307-P336 HydrophobicContact CZ3-CG 3.73Å; T334-P336 WeakPolarHBondContact O-CD 3.46Å; P336-L339 PolarHBondContact O-N 3.21Å; P336-L340 HydrophobicContact CB-CD1 3.83Å; P336-L340 HydrophobicContact CB-CG 4.3Å; P336-L340 WeakPolarHBondContact O-CA 3.25Å; P336-L340 WeakPolarHBondContact O-CB 3.47Å; P336-L340 VanDerWaalsContact O-CG 3.23Å; P336-L340 WeakPolarHBondContact O-CG 3.48Å; P336-L340 PolarHBondContact O-N 2.85Å; P336-L350 HydrophobicContact CB-CD1 3.93Å; P336-L350 HydrophobicContact CG-CD1 4.41Å
337	N	62.1	Low	64.2	Low	40 Å²	40	38.9 Å²	38.9	21%	0.214	26%	0.26	C	S	.	.	H	α-helix	trans	-67.9	-39.1	174.4	-66.2	-16.8	0	0	0	112.4	I273 L274 D335 L339 T341	I273-N337 PolarHBondContact O-ND2 3.09Å; I273-N337 PolarHBondContact O-OD1 3.14Å; I273-N337 VanDerWaalsContact O-OD1 3.06Å; L274-N337 VanDerWaalsContact CA-OD1 3.28Å; L274-N337 WeakPolarHBondContact CA-OD1 3.17Å; L274-N337 WeakPolarHBondContact CD2-OD1 3.29Å; L274-N337 PolarHBondContact N-OD1 3.16Å; D335-N337 PolarHBondContact O-N 2.99Å; D335-N337 VanDerWaalsContact O-N 3.09Å; D335-N337 VanDerWaalsContact OD1-CB 3.26Å; D335-N337 WeakPolarHBondContact OD1-CB 3.2Å; D335-N337 PolarHBondContact OD1-N 3.42Å; N337-L339 VanDerWaalsContact C-N 3.33Å; N337-T341 WeakPolarHBondContact O-CB 3.25Å; N337-T341 WeakPolarHBondContact O-CG2 3.4Å; N337-T341 PolarHBondContact O-N 3.32Å; N337-T341 PolarHBondContact O-OG1 2.86Å
338	I	65.7	Low	63.9	Low	112 Å²	112	37.7 Å²	37.7	57%	0.574	26%	0.257	S	S	*	.	H	α-helix	trans	-71.5	-34.5	178.3	-60.4	177.3	0	0	0	110.3	D335	D335-I338 HydrophobicContact CB-CB 4.4Å; D335-I338 HydrophobicContact CB-CD1 3.93Å; D335-I338 HydrophobicContact CB-CG1 3.97Å; D335-I338 PolarHBondContact O-N 2.95Å
339	L	63.8	Low	63.9	Low	2 Å²	2	39.4 Å²	39.4	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-88	-34.2	-174.2	-67.7	176.2	0	0	0	114.8	I228 T334 D335 P336 N337 E370 L371 I374	I228-L339 HydrophobicContact CG2-CD1 3.93Å; T334-L339 WeakPolarHBondContact OG1-CD1 3.34Å; D335-L339 PolarHBondContact O-N 3.13Å; P336-L339 PolarHBondContact O-N 3.21Å; N337-L339 VanDerWaalsContact C-N 3.33Å; L339-E370 HydrophobicContact CD2-CB 4.35Å; L339-E370 HydrophobicContact CD2-CG 4.01Å; L339-L371 HydrophobicContact CD2-CB 3.91Å; L339-L371 HydrophobicContact CD2-CD1 4.13Å; L339-I374 HydrophobicContact CB-CD1 3.92Å; L339-I374 HydrophobicContact CD1-CD1 3.82Å; L339-I374 HydrophobicContact CD2-CD1 3.96Å; L339-I374 HydrophobicContact CG-CD1 4.12Å
340	L	66.4	Low	64.2	Low	1 Å²	1	39.2 Å²	39.2	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-111.6	-2.4	-167.2	-46.6	-179.8	0	0	0	113.8	P231 L274 P336 G342 L343 A346 L350 I374	P231-L340 HydrophobicContact CG-CD1 4.16Å; P231-L340 HydrophobicContact CG-CD2 3.97Å; L274-L340 HydrophobicContact CD2-CB 4.26Å; P336-L340 HydrophobicContact CB-CD1 3.83Å; P336-L340 HydrophobicContact CB-CG 4.3Å; P336-L340 WeakPolarHBondContact O-CA 3.25Å; P336-L340 WeakPolarHBondContact O-CB 3.47Å; P336-L340 VanDerWaalsContact O-CG 3.23Å; P336-L340 WeakPolarHBondContact O-CG 3.48Å; P336-L340 PolarHBondContact O-N 2.85Å; L340-G342 PolarHBondContact O-N 3.22Å; L340-L343 HydrophobicContact CD2-CD1 3.93Å; L340-L343 WeakPolarHBondContact O-CB 3.46Å; L340-L343 PolarHBondContact O-N 3.49Å; L340-A346 HydrophobicContact CB-CB 3.77Å; L340-A346 WeakPolarHBondContact O-CB 3.34Å; L340-L350 HydrophobicContact CD1-CD1 4.14Å; L340-L350 HydrophobicContact CD1-CD2 3.64Å; L340-I374 HydrophobicContact CD2-CG2 4.07Å
341	T	66	Low	65.2	Low	84 Å²	84	33.4 Å²	33.4	52%	0.515	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	125.8	172.5	28.9	0	0	0	0	111	N337 L343	N337-T341 WeakPolarHBondContact O-CB 3.25Å; N337-T341 WeakPolarHBondContact O-CG2 3.4Å; N337-T341 PolarHBondContact O-N 3.32Å; N337-T341 PolarHBondContact O-OG1 2.86Å; T341-L343 VanDerWaalsContact C-N 3.31Å; T341-L343 PolarHBondContact O-N 3.47Å
342	G	59.5	Low	66.5	Low	84 Å²	84	32.1 Å²	32.1	87%	0.866	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.2	-3.6	-176.3	0	0	0	0	0	115.7	L340	L340-G342 PolarHBondContact O-N 3.22Å
343	L	63.7	Low	67.5	Low	25 Å²	25	32 Å²	32	13%	0.131	22%	0.218	C	C	.	.			trans	-82.9	125.9	174.3	-64.3	-175.7	0	0	0	111.1	L340 T341 G345 A346 I374 A378	L340-L343 HydrophobicContact CD2-CD1 3.93Å; L340-L343 WeakPolarHBondContact O-CB 3.46Å; L340-L343 PolarHBondContact O-N 3.49Å; T341-L343 VanDerWaalsContact C-N 3.31Å; T341-L343 PolarHBondContact O-N 3.47Å; L343-G345 PolarHBondContact O-N 2.98Å; L343-A346 WeakPolarHBondContact O-CB 3.18Å; L343-A346 PolarHBondContact O-N 2.84Å; L343-A346 VanDerWaalsContact O-N 3.17Å; L343-I374 HydrophobicContact CD1-CG2 3.66Å; L343-A378 HydrophobicContact CD2-CB 3.89Å
344	P	61.5	Low	68.5	Low	76 Å²	76	32 Å²	32	49%	0.494	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	128.2	178.8	28.2	-35.1	0	0	0	109.9	Y233 H382	Y233-P344 WeakPolarHBondContact CE1-O 3.41Å; Y233-P344 PolarHBondContact OH-O 3.36Å; Y233-P344 VanDerWaalsContact OH-O 3.11Å; P344-H382 VanDerWaalsContact CG-CE1 3.48Å; P344-H382 WeakPolarHBondContact CG-CE1 3.44Å
345	G	58.9	Low	69.6	Low	45 Å²	45	31.2 Å²	31.2	46%	0.464	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	9	-177	0	0	0	0	0	115.4	L343 N347 G348	L343-G345 PolarHBondContact O-N 2.98Å; G345-N347 PolarHBondContact O-N 2.93Å; G345-G348 PolarHBondContact O-N 3.14Å
346	A	58.5	Low	70.7	Confident	8 Å²	8	29.7 Å²	29.7	7%	0.066	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-37.3	169.7	0	0	0	0	0	112.7	L274 L340 L343 G348	L274-A346 VanDerWaalsContact CD1-C 3.41Å; L274-A346 HydrophobicContact CD1-CB 3.87Å; L274-A346 WeakPolarHBondContact CD1-O 3.37Å; L274-A346 HydrophobicContact CD2-CB 4.41Å; L340-A346 HydrophobicContact CB-CB 3.77Å; L340-A346 WeakPolarHBondContact O-CB 3.34Å; L343-A346 WeakPolarHBondContact O-CB 3.18Å; L343-A346 PolarHBondContact O-N 2.84Å; L343-A346 VanDerWaalsContact O-N 3.17Å; A346-G348 PolarHBondContact O-N 3.34Å
347	N	59.8	Low	71.9	Confident	53 Å²	53	29.6 Å²	29.6	28%	0.283	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	3.9	175.9	-69.2	-20.7	0	0	0	115.6	K271 D276 G345	K271-N347 HydrophobicContact CG-CB 3.9Å; D276-N347 PolarHBondContact OD2-ND2 3.46Å; G345-N347 PolarHBondContact O-N 2.93Å
348	G	65	Low	73	Confident	21 Å²	21	28 Å²	28	22%	0.216	20%	0.196	C	C	.	.	S	Bend	trans	-80.9	-176.7	173.8	0	0	0	0	0	113	A270 G345 A346	A270-G348 WeakPolarHBondContact CB-O 3.37Å; G345-G348 PolarHBondContact O-N 3.14Å; A346-G348 PolarHBondContact O-N 3.34Å
349	P	71.5	Confident	73.9	Confident	56 Å²	56	23.6 Å²	23.6	36%	0.364	18%	0.175	S	C	.	.			trans	-64.1	148.5	166.2	27.3	-31.1	0	0	0	110.7	A232 P263 L265	A232-P349 HydrophobicContact CB-CB 4.47Å; A232-P349 HydrophobicContact CB-CG 3.92Å; A232-P349 VanDerWaalsContact CB-O 3.28Å; A232-P349 WeakPolarHBondContact CB-O 3.38Å; A232-P349 PolarHBondContact N-O 2.93Å; P263-P349 HydrophobicContact CB-CB 3.9Å; L265-P349 WeakPolarHBondContact O-CA 3.5Å
350	L	76.5	Confident	74.9	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137.5	-179.5	-53.3	-179	0	0	0	110.6	C229 I230 P231 P263 F264 L265 A270 P336 L340	C229-L350 HydrophobicContact CB-CD1 4.31Å; I230-L350 CarbonylContact O-C 3.58Å; I230-L350 WeakPolarHBondContact O-CA 3.49Å; P231-L350 HydrophobicContact CB-CD2 4.46Å; P231-L350 HydrophobicContact CG-CD2 4.49Å; P263-L350 CarbonylContact C-O 3.53Å; P263-L350 WeakPolarHBondContact CA-O 3.4Å; F264-L350 PolarHBondContact N-O 2.85Å; L265-L350 HydrophobicContact CB-CB 4.36Å; L265-L350 HydrophobicContact CD1-CD1 4.3Å; L265-L350 PolarHBondContact N-O 2.75Å; L265-L350 PolarHBondContact O-N 2.86Å; L265-L350 VanDerWaalsContact O-N 3.08Å; A270-L350 HydrophobicContact CB-CD1 4.28Å; A270-L350 HydrophobicContact CB-CG 4.14Å; P336-L350 HydrophobicContact CB-CD1 3.93Å; P336-L350 HydrophobicContact CG-CD1 4.41Å; L340-L350 HydrophobicContact CD1-CD1 4.14Å; L340-L350 HydrophobicContact CD1-CD2 3.64Å
351	V	81.5	Confident	75.7	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.024	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	159.8	171.8	-62.3	0	0	0	0	109.9	I230 A232	I230-V351 HydrophobicContact CD1-CG2 4.13Å; I230-V351 HydrophobicContact CG1-CG2 3.54Å; I230-V351 PolarHBondContact N-O 2.95Å; I230-V351 PolarHBondContact O-N 2.71Å; A232-V351 HydrophobicContact CB-CG1 4.09Å
352	L	83.9	Confident	76.8	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.026	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.2	178.6	-73	169.5	0	0	0	111.4	D260 F264 I333	D260-L352 PolarHBondContact N-O 3.47Å; F264-L352 HydrophobicContact CB-CD1 3.9Å; F264-L352 HydrophobicContact CB-CG 3.8Å; F264-L352 HydrophobicContact CD1-CD1 4.04Å; F264-L352 HydrophobicContact CD1-CD2 4.19Å; F264-L352 HydrophobicContact CD1-CG 4.09Å; F264-L352 HydrophobicContact CD2-CD1 3.68Å; F264-L352 HydrophobicContact CD2-CG 4.46Å; F264-L352 HydrophobicContact CE2-CD1 4.29Å; F264-L352 HydrophobicContact CG-CD1 3.57Å; F264-L352 HydrophobicContact CG-CD2 4.44Å; F264-L352 HydrophobicContact CG-CG 3.84Å; I333-L352 HydrophobicContact CD1-CD2 4.45Å; I333-L352 HydrophobicContact CG2-CD2 4.45Å
353	L	87.9	Confident	78.1	Confident	0 Å²	0	21 Å²	21	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	116.3	166.8	-177.1	67.7	0	0	0	108.7	S227 I228 I230 I257 C259	S227-L353 WeakPolarHBondContact CA-O 3.27Å; I228-L353 HydrophobicContact CB-CB 4.39Å; I228-L353 PolarHBondContact N-O 3.47Å; I228-L353 PolarHBondContact O-N 3.29Å; I230-L353 HydrophobicContact CD1-CB 4.31Å; I230-L353 HydrophobicContact CG2-CB 4.31Å; I257-L353 HydrophobicContact CG2-CD1 3.78Å; I257-L353 HydrophobicContact CG2-CG 4.25Å; C259-L353 HydrophobicContact CB-CD1 3.92Å
354	H	87.9	Confident	79.2	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.009	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	134	-179.2	-67.9	-55.6	0	0	0	111.3	S227 I257 Q258 D260 W356	S227-H354 WeakPolarHBondContact CB-ND1 3.38Å; S227-H354 PolarHBondContact OG-CE1 3.35Å; S227-H354 VanDerWaalsContact OG-CE1 3.32Å; S227-H354 PolarHBondContact OG-ND1 3.38Å; I257-H354 WeakPolarHBondContact CA-O 3.47Å; Q258-H354 PolarHBondContact N-O 2.81Å; Q258-H354 PolarHBondContact O-N 2.94Å; D260-H354 IonicContact OD1-CD2 2.92Å; D260-H354 IonicContact OD2-NE2 2.83Å; H354-W356 HydrophobicContact CB-CE3 4.09Å; H354-W356 HydrophobicContact CB-CH2 3.31Å; H354-W356 HydrophobicContact CB-CZ2 3.77Å; H354-W356 HydrophobicContact CB-CZ3 3.48Å; H354-W356 VanDerWaalsContact CB-CZ3 3.48Å
355	I	90.1	Very high	80.5	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	122.7	176.4	-57.3	173.3	0	0	0	107.3	R225 H226 I228 L247 L256 I257 I363 A366	R225-I355 CarbonylContact C-O 3.6Å; R225-I355 WeakPolarHBondContact CA-O 3.25Å; H226-I355 PolarHBondContact N-O 2.97Å; H226-I355 PolarHBondContact O-N 3.26Å; I228-I355 HydrophobicContact CD1-CD1 3.76Å; L247-I355 HydrophobicContact CD2-CD1 3.76Å; L256-I355 WeakPolarHBondContact O-CA 3.11Å; I257-I355 HydrophobicContact CD1-CG1 4.5Å; I257-I355 HydrophobicContact CG1-CG1 4.21Å; I257-I355 HydrophobicContact CG1-CG2 4.24Å; I257-I355 HydrophobicContact CG2-CG1 4.12Å; I355-I363 HydrophobicContact CB-CD1 4.47Å; I355-I363 HydrophobicContact CG2-CD1 3.87Å; I355-A366 HydrophobicContact CD1-CB 4Å; I355-A366 HydrophobicContact CG2-CB 4.35Å
356	W	90	Very high	81.9	Confident	2 Å²	2	24.3 Å²	24.3	1%	0.008	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	147.1	172.8	-62	-96.2	0	0	0	111.4	I5 I24 L223 H224 C255 L256 Q258 I324 A325 H354	I5-W356 HydrophobicContact CD1-CB 3.88Å; I24-W356 HydrophobicContact CB-CH2 4.16Å; I24-W356 HydrophobicContact CB-CZ2 4.03Å; I24-W356 HydrophobicContact CD1-CD2 3.75Å; I24-W356 HydrophobicContact CD1-CE3 4.31Å; I24-W356 HydrophobicContact CD1-CG 3.92Å; I24-W356 HydrophobicContact CD1-CZ2 4.1Å; I24-W356 HydrophobicContact CG2-CZ2 4.14Å; L223-W356 HydrophobicContact CD1-CB 4.25Å; H224-W356 VanDerWaalsContact O-CA 3.27Å; H224-W356 WeakPolarHBondContact O-CA 3.19Å; C255-W356 VanDerWaalsContact CA-O 3.27Å; C255-W356 WeakPolarHBondContact CA-O 3.3Å; L256-W356 HydrophobicContact CB-CB 4.47Å; L256-W356 HydrophobicContact CB-CE3 4.4Å; L256-W356 HydrophobicContact CD2-CE3 4.07Å; L256-W356 HydrophobicContact CD2-CZ3 4.39Å; L256-W356 HydrophobicContact CG-CE3 3.97Å; L256-W356 HydrophobicContact CG-CZ3 4.36Å; L256-W356 PolarHBondContact N-O 3.46Å; L256-W356 PolarHBondContact O-N 3.34Å; Q258-W356 HydrophobicContact CB-CH2 4.17Å; Q258-W356 HydrophobicContact CB-CZ3 3.66Å; I324-W356 HydrophobicContact CG2-CZ2 4.05Å; A325-W356 PolarHBondContact O-NE1 3.16Å; H354-W356 HydrophobicContact CB-CE3 4.09Å; H354-W356 HydrophobicContact CB-CH2 3.31Å; H354-W356 HydrophobicContact CB-CZ2 3.77Å; H354-W356 HydrophobicContact CB-CZ3 3.48Å; H354-W356 VanDerWaalsContact CB-CZ3 3.48Å
357	S	89.2	Confident	83.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	156.9	166.5	-171.4	0	0	0	0	110.5	H224 P254 S359	H224-S357 PolarHBondContact N-O 2.98Å; H224-S357 PolarHBondContact O-N 3.49Å; P254-S357 WeakPolarHBondContact O-CB 3.33Å; P254-S357 PolarHBondContact O-OG 3.46Å; S357-S359 PolarHBondContact OG-N 3.08Å; S357-S359 VanDerWaalsContact OG-N 3.14Å
358	G	85	Confident	84.4	Confident	5 Å²	5	31.4 Å²	31.4	5%	0.052	16%	0.157	C	C	.	.	S	Bend	trans	-72.3	-19.5	164.2	0	0	0	0	0	112.9	F54	F54-G358 WeakPolarHBondContact CD1-O 3.44Å; F54-G358 WeakPolarHBondContact CE1-O 3.23Å
359	S	85.8	Confident	85.4	Confident	20 Å²	20	33.2 Å²	33.2	14%	0.14	16%	0.161	C	C	.	.			trans	-93	117.1	-179.8	178.8	0	0	0	0	111.9	S357 E361 A362 I363	S357-S359 PolarHBondContact OG-N 3.08Å; S357-S359 VanDerWaalsContact OG-N 3.14Å; S359-E361 PolarHBondContact O-N 3.44Å; S359-E361 PolarHBondContact OG-N 3.28Å; S359-A362 PolarHBondContact O-N 3.04Å; S359-A362 PolarHBondContact OG-N 2.95Å; S359-I363 PolarHBondContact O-N 3.3Å
360	S	83.7	Confident	86.2	Confident	45 Å²	45	31.6 Å²	31.6	32%	0.315	15%	0.149	S	C	.	.	H	α-helix	trans	-61.6	-26.6	171.5	72.5	0	0	0	0	112.6	H224 R364	H224-S360 WeakPolarHBondContact NE2-CB 3.41Å; S360-R364 WeakPolarHBondContact O-CG 3.48Å; S360-R364 PolarHBondContact O-N 3.13Å; S360-R364 PolarHBondContact O-NH1 2.89Å; S360-R364 PolarHBondContact OG-NH1 3.44Å
361	E	84.3	Confident	86.5	Confident	67 Å²	67	34.2 Å²	34.2	31%	0.313	16%	0.162	S	C	.	.	H	α-helix	trans	-73.3	-42.3	176.7	176.7	57.7	-164.7	0	0	111.9	S359 I363 R364 R365	S359-E361 PolarHBondContact O-N 3.44Å; S359-E361 PolarHBondContact OG-N 3.28Å; E361-I363 VanDerWaalsContact C-N 3.27Å; E361-I363 PolarHBondContact O-N 3.03Å; E361-R364 WeakPolarHBondContact O-CB 3.42Å; E361-R364 PolarHBondContact O-N 3.17Å; E361-R364 VanDerWaalsContact O-N 3.14Å; E361-R364 IonicContact OE2-CZ 2.67Å; E361-R364 IonicContact OE2-NE 2.99Å; E361-R364 PolarHBondContact OE2-NE 2.82Å; E361-R364 IonicContact OE2-NH2 2.71Å; E361-R364 PolarHBondContact OE2-NH2 2.93Å; E361-R365 WeakPolarHBondContact O-CG 3.48Å; E361-R365 PolarHBondContact O-N 2.91Å; E361-R365 IonicContact OE1-CZ 3.7Å; E361-R365 VanDerWaalsContact OE1-CZ 3.28Å; E361-R365 IonicContact OE1-NE 2.65Å; E361-R365 PolarHBondContact OE1-NE 3.17Å; E361-R365 IonicContact OE1-NH2 3.88Å; E361-R365 PolarHBondContact OE1-NH2 3.19Å
362	A	88	Confident	86.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.9	-39.8	173.7	0	0	0	0	0	111.9	C251 A253 S359 R365 A366	C251-A362 HydrophobicContact CB-CB 4.06Å; C251-A362 WeakPolarHBondContact O-CA 3.49Å; C251-A362 WeakPolarHBondContact O-CB 3.31Å; A253-A362 HydrophobicContact CB-CB 3.71Å; S359-A362 PolarHBondContact O-N 3.04Å; S359-A362 PolarHBondContact OG-N 2.95Å; A362-R365 PolarHBondContact O-N 3.42Å; A362-A366 PolarHBondContact O-N 3.36Å
363	I	88.5	Confident	86.9	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-40.3	173.7	-69.2	-57.9	0	0	0	112.2	H224 H226 I355 S359 E361 R365 A366 T367	H224-I363 HydrophobicContact CB-CB 4.36Å; H224-I363 HydrophobicContact CB-CG1 3.7Å; H226-I363 HydrophobicContact CB-CD1 4.3Å; H226-I363 HydrophobicContact CB-CG2 4.02Å; I355-I363 HydrophobicContact CB-CD1 4.47Å; I355-I363 HydrophobicContact CG2-CD1 3.87Å; S359-I363 PolarHBondContact O-N 3.3Å; E361-I363 VanDerWaalsContact C-N 3.27Å; E361-I363 PolarHBondContact O-N 3.03Å; I363-R365 VanDerWaalsContact C-N 3.34Å; I363-R365 PolarHBondContact O-N 3.09Å; I363-A366 WeakPolarHBondContact O-CB 3.49Å; I363-A366 PolarHBondContact O-N 2.99Å; I363-T367 WeakPolarHBondContact O-CG2 3.37Å; I363-T367 PolarHBondContact O-N 3.01Å
364	R	86.8	Confident	86.9	Confident	112 Å²	112	36.6 Å²	36.6	42%	0.423	19%	0.186	S	C	.	.	H	α-helix	trans	-58.5	-45.1	171.9	-75.3	-175.8	-64.7	-89.7	9.4	111.6	S360 E361 A366 T367 F368	S360-R364 WeakPolarHBondContact O-CG 3.48Å; S360-R364 PolarHBondContact O-N 3.13Å; S360-R364 PolarHBondContact O-NH1 2.89Å; S360-R364 PolarHBondContact OG-NH1 3.44Å; E361-R364 WeakPolarHBondContact O-CB 3.42Å; E361-R364 PolarHBondContact O-N 3.17Å; E361-R364 VanDerWaalsContact O-N 3.14Å; E361-R364 IonicContact OE2-CZ 2.67Å; E361-R364 IonicContact OE2-NE 2.99Å; E361-R364 PolarHBondContact OE2-NE 2.82Å; E361-R364 IonicContact OE2-NH2 2.71Å; E361-R364 PolarHBondContact OE2-NH2 2.93Å; R364-A366 PolarHBondContact O-N 3.43Å; R364-T367 PolarHBondContact O-N 3.39Å; R364-T367 VanDerWaalsContact O-N 3.14Å; R364-T367 PolarHBondContact O-OG1 3.48Å; R364-F368 VanDerWaalsContact O-CD2 3.29Å; R364-F368 WeakPolarHBondContact O-CD2 3.42Å; R364-F368 PolarHBondContact O-N 3.35Å
365	R	88.5	Confident	86.7	Confident	104 Å²	104	42.6 Å²	42.6	39%	0.392	21%	0.209	S	C	.	.	H	α-helix	trans	-61.2	-42.5	176.5	-68.1	171.1	-169.5	-170.3	3.3	112.3	C251 E361 A362 I363 T367 F368 L369	C251-R365 WeakPolarHBondContact O-CD 3.49Å; E361-R365 WeakPolarHBondContact O-CG 3.48Å; E361-R365 PolarHBondContact O-N 2.91Å; E361-R365 IonicContact OE1-CZ 3.7Å; E361-R365 VanDerWaalsContact OE1-CZ 3.28Å; E361-R365 IonicContact OE1-NE 2.65Å; E361-R365 PolarHBondContact OE1-NE 3.17Å; E361-R365 IonicContact OE1-NH2 3.88Å; E361-R365 PolarHBondContact OE1-NH2 3.19Å; A362-R365 PolarHBondContact O-N 3.42Å; I363-R365 VanDerWaalsContact C-N 3.34Å; I363-R365 PolarHBondContact O-N 3.09Å; R365-T367 VanDerWaalsContact C-N 3.3Å; R365-T367 PolarHBondContact O-N 3.39Å; R365-F368 PolarHBondContact O-N 2.85Å; R365-F368 VanDerWaalsContact O-N 3.13Å; R365-L369 WeakPolarHBondContact O-CG 3.34Å; R365-L369 PolarHBondContact O-N 3.14Å
366	A	88.2	Confident	86.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-56.8	-42.4	173.2	0	0	0	0	0	112.2	I355 A362 I363 R364 F368 L369 E370	I355-A366 HydrophobicContact CD1-CB 4Å; I355-A366 HydrophobicContact CG2-CB 4.35Å; A362-A366 PolarHBondContact O-N 3.36Å; I363-A366 WeakPolarHBondContact O-CB 3.49Å; I363-A366 PolarHBondContact O-N 2.99Å; R364-A366 PolarHBondContact O-N 3.43Å; A366-F368 PolarHBondContact O-N 3.4Å; A366-L369 PolarHBondContact O-N 2.85Å; A366-E370 PolarHBondContact O-N 2.99Å; A366-E370 VanDerWaalsContact O-N 3.1Å
367	T	85.9	Confident	86.4	Confident	32 Å²	32	46.9 Å²	46.9	20%	0.196	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-16.4	178.7	69.7	0	0	0	0	114.7	H226 A331 I363 R364 R365	H226-T367 HydrophobicContact CB-CG2 4.5Å; H226-T367 VanDerWaalsContact CE1-CG2 3.47Å; H226-T367 WeakPolarHBondContact CE1-CG2 3.42Å; A331-T367 HydrophobicContact CB-CG2 4.15Å; I363-T367 WeakPolarHBondContact O-CG2 3.37Å; I363-T367 PolarHBondContact O-N 3.01Å; R364-T367 PolarHBondContact O-N 3.39Å; R364-T367 VanDerWaalsContact O-N 3.14Å; R364-T367 PolarHBondContact O-OG1 3.48Å; R365-T367 VanDerWaalsContact C-N 3.3Å; R365-T367 PolarHBondContact O-N 3.39Å
368	F	85.1	Confident	86.2	Confident	177 Å²	177	47.1 Å²	47.1	78%	0.776	23%	0.233	S	C	*	.	H	α-helix	trans	-91	-16.8	170.9	-73.3	-67.7	0	0	0	113.4	R364 R365 A366	R364-F368 VanDerWaalsContact O-CD2 3.29Å; R364-F368 WeakPolarHBondContact O-CD2 3.42Å; R364-F368 PolarHBondContact O-N 3.35Å; R365-F368 PolarHBondContact O-N 2.85Å; R365-F368 VanDerWaalsContact O-N 3.13Å; A366-F368 PolarHBondContact O-N 3.4Å
369	L	85.7	Confident	86.2	Confident	60 Å²	60	50.9 Å²	50.9	31%	0.314	26%	0.255	S	S	.	.	H	α-helix	trans	-106.7	-10.8	-171.8	-67	170.7	0	0	0	113.7	L247 F250 R365 A366 L371 G372 H373	L247-L369 HydrophobicContact CD1-CB 3.6Å; L247-L369 HydrophobicContact CD1-CD1 4.03Å; L247-L369 HydrophobicContact CD1-CG 4.49Å; F250-L369 HydrophobicContact CB-CD1 3.47Å; F250-L369 VanDerWaalsContact CB-CD1 3.47Å; F250-L369 HydrophobicContact CG-CD1 4.22Å; R365-L369 WeakPolarHBondContact O-CG 3.34Å; R365-L369 PolarHBondContact O-N 3.14Å; A366-L369 PolarHBondContact O-N 2.85Å; L369-L371 PolarHBondContact O-N 2.66Å; L369-G372 PolarHBondContact O-N 3.39Å; L369-H373 WeakPolarHBondContact O-CB 3.46Å; L369-H373 PolarHBondContact O-N 2.99Å
370	E	86.8	Confident	86.2	Confident	22 Å²	22	54.8 Å²	54.8	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-48.4	-52.2	179.9	47.3	164.8	-155.7	0	0	113.8	H226 I228 T334 L339 A366 G372 H373 I374	H226-E370 IonicContact CE1-OE2 3.24Å; H226-E370 IonicContact NE2-OE2 3.6Å; H226-E370 PolarHBondContact NE2-OE2 3.39Å; I228-E370 HydrophobicContact CD1-CB 3.71Å; I228-E370 HydrophobicContact CG1-CB 4.27Å; T334-E370 WeakPolarHBondContact CB-OE1 3.37Å; T334-E370 WeakPolarHBondContact CB-OE2 3.35Å; T334-E370 VanDerWaalsContact CG2-OE1 3.32Å; T334-E370 WeakPolarHBondContact CG2-OE1 3.33Å; T334-E370 WeakPolarHBondContact CG2-OE2 3.43Å; T334-E370 PolarHBondContact OG1-OE2 2.84Å; L339-E370 HydrophobicContact CD2-CB 4.35Å; L339-E370 HydrophobicContact CD2-CG 4.01Å; A366-E370 PolarHBondContact O-N 2.99Å; A366-E370 VanDerWaalsContact O-N 3.1Å; E370-G372 PolarHBondContact O-N 2.98Å; E370-H373 PolarHBondContact O-N 2.88Å; E370-I374 VanDerWaalsContact O-CG1 3.25Å; E370-I374 WeakPolarHBondContact O-CG1 3.5Å; E370-I374 PolarHBondContact O-N 2.87Å
371	L	83.7	Confident	86.2	Confident	56 Å²	56	54.5 Å²	54.5	29%	0.293	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-43.8	-179.3	-180	66	0	0	0	112	L339 L369 H373 R375	L339-L371 HydrophobicContact CD2-CB 3.91Å; L339-L371 HydrophobicContact CD2-CD1 4.13Å; L369-L371 PolarHBondContact O-N 2.66Å; L371-H373 VanDerWaalsContact C-N 3.33Å; L371-R375 WeakPolarHBondContact O-CB 3.41Å; L371-R375 VanDerWaalsContact O-CG 3.25Å; L371-R375 WeakPolarHBondContact O-CG 3.39Å; L371-R375 PolarHBondContact O-N 2.76Å
372	G	85.5	Confident	86	Confident	49 Å²	49	54.1 Å²	54.1	51%	0.505	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-39	176.9	0	0	0	0	0	111.9	L369 E370 L376	L369-G372 PolarHBondContact O-N 3.39Å; E370-G372 PolarHBondContact O-N 2.98Å; G372-L376 VanDerWaalsContact O-CB 3.29Å; G372-L376 WeakPolarHBondContact O-CB 3.4Å; G372-L376 PolarHBondContact O-N 3.2Å
373	H	88.9	Confident	85.6	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.046	28%	0.277	C	S	.	.	H	α-helix	trans	-68.9	-45.5	178.5	-174	58.3	0	0	0	112.9	S243 H244 L247 L369 E370 L371 R375 L376 L377	S243-H373 PolarHBondContact O-CE1 2.89Å; H244-H373 AromaticContact CE1-NE2 3.61Å; H244-H373 AromaticContact CG-NE2 3.82Å; H244-H373 AromaticContact ND1-CE1 3.27Å; H244-H373 PolarHBondContact ND1-CE1 3.47Å; H244-H373 VanDerWaalsContact ND1-CE1 3.27Å; H244-H373 AromaticContact ND1-NE2 2.98Å; H244-H373 PolarHBondContact ND1-NE2 2.88Å; L247-H373 HydrophobicContact CD2-CB 4.35Å; L369-H373 WeakPolarHBondContact O-CB 3.46Å; L369-H373 PolarHBondContact O-N 2.99Å; E370-H373 PolarHBondContact O-N 2.88Å; L371-H373 VanDerWaalsContact C-N 3.33Å; H373-R375 PolarHBondContact O-N 2.69Å; H373-L376 PolarHBondContact O-N 2.72Å; H373-L377 WeakPolarHBondContact O-CG 3.39Å; H373-L377 PolarHBondContact O-N 3.24Å
374	I	86.8	Confident	85.1	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-41.7	176.3	-60.1	165	0	0	0	110.4	I228 I230 L234 L339 L340 L343 E370 L376 L377 A378	I228-I374 HydrophobicContact CG2-CD1 3.53Å; I228-I374 HydrophobicContact CG2-CG1 4.24Å; I230-I374 HydrophobicContact CG2-CD1 4.2Å; I230-I374 HydrophobicContact CG2-CG1 3.97Å; L234-I374 HydrophobicContact CD1-CG2 4.33Å; L339-I374 HydrophobicContact CB-CD1 3.92Å; L339-I374 HydrophobicContact CD1-CD1 3.82Å; L339-I374 HydrophobicContact CD2-CD1 3.96Å; L339-I374 HydrophobicContact CG-CD1 4.12Å; L340-I374 HydrophobicContact CD2-CG2 4.07Å; L343-I374 HydrophobicContact CD1-CG2 3.66Å; E370-I374 VanDerWaalsContact O-CG1 3.25Å; E370-I374 WeakPolarHBondContact O-CG1 3.5Å; E370-I374 PolarHBondContact O-N 2.87Å; I374-L376 VanDerWaalsContact C-N 3.35Å; I374-L376 PolarHBondContact O-N 3.21Å; I374-L377 PolarHBondContact O-N 3.39Å; I374-A378 WeakPolarHBondContact O-CB 3.26Å; I374-A378 PolarHBondContact O-N 2.92Å
375	R	84	Confident	84.3	Confident	128 Å²	128	62.1 Å²	62.1	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-40.7	173.5	-73.5	176.4	177.2	-162.8	-0.8	111.7	L371 H373 A378 V379	L371-R375 WeakPolarHBondContact O-CB 3.41Å; L371-R375 VanDerWaalsContact O-CG 3.25Å; L371-R375 WeakPolarHBondContact O-CG 3.39Å; L371-R375 PolarHBondContact O-N 2.76Å; H373-R375 PolarHBondContact O-N 2.69Å; R375-A378 PolarHBondContact O-N 3.44Å; R375-V379 WeakPolarHBondContact O-CG2 3.2Å; R375-V379 PolarHBondContact O-N 3.31Å
376	L	87	Confident	83.2	Confident	89 Å²	89	62 Å²	62	47%	0.466	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-41.9	175	-177.5	62.8	0	0	0	112.4	G372 H373 I374 V379 R380	G372-L376 VanDerWaalsContact O-CB 3.29Å; G372-L376 WeakPolarHBondContact O-CB 3.4Å; G372-L376 PolarHBondContact O-N 3.2Å; H373-L376 PolarHBondContact O-N 2.72Å; I374-L376 VanDerWaalsContact C-N 3.35Å; I374-L376 PolarHBondContact O-N 3.21Å; L376-V379 PolarHBondContact O-N 3.04Å; L376-R380 VanDerWaalsContact O-CB 3.27Å; L376-R380 WeakPolarHBondContact O-CB 3.46Å; L376-R380 PolarHBondContact O-N 3.29Å
377	L	86.3	Confident	81.9	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-43.7	172.5	-71.7	172.2	0	0	0	111.2	L234 L237 A238 H373 I374 R380 F381	L234-L377 HydrophobicContact CD1-CB 4.19Å; L237-L377 HydrophobicContact CD2-CB 4.34Å; L237-L377 HydrophobicContact CD2-CD2 3.91Å; L237-L377 VanDerWaalsContact CD2-O 3.23Å; L237-L377 WeakPolarHBondContact CD2-O 3.43Å; L237-L377 HydrophobicContact CG-CD2 4.02Å; A238-L377 HydrophobicContact CB-CD1 4.49Å; H373-L377 WeakPolarHBondContact O-CG 3.39Å; H373-L377 PolarHBondContact O-N 3.24Å; I374-L377 PolarHBondContact O-N 3.39Å; L377-R380 PolarHBondContact O-N 3.05Å; L377-F381 VanDerWaalsContact O-CB 3.31Å; L377-F381 WeakPolarHBondContact O-CB 3.25Å; L377-F381 PolarHBondContact O-N 3.22Å
378	A	85.5	Confident	80.5	Confident	5 Å²	5	69 Å²	69	4%	0.041	35%	0.35	C	S	.	.	H	α-helix	trans	-63.8	-44.4	177.1	0	0	0	0	0	112.3	L343 I374 R375 F381 H382	L343-A378 HydrophobicContact CD2-CB 3.89Å; I374-A378 WeakPolarHBondContact O-CB 3.26Å; I374-A378 PolarHBondContact O-N 2.92Å; R375-A378 PolarHBondContact O-N 3.44Å; A378-F381 PolarHBondContact O-N 3.29Å; A378-H382 PolarHBondContact O-N 3.29Å; A378-H382 PolarHBondContact O-ND1 2.91Å
379	V	84.8	Confident	78.7	Confident	85 Å²	85	63.3 Å²	63.3	52%	0.515	33%	0.325	S	S	.	.	H	α-helix	trans	-62.8	-46.8	174.5	169.5	0	0	0	0	110.7	R375 L376 F381 H382 L383	R375-V379 WeakPolarHBondContact O-CG2 3.2Å; R375-V379 PolarHBondContact O-N 3.31Å; L376-V379 PolarHBondContact O-N 3.04Å; V379-F381 VanDerWaalsContact C-N 3.33Å; V379-F381 PolarHBondContact O-N 3.36Å; V379-H382 PolarHBondContact O-N 3.31Å; V379-L383 HydrophobicContact CG1-CD1 3.83Å; V379-L383 HydrophobicContact CG1-CG 4.31Å; V379-L383 WeakPolarHBondContact O-CB 3.38Å; V379-L383 VanDerWaalsContact O-CG 3.32Å; V379-L383 WeakPolarHBondContact O-CG 3.48Å; V379-L383 PolarHBondContact O-N 3.23Å
380	R	85.9	Confident	76.9	Confident	102 Å²	102	63.3 Å²	63.3	39%	0.385	34%	0.34	S	S	.	.	H	α-helix	trans	-61.7	-39.2	177.4	-178	172.5	179	174.3	-2.7	112	L237 L376 L377 L384	L237-R380 HydrophobicContact CD1-CG 4.23Å; L237-R380 HydrophobicContact CD2-CB 3.97Å; L237-R380 HydrophobicContact CD2-CG 3.97Å; L376-R380 VanDerWaalsContact O-CB 3.27Å; L376-R380 WeakPolarHBondContact O-CB 3.46Å; L376-R380 PolarHBondContact O-N 3.29Å; L377-R380 PolarHBondContact O-N 3.05Å; R380-L384 HydrophobicContact CG-CD1 4.03Å; R380-L384 WeakPolarHBondContact O-CB 3.32Å; R380-L384 VanDerWaalsContact O-CG 3.25Å; R380-L384 WeakPolarHBondContact O-CG 3.36Å; R380-L384 PolarHBondContact O-N 3.35Å
381	F	83.9	Confident	74.6	Confident	38 Å²	38	70.1 Å²	70.1	17%	0.167	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-46.6	173.9	179	-90.1	0	0	0	111.9	Y233 L234 L237 L377 A378 V379 L384 K385	Y233-F381 AromaticContact CD2-CD1 3.74Å; Y233-F381 HydrophobicContact CD2-CD1 3.74Å; Y233-F381 HydrophobicContact CD2-CD2 4.29Å; Y233-F381 AromaticContact CD2-CE1 3.52Å; Y233-F381 HydrophobicContact CD2-CE1 3.52Å; Y233-F381 HydrophobicContact CD2-CE2 4.09Å; Y233-F381 HydrophobicContact CD2-CG 4.13Å; Y233-F381 AromaticContact CD2-CZ 3.71Å; Y233-F381 HydrophobicContact CD2-CZ 3.71Å; Y233-F381 AromaticContact CE2-CD1 3.71Å; Y233-F381 HydrophobicContact CE2-CD1 3.71Å; Y233-F381 AromaticContact CE2-CE1 3.9Å; Y233-F381 HydrophobicContact CE2-CE1 3.9Å; Y233-F381 HydrophobicContact CE2-CG 4.16Å; Y233-F381 VanDerWaalsContact O-CE2 3.25Å; Y233-F381 WeakPolarHBondContact O-CE2 3.5Å; L234-F381 HydrophobicContact CD2-CB 3.68Å; L234-F381 HydrophobicContact CD2-CD2 4.33Å; L234-F381 HydrophobicContact CD2-CG 3.96Å; L237-F381 HydrophobicContact CD2-CB 4.12Å; L377-F381 VanDerWaalsContact O-CB 3.31Å; L377-F381 WeakPolarHBondContact O-CB 3.25Å; L377-F381 PolarHBondContact O-N 3.22Å; A378-F381 PolarHBondContact O-N 3.29Å; V379-F381 VanDerWaalsContact C-N 3.33Å; V379-F381 PolarHBondContact O-N 3.36Å; F381-L384 PolarHBondContact O-N 2.92Å; F381-K385 HydrophobicContact CE1-CD 4.06Å; F381-K385 WeakPolarHBondContact O-CB 3.47Å; F381-K385 PolarHBondContact O-N 3.08Å
382	H	79.2	Confident	72.5	Confident	59 Å²	59	71.1 Å²	71.1	27%	0.273	38%	0.38	S	S	.	.	H	α-helix	trans	-68.7	-37.3	179.2	-73.6	84.6	0	0	0	112.5	P344 A378 V379 K385 N386	P344-H382 VanDerWaalsContact CG-CE1 3.48Å; P344-H382 WeakPolarHBondContact CG-CE1 3.44Å; A378-H382 PolarHBondContact O-N 3.29Å; A378-H382 PolarHBondContact O-ND1 2.91Å; V379-H382 PolarHBondContact O-N 3.31Å; H382-K385 PolarHBondContact O-N 3.5Å; H382-N386 VanDerWaalsContact O-CB 3.25Å; H382-N386 WeakPolarHBondContact O-CB 3.43Å; H382-N386 PolarHBondContact O-N 2.99Å; H382-N386 PolarHBondContact O-ND2 2.99Å
383	L	80.1	Confident	70	Confident	77 Å²	77	71.6 Å²	71.6	40%	0.403	39%	0.385	S	S	.	.	H	α-helix	trans	-60.1	-48.9	170.9	-72.3	170.6	0	0	0	111.2	V379 K385 N386 L387 L621	V379-L383 HydrophobicContact CG1-CD1 3.83Å; V379-L383 HydrophobicContact CG1-CG 4.31Å; V379-L383 WeakPolarHBondContact O-CB 3.38Å; V379-L383 VanDerWaalsContact O-CG 3.32Å; V379-L383 WeakPolarHBondContact O-CG 3.48Å; V379-L383 PolarHBondContact O-N 3.23Å; L383-K385 PolarHBondContact O-N 3.46Å; L383-N386 PolarHBondContact O-N 3.09Å; L383-L387 WeakPolarHBondContact O-CB 3.16Å; L383-L387 WeakPolarHBondContact O-CD1 3.31Å; L383-L387 VanDerWaalsContact O-CG 3.22Å; L383-L387 WeakPolarHBondContact O-CG 3.3Å; L383-L387 PolarHBondContact O-N 2.85Å; L383-L621 HydrophobicContact CD2-CD2 3.65Å
384	L	77.7	Confident	67.6	Low	85 Å²	85	76.7 Å²	76.7	45%	0.445	41%	0.412	S	S	.	.	H	α-helix	trans	-61.3	-44.2	177.3	-73.6	168	0	0	0	112	L237 R380 F381 N386 L387 S388	L237-L384 HydrophobicContact CD1-CD1 3.91Å; R380-L384 HydrophobicContact CG-CD1 4.03Å; R380-L384 WeakPolarHBondContact O-CB 3.32Å; R380-L384 VanDerWaalsContact O-CG 3.25Å; R380-L384 WeakPolarHBondContact O-CG 3.36Å; R380-L384 PolarHBondContact O-N 3.35Å; F381-L384 PolarHBondContact O-N 2.92Å; L384-N386 PolarHBondContact O-N 3.35Å; L384-L387 PolarHBondContact O-N 3.06Å; L384-S388 WeakPolarHBondContact O-CB 3.36Å; L384-S388 PolarHBondContact O-N 3.25Å; L384-S388 PolarHBondContact O-OG 2.87Å
385	K	70.9	Confident	65	Low	124 Å²	124	85.3 Å²	85.3	54%	0.539	46%	0.457	S	S	.	.	H	α-helix	trans	-62.7	-40.9	176.9	-174.1	175.3	-179.1	177	0	112.6	F381 H382 L383 L387 S388 K389	F381-K385 HydrophobicContact CE1-CD 4.06Å; F381-K385 WeakPolarHBondContact O-CB 3.47Å; F381-K385 PolarHBondContact O-N 3.08Å; H382-K385 PolarHBondContact O-N 3.5Å; L383-K385 PolarHBondContact O-N 3.46Å; K385-L387 VanDerWaalsContact C-N 3.3Å; K385-L387 PolarHBondContact O-N 3.22Å; K385-S388 PolarHBondContact O-N 3.01Å; K385-S388 PolarHBondContact O-OG 3.14Å; K385-K389 PolarHBondContact O-N 2.91Å
386	N	64.9	Low	62.7	Low	101 Å²	101	88.2 Å²	88.2	54%	0.54	48%	0.476	S	S	.	.	H	α-helix	trans	-70.6	-26.3	177.4	-70.4	-13	0	0	0	112.7	H382 L383 L384	H382-N386 VanDerWaalsContact O-CB 3.25Å; H382-N386 WeakPolarHBondContact O-CB 3.43Å; H382-N386 PolarHBondContact O-N 2.99Å; H382-N386 PolarHBondContact O-ND2 2.99Å; L383-N386 PolarHBondContact O-N 3.09Å; L384-N386 PolarHBondContact O-N 3.35Å
387	L	61.7	Low	60.1	Low	120 Å²	120	92.1 Å²	92.1	63%	0.628	50%	0.497	S	S	*	.	H	α-helix	trans	-80.7	-39.7	172.9	-70.5	166.1	0	0	0	112.3	L383 L384 K385	L383-L387 WeakPolarHBondContact O-CB 3.16Å; L383-L387 WeakPolarHBondContact O-CD1 3.31Å; L383-L387 VanDerWaalsContact O-CG 3.22Å; L383-L387 WeakPolarHBondContact O-CG 3.3Å; L383-L387 PolarHBondContact O-N 2.85Å; L384-L387 PolarHBondContact O-N 3.06Å; K385-L387 VanDerWaalsContact C-N 3.3Å; K385-L387 PolarHBondContact O-N 3.22Å
388	S	56.7	Low	57.6	Low	59 Å²	59	97.6 Å²	97.6	41%	0.413	54%	0.535	S	S	.	.	H	α-helix	trans	-81.5	-24.3	-173.4	69.6	0	0	0	0	115.3	L384 K385 G390	L384-S388 WeakPolarHBondContact O-CB 3.36Å; L384-S388 PolarHBondContact O-N 3.25Å; L384-S388 PolarHBondContact O-OG 2.87Å; K385-S388 PolarHBondContact O-N 3.01Å; K385-S388 PolarHBondContact O-OG 3.14Å; S388-G390 PolarHBondContact O-N 2.89Å
389	K	47.4	Very low	54.8	Low	58 Å²	58	104.8 Å²	104.8	25%	0.252	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	48.1	46.2	169.2	-69.3	-176.8	176.8	172.1	0	116.6	K385 I413	K385-K389 PolarHBondContact O-N 2.91Å; K389-I413 HydrophobicContact CB-CD1 4.29Å; K389-I413 HydrophobicContact CB-CG1 4.08Å; K389-I413 HydrophobicContact CD-CD1 3.75Å; K389-I413 HydrophobicContact CD-CG1 3.9Å; K389-I413 PolarHBondContact O-N 3.01Å
390	G	46.8	Very low	52.3	Low	60 Å²	60	106.8 Å²	106.8	62%	0.619	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	143.9	-29.3	155.8	0	0	0	0	0	115.9	S388 T392	S388-G390 PolarHBondContact O-N 2.89Å; G390-T392 PolarHBondContact O-N 3.28Å; G390-T392 VanDerWaalsContact O-N 3.17Å
391	E	38.5	Very low	49.8	Very low	165 Å²	165	104.9 Å²	104.9	77%	0.771	60%	0.604	S	S	*	*			trans	-94	78.9	-168.1	-159.1	163.4	-147.5	0	0	113.1
392	T	39.4	Very low	47.3	Very low	77 Å²	77	112.5 Å²	112.5	47%	0.472	64%	0.64	S	S	.	*			trans	-99.3	109.1	147.6	43.7	0	0	0	0	107.8	G390 D394	G390-T392 PolarHBondContact O-N 3.28Å; G390-T392 VanDerWaalsContact O-N 3.17Å; T392-D394 PolarHBondContact O-N 3.01Å
393	G	32.8	Very low	45.3	Very low	59 Å²	59	117.3 Å²	117.3	61%	0.608	67%	0.666	S	S	*	*			trans	-59.9	109.8	171.4	0	0	0	0	0	109.8	R236	R236-G393 PolarHBondContact NH1-O 3.06Å; R236-G393 PolarHBondContact NH2-O 3.38Å
394	D	38.8	Very low	43.1	Very low	117 Å²	117	121.4 Å²	121.4	63%	0.626	69%	0.689	S	S	*	*			trans	-114.2	124	171.4	-69.6	-35	0	0	0	107.3	R236 T392 E396	R236-D394 IonicContact NH2-OD1 2.73Å; R236-D394 PolarHBondContact NH2-OD1 2.94Å; T392-D394 PolarHBondContact O-N 3.01Å; D394-E396 VanDerWaalsContact C-N 3.34Å; D394-E396 PolarHBondContact O-N 3.39Å; D394-E396 VanDerWaalsContact O-N 3.11Å
395	L	32.2	Very low	41.3	Very low	180 Å²	180	124.1 Å²	124.1	94%	0.942	71%	0.708	S	S	*	*			trans	-90.1	63	-166.2	-168.1	91.1	0	0	0	111.4
396	E	36.4	Very low	39.5	Very low	189 Å²	189	126.9 Å²	126.9	88%	0.883	72%	0.723	S	S	*	*			trans	-109.5	138.2	172.9	-67.4	-147.9	145.6	0	0	113.2	D394	D394-E396 VanDerWaalsContact C-N 3.34Å; D394-E396 PolarHBondContact O-N 3.39Å; D394-E396 VanDerWaalsContact O-N 3.11Å
397	L	31.4	Very low	38	Very low	171 Å²	171	130.1 Å²	130.1	90%	0.895	74%	0.74	S	S	*	*			trans	-88.2	123.7	-173.3	-63.6	153.3	0	0	0	110.2
398	S	33.8	Very low	36.6	Very low	118 Å²	118	127.5 Å²	127.5	83%	0.825	74%	0.742	S	S	*	*				172	157.6	126.1	45.8	0	0	0	0	113.4
399	N	26.9	Very low	35.6	Very low	156 Å²	156	132.1 Å²	132.1	83%	0.834	76%	0.763	S	S	*	*			trans	-75.2	147	179.4	-47.9	-63.1	0	0	0	112.1
400	S	33.4	Very low	34.8	Very low	127 Å²	127	133.8 Å²	133.8	89%	0.888	79%	0.787	S	S	*	*				145.8	165.1	119.7	62.8	0	0	0	0	113.1
401	G	32.4	Very low	34.9	Very low	63 Å²	63	133.8 Å²	133.8	65%	0.649	78%	0.776	S	S	*	*			trans	99.4	69.5	162	0	0	0	0	0	116.1	L403	G401-L403 PolarHBondContact O-N 3.46Å
402	E	31.6	Very low	35.4	Very low	198 Å²	198	128.8 Å²	128.8	93%	0.925	76%	0.764	S	S	*	*			trans	-60.7	115.6	151.6	176.7	174	-141.8	0	0	108.5
403	L	37.1	Very low	36.3	Very low	159 Å²	159	126.3 Å²	126.3	83%	0.832	75%	0.747	S	S	*	*			trans	-143.8	147	176.1	-78.6	178.9	0	0	0	110.9	G401	G401-L403 PolarHBondContact O-N 3.46Å
404	D	35.5	Very low	37.8	Very low	163 Å²	163	129.6 Å²	129.6	87%	0.872	75%	0.746	S	S	*	*			trans	-81.4	170.1	-165.1	-73	-69.4	0	0	0	115.9
405	V	38.4	Very low	39.8	Very low	142 Å²	142	124.8 Å²	124.8	86%	0.861	72%	0.721	S	S	*	*			trans	-77.7	117.5	-178.8	179.5	0	0	0	0	111.6
406	E	34.5	Very low	42.2	Very low	183 Å²	183	121.7 Å²	121.7	86%	0.855	70%	0.701	S	S	*	*			trans	-118.7	165	158.9	-80.4	-90.2	108.5	0	0	109.7
407	D	32.8	Very low	44.6	Very low	168 Å²	168	117.1 Å²	117.1	90%	0.898	69%	0.687	S	S	*	*	S	Bend	trans	-57.1	143.2	-165.1	-76	-46.9	0	0	0	116.9
408	G	31.4	Very low	47.1	Very low	65 Å²	65	110.9 Å²	110.9	67%	0.67	65%	0.654	S	S	*	*	S	Bend	trans	134.2	102.5	151.2	0	0	0	0	0	118.3	A410	G408-A410 VanDerWaalsContact C-N 3.27Å; G408-A410 PolarHBondContact O-N 3.5Å
409	D	37	Very low	49.4	Very low	156 Å²	156	109.7 Å²	109.7	83%	0.834	65%	0.646	S	S	*	*	S	Bend	trans	55.9	-11.2	148.4	-142.5	20.1	0	0	0	121.8
410	A	30.9	Very low	51.8	Low	93 Å²	93	102.5 Å²	102.5	77%	0.769	61%	0.607	S	S	*	*			trans	-130.8	85.8	-171.1	0	0	0	0	0	116.5	G408	G408-A410 VanDerWaalsContact C-N 3.27Å; G408-A410 PolarHBondContact O-N 3.5Å
411	P	48.2	Very low	53.8	Low	60 Å²	60	100.1 Å²	100.1	39%	0.39	59%	0.589	S	S	.	*			trans	-94.2	104.2	157.4	33.2	-27	0	0	0	110.6
412	A	49.3	Very low	55.3	Low	61 Å²	61	99 Å²	99	50%	0.504	57%	0.574	S	S	.	*			trans	-56.4	155.4	157.7	0	0	0	0	0	109.8	H414	A412-H414 PolarHBondContact O-N 2.94Å
413	I	57.5	Low	56.7	Low	24 Å²	24	94 Å²	94	12%	0.123	56%	0.557	C	S	.	*			trans	-81.2	78.5	-179.6	-55.2	-178.5	0	0	0	109.3	K389 C415 H491	K389-I413 HydrophobicContact CB-CD1 4.29Å; K389-I413 HydrophobicContact CB-CG1 4.08Å; K389-I413 HydrophobicContact CD-CD1 3.75Å; K389-I413 HydrophobicContact CD-CG1 3.9Å; K389-I413 PolarHBondContact O-N 3.01Å; I413-C415 VanDerWaalsContact C-N 3.33Å; I413-C415 PolarHBondContact O-N 2.85Å; I413-H491 WeakPolarHBondContact CD1-ND1 3.26Å
414	H	64.4	Low	57.2	Low	129 Å²	129	90.9 Å²	90.9	60%	0.597	54%	0.544	S	S	*	.			trans	-75.7	85	174.2	-165.9	-36.9	0	0	0	110.4	A412 K416	A412-H414 PolarHBondContact O-N 2.94Å; H414-K416 VanDerWaalsContact CE1-CG 3.49Å; H414-K416 WeakPolarHBondContact CE1-CG 3.35Å; H414-K416 WeakPolarHBondContact ND1-CG 3.28Å; H414-K416 PolarHBondContact O-N 3.05Å
415	C	80.7	Confident	57.9	Low	15 Å²	15	88.5 Å²	88.5	10%	0.101	54%	0.54	C	S	.	.			trans	-73.2	102.3	164.6	-72.7	0	0	0	0	108.9	I413 Y438 E439 I487	I413-C415 VanDerWaalsContact C-N 3.33Å; I413-C415 PolarHBondContact O-N 2.85Å; C415-Y438 HydrophobicContact CB-CD1 4.12Å; C415-E439 CarbonylContact C-O 3.52Å; C415-E439 VanDerWaalsContact CA-O 3.3Å; C415-E439 WeakPolarHBondContact CA-O 3.4Å; C415-I487 HydrophobicContact CB-CD1 3.98Å; C415-I487 HydrophobicContact CB-CG1 3.9Å
416	K	83.1	Confident	58.2	Low	116 Å²	116	86.4 Å²	86.4	50%	0.504	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	126.3	176.3	-70.8	-175.5	176	-170.9	0	109.1	H414 I418 Y438 E439	H414-K416 VanDerWaalsContact CE1-CG 3.49Å; H414-K416 WeakPolarHBondContact CE1-CG 3.35Å; H414-K416 WeakPolarHBondContact ND1-CG 3.28Å; H414-K416 PolarHBondContact O-N 3.05Å; K416-I418 PolarHBondContact O-N 3.24Å; K416-Y438 CarbonylContact O-C 3.43Å; K416-Y438 WeakPolarHBondContact O-CA 3.45Å; K416-E439 HydrophobicContact CB-CB 4.39Å; K416-E439 PolarHBondContact N-O 3.34Å; K416-E439 PolarHBondContact O-N 3.05Å
417	P	85.8	Confident	58.4	Low	93 Å²	93	84.6 Å²	84.6	60%	0.604	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	132	172.5	28.2	-33	0	0	0	109.7	I436 G437	P417-I436 HydrophobicContact CB-CG2 4.35Å; P417-G437 CarbonylContact C-O 3.51Å; P417-G437 WeakPolarHBondContact CA-O 3.32Å
418	I	85.3	Confident	59	Low	40 Å²	40	85.5 Å²	85.5	21%	0.205	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	152.4	179.7	53.7	161.7	0	0	0	110.6	K416 I420 G437 E439 E483	K416-I418 PolarHBondContact O-N 3.24Å; I418-I420 HydrophobicContact CD1-CD1 3.68Å; I418-I420 HydrophobicContact CD1-CG1 3.82Å; I418-I420 HydrophobicContact CG1-CD1 3.96Å; I418-I420 HydrophobicContact CG1-CG1 3.92Å; I418-G437 PolarHBondContact N-O 2.88Å; I418-G437 PolarHBondContact O-N 3.39Å; I418-E439 HydrophobicContact CD1-CB 3.97Å; I418-E439 HydrophobicContact CG1-CB 4.19Å; I418-E439 HydrophobicContact CG2-CB 3.8Å; I418-E483 HydrophobicContact CD1-CB 4.36Å; I418-E483 HydrophobicContact CD1-CG 4.1Å
419	S	81.6	Confident	59.5	Low	92 Å²	92	91.6 Å²	91.6	64%	0.643	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.9	176.3	54.5	0	0	0	0	110.5	M434	S419-M434 WeakPolarHBondContact O-CE 3.43Å
420	I	78	Confident	59.3	Low	5 Å²	5	88.8 Å²	88.8	3%	0.026	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.2	-168.9	-60.2	-171.1	0	0	0	109.6	I418 A422 M434 I435	I418-I420 HydrophobicContact CD1-CD1 3.68Å; I418-I420 HydrophobicContact CD1-CG1 3.82Å; I418-I420 HydrophobicContact CG1-CD1 3.96Å; I418-I420 HydrophobicContact CG1-CG1 3.92Å; I420-A422 PolarHBondContact O-N 2.93Å; I420-M434 CarbonylContact O-C 3.58Å; I420-M434 WeakPolarHBondContact O-CA 3.19Å; I420-I435 HydrophobicContact CB-CG1 4.11Å; I420-I435 HydrophobicContact CG2-CG1 4.39Å; I420-I435 PolarHBondContact N-O 3.23Å; I420-I435 WeakPolarHBondContact O-CG1 3.37Å; I420-I435 PolarHBondContact O-N 2.94Å
421	P	74.6	Confident	59.9	Low	78 Å²	78	89.2 Å²	89.2	51%	0.506	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	125	174.8	27.8	-34.1	0	0	0	111.5	T423 M434 R470	P421-T423 PolarHBondContact O-N 2.87Å; P421-M434 HydrophobicContact CB-SD 4.16Å; P421-R470 PolarHBondContact O-NH2 3.41Å
422	A	64.2	Low	60.1	Low	40 Å²	40	90.6 Å²	90.6	33%	0.331	56%	0.556	S	S	.	*			trans	-64.6	112.4	-179	0	0	0	0	0	111.4	I420 V424 G433 I435	I420-A422 PolarHBondContact O-N 2.93Å; A422-V424 PolarHBondContact O-N 3.31Å; A422-G433 WeakPolarHBondContact CB-O 3.3Å; A422-G433 PolarHBondContact N-O 2.78Å; A422-I435 HydrophobicContact CB-CG2 4.1Å
423	T	60.5	Low	60.9	Low	93 Å²	93	89.4 Å²	89.4	57%	0.571	55%	0.55	S	S	*	.			trans	-87	95.6	177.8	39.2	0	0	0	0	110.3	P421 S425 R470	P421-T423 PolarHBondContact O-N 2.87Å; T423-S425 PolarHBondContact O-N 2.85Å; T423-S425 VanDerWaalsContact O-N 3.08Å; T423-R470 PolarHBondContact OG1-NH1 3Å
424	V	47.9	Very low	61.7	Low	93 Å²	93	94 Å²	94	56%	0.564	57%	0.572	S	S	*	*			trans	-65.8	106.1	179.9	-171.2	0	0	0	0	110.6	A422 S426	A422-V424 PolarHBondContact O-N 3.31Å; V424-S426 PolarHBondContact O-N 2.9Å
425	S	49.4	Very low	62.4	Low	112 Å²	112	90.9 Å²	90.9	78%	0.783	56%	0.559	S	S	*	*			trans	-79.3	107.7	172.7	44.6	0	0	0	0	110.8	T423	T423-S425 PolarHBondContact O-N 2.85Å; T423-S425 VanDerWaalsContact O-N 3.08Å
426	S	44.8	Very low	62.5	Low	98 Å²	98	96.2 Å²	96.2	69%	0.685	59%	0.585	S	S	*	*	S	Bend	trans	64.4	113.1	175.6	-78	0	0	0	0	118.3	V424	V424-S426 PolarHBondContact O-N 2.9Å
427	D	40.1	Very low	62.7	Low	145 Å²	145	90.7 Å²	90.7	78%	0.775	56%	0.561	S	S	*	*	S	Bend	trans	61.6	52.6	136.2	-53.7	-23.5	0	0	0	119.8
428	K	45	Very low	63	Low	187 Å²	187	89.6 Å²	89.6	81%	0.813	55%	0.546	S	S	*	.	S	Bend	trans	-160.9	154	133.2	-100.3	138.1	-165.6	174.3	0	113
429	Q	40.5	Very low	63.2	Low	194 Å²	194	89 Å²	89	91%	0.907	54%	0.542	S	S	*	.			trans	-16.1	119.8	-176.8	-73.3	168.9	-34.8	0	0	117.4	S431	Q429-S431 PolarHBondContact O-N 2.83Å
430	A	33.2	Very low	63.6	Low	97 Å²	97	84.8 Å²	84.8	80%	0.802	51%	0.512	S	S	*	.			trans	-73.3	121.3	177.7	0	0	0	0	0	112.8
431	S	43.1	Very low	64.2	Low	102 Å²	102	91.5 Å²	91.5	71%	0.713	54%	0.537	S	S	*	.			trans	-107.7	132.3	147.2	55.2	0	0	0	0	108.1	Q429 G433	Q429-S431 PolarHBondContact O-N 2.83Å; S431-G433 VanDerWaalsContact C-N 3.25Å; S431-G433 PolarHBondContact O-N 3.26Å
432	G	53.9	Low	65	Low	89 Å²	89	88.3 Å²	88.3	92%	0.918	52%	0.515	S	S	*	.			trans	-77.5	67.7	-173.8	0	0	0	0	0	113
433	G	65	Low	66.3	Low	36 Å²	36	94.1 Å²	94.1	37%	0.371	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-69.4	141	176.8	0	0	0	0	0	112.6	A422 S431	A422-G433 WeakPolarHBondContact CB-O 3.3Å; A422-G433 PolarHBondContact N-O 2.78Å; S431-G433 VanDerWaalsContact C-N 3.25Å; S431-G433 PolarHBondContact O-N 3.26Å
434	M	75.8	Confident	67.8	Low	119 Å²	119	89.8 Å²	89.8	59%	0.586	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.5	161.1	-61.5	-68.6	-79.7	0	0	107.9	S419 I420 P421	S419-M434 WeakPolarHBondContact O-CE 3.43Å; I420-M434 CarbonylContact O-C 3.58Å; I420-M434 WeakPolarHBondContact O-CA 3.19Å; P421-M434 HydrophobicContact CB-SD 4.16Å
435	I	79.1	Confident	69.8	Low	64 Å²	64	88.6 Å²	88.6	33%	0.328	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	158.4	167.4	54.5	173.2	0	0	0	110.1	I420 A422 E485	I420-I435 HydrophobicContact CB-CG1 4.11Å; I420-I435 HydrophobicContact CG2-CG1 4.39Å; I420-I435 PolarHBondContact N-O 3.23Å; I420-I435 WeakPolarHBondContact O-CG1 3.37Å; I420-I435 PolarHBondContact O-N 2.94Å; A422-I435 HydrophobicContact CB-CG2 4.1Å; I435-E485 HydrophobicContact CD1-CG 3.98Å
436	I	82.3	Confident	71.6	Confident	127 Å²	127	87.7 Å²	87.7	65%	0.651	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.9	166.3	-56.6	174.7	0	0	0	107.1	P417	P417-I436 HydrophobicContact CB-CG2 4.35Å
437	G	86.9	Confident	73.7	Confident	0 Å²	0	88.8 Å²	88.8	0%	0	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	-165.1	166.1	0	0	0	0	0	110.8	P417 I418 A484	P417-G437 CarbonylContact C-O 3.51Å; P417-G437 WeakPolarHBondContact CA-O 3.32Å; I418-G437 PolarHBondContact N-O 2.88Å; I418-G437 PolarHBondContact O-N 3.39Å; G437-A484 CarbonylContact C-O 3Å; G437-A484 WeakPolarHBondContact CA-O 3.36Å
438	Y	91.2	Very high	76.2	Confident	71 Å²	71	82.1 Å²	82.1	28%	0.278	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	133.8	-170.1	-61.5	-89.8	0	0	0	111.1	C415 K416 A484 I487 C490	C415-Y438 HydrophobicContact CB-CD1 4.12Å; K416-Y438 CarbonylContact O-C 3.43Å; K416-Y438 WeakPolarHBondContact O-CA 3.45Å; Y438-A484 PolarHBondContact N-O 2.86Å; Y438-A484 PolarHBondContact O-N 3.47Å; Y438-I487 HydrophobicContact CD1-CB 4.25Å; Y438-I487 HydrophobicContact CD1-CG1 4.43Å; Y438-I487 HydrophobicContact CD2-CB 4.21Å; Y438-I487 HydrophobicContact CE1-CB 4.35Å; Y438-I487 HydrophobicContact CE1-CD1 4.5Å; Y438-I487 HydrophobicContact CE2-CB 4.34Å; Y438-I487 HydrophobicContact CG-CB 4.18Å; Y438-C490 PolarHBondContact O-SG 3.46Å; Y438-C490 VanDerWaalsContact O-SG 3.4Å
439	E	90.4	Very high	78.4	Confident	28 Å²	28	74.6 Å²	74.6	13%	0.131	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.1	173.1	-164.7	-154.2	125.1	0	0	109.3	C415 K416 I418 R441 H481 V482	C415-E439 CarbonylContact C-O 3.52Å; C415-E439 VanDerWaalsContact CA-O 3.3Å; C415-E439 WeakPolarHBondContact CA-O 3.4Å; K416-E439 HydrophobicContact CB-CB 4.39Å; K416-E439 PolarHBondContact N-O 3.34Å; K416-E439 PolarHBondContact O-N 3.05Å; I418-E439 HydrophobicContact CD1-CB 3.97Å; I418-E439 HydrophobicContact CG1-CB 4.19Å; I418-E439 HydrophobicContact CG2-CB 3.8Å; E439-R441 IonicContact OE1-CZ 2.66Å; E439-R441 IonicContact OE1-NE 3.96Å; E439-R441 PolarHBondContact OE1-NE 2.87Å; E439-R441 IonicContact OE1-NH2 3.65Å; E439-R441 PolarHBondContact OE1-NH2 3.41Å; E439-R441 IonicContact OE2-NH2 2.76Å; E439-H481 IonicContact OE1-CD2 3.35Å; E439-V482 CarbonylContact C-O 3.58Å; E439-V482 VanDerWaalsContact CA-O 3.25Å; E439-V482 WeakPolarHBondContact CA-O 3.38Å
440	C	89.9	Confident	80.8	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.014	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	148	165.9	80.7	0	0	0	0	112.9	V482	C440-V482 PolarHBondContact N-O 2.79Å; C440-V482 PolarHBondContact O-N 2.85Å
441	R	90.6	Very high	83.6	Confident	147 Å²	147	66.6 Å²	66.6	56%	0.555	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	146.1	176.7	-61.2	-174.3	-160.2	-160	-1.6	111.1	E439 V480 H481	E439-R441 IonicContact OE1-CZ 2.66Å; E439-R441 IonicContact OE1-NE 3.96Å; E439-R441 PolarHBondContact OE1-NE 2.87Å; E439-R441 IonicContact OE1-NH2 3.65Å; E439-R441 PolarHBondContact OE1-NH2 3.41Å; E439-R441 IonicContact OE2-NH2 2.76Å; R441-V480 VanDerWaalsContact CA-O 3.27Å; R441-V480 WeakPolarHBondContact CA-O 3.25Å; R441-H481 PolarHBondContact NE-CD2 3.12Å
442	F	91.5	Very high	85.9	Confident	11 Å²	11	61.8 Å²	61.8	5%	0.048	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	154.7	172.1	53.3	-86.3	0	0	0	110.7	I444 V480 V482 R494 L497 D498	F442-I444 HydrophobicContact CD2-CG1 4.32Å; F442-I444 HydrophobicContact CE2-CD1 4.29Å; F442-I444 HydrophobicContact CE2-CG1 4.36Å; F442-V480 HydrophobicContact CD1-CB 4.41Å; F442-V480 HydrophobicContact CD2-CB 4.09Å; F442-V480 HydrophobicContact CD2-CG2 4.06Å; F442-V480 HydrophobicContact CE1-CB 4.01Å; F442-V480 HydrophobicContact CE1-CG1 4.06Å; F442-V480 HydrophobicContact CE2-CB 3.65Å; F442-V480 HydrophobicContact CE2-CG1 4.17Å; F442-V480 HydrophobicContact CE2-CG2 3.5Å; F442-V480 HydrophobicContact CG-CB 4.45Å; F442-V480 HydrophobicContact CZ-CB 3.6Å; F442-V480 HydrophobicContact CZ-CG1 3.64Å; F442-V480 HydrophobicContact CZ-CG2 3.88Å; F442-V480 PolarHBondContact N-O 2.94Å; F442-V480 PolarHBondContact O-N 3.47Å; F442-V482 HydrophobicContact CE1-CG2 3.96Å; F442-R494 HydrophobicContact CD1-CB 4.42Å; F442-R494 HydrophobicContact CD1-CG 3.88Å; F442-R494 HydrophobicContact CE1-CB 3.99Å; F442-R494 HydrophobicContact CE1-CG 3.86Å; F442-R494 HydrophobicContact CG-CG 4.36Å; F442-R494 HydrophobicContact CZ-CB 4.47Å; F442-R494 HydrophobicContact CZ-CG 4.32Å; F442-L497 HydrophobicContact CE2-CB 3.98Å; F442-L497 HydrophobicContact CZ-CB 3.84Å; F442-D498 HydrophobicContact CD2-CB 3.92Å; F442-D498 HydrophobicContact CE2-CB 4Å
443	R	91.2	Very high	87.8	Confident	162 Å²	162	60.6 Å²	60.6	61%	0.611	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.7	-176.9	-165.3	178.6	-174.3	-167.4	3.5	111.4	D477 G478 I479	R443-D477 PolarHBondContact NE-O 3.31Å; R443-G478 WeakPolarHBondContact CA-O 3.36Å; R443-I479 HydrophobicContact CB-CG1 4.44Å; R443-I479 HydrophobicContact CG-CG1 4.17Å
444	I	92.4	Very high	89	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	30%	0.301	C	S	.	.			trans	-102.8	143.7	175	-57.5	173.4	0	0	0	107.8	F442 L448 I449 A452 G478 V480 L497 F499	F442-I444 HydrophobicContact CD2-CG1 4.32Å; F442-I444 HydrophobicContact CE2-CD1 4.29Å; F442-I444 HydrophobicContact CE2-CG1 4.36Å; I444-L448 HydrophobicContact CG2-CB 3.74Å; I444-I449 HydrophobicContact CG2-CG1 4.27Å; I444-A452 HydrophobicContact CD1-CB 3.58Å; I444-G478 PolarHBondContact N-O 3.4Å; I444-V480 HydrophobicContact CD1-CG2 3.5Å; I444-V480 VanDerWaalsContact CD1-CG2 3.5Å; I444-V480 HydrophobicContact CG1-CG2 4.13Å; I444-L497 WeakPolarHBondContact CD1-O 3.29Å; I444-F499 HydrophobicContact CG2-CB 4.15Å
445	L	89	Confident	89.8	Confident	69 Å²	69	59.5 Å²	59.5	36%	0.361	30%	0.299	S	S	.	.			trans	-67.8	141.6	175.7	-67.5	89.1	0	0	0	110.1	H447 L448 I449	L445-H447 VanDerWaalsContact C-N 3.26Å; L445-H447 PolarHBondContact O-N 3.41Å; L445-H447 VanDerWaalsContact O-N 3.08Å; L445-L448 HydrophobicContact CB-CD1 4.15Å; L445-L448 HydrophobicContact CB-CG 4.19Å; L445-L448 HydrophobicContact CD1-CD1 4.03Å; L445-L448 WeakPolarHBondContact O-CA 3.38Å; L445-L448 WeakPolarHBondContact O-CB 3.31Å; L445-L448 PolarHBondContact O-N 2.83Å; L445-I449 PolarHBondContact O-N 3.23Å
446	P	87.5	Confident	90.4	Very high	93 Å²	93	66.9 Å²	66.9	60%	0.604	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-52.4	-37.7	-173.2	-31.6	36.9	0	0	0	115.3	L448 I449	P446-L448 PolarHBondContact O-N 2.88Å; P446-I449 PolarHBondContact O-N 3.26Å
447	H	89.5	Confident	90.9	Very high	121 Å²	121	61.3 Å²	61.3	56%	0.56	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-74.6	-8.1	178	66.6	-76.8	0	0	0	114.7	L445 E501	L445-H447 VanDerWaalsContact C-N 3.26Å; L445-H447 PolarHBondContact O-N 3.41Å; L445-H447 VanDerWaalsContact O-N 3.08Å; H447-E501 IonicContact CD2-OE2 2.66Å; H447-E501 IonicContact CE1-OE2 2.78Å; H447-E501 IonicContact NE2-OE2 3.15Å; H447-E501 PolarHBondContact NE2-OE2 3.35Å
448	L	91.8	Very high	91.2	Very high	5 Å²	5	63.9 Å²	63.9	3%	0.026	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-104.1	-10.7	178	-54.6	-177	0	0	0	113	I444 L445 P446 G450 L451 A452 F499 T500 E501 V610	I444-L448 HydrophobicContact CG2-CB 3.74Å; L445-L448 HydrophobicContact CB-CD1 4.15Å; L445-L448 HydrophobicContact CB-CG 4.19Å; L445-L448 HydrophobicContact CD1-CD1 4.03Å; L445-L448 WeakPolarHBondContact O-CA 3.38Å; L445-L448 WeakPolarHBondContact O-CB 3.31Å; L445-L448 PolarHBondContact O-N 2.83Å; P446-L448 PolarHBondContact O-N 2.88Å; L448-G450 PolarHBondContact O-N 3.13Å; L448-L451 HydrophobicContact CD2-CD1 4.12Å; L448-L451 WeakPolarHBondContact O-CB 3.23Å; L448-L451 PolarHBondContact O-N 2.94Å; L448-A452 PolarHBondContact O-N 3.07Å; L448-F499 HydrophobicContact CB-CB 4.27Å; L448-T500 VanDerWaalsContact CD1-C 3.46Å; L448-E501 HydrophobicContact CD1-CB 4.1Å; L448-V610 HydrophobicContact CD1-CG1 4.42Å; L448-V610 HydrophobicContact CD2-CG1 3.58Å
449	I	91.4	Very high	91.3	Very high	28 Å²	28	61.3 Å²	61.3	14%	0.144	31%	0.31	C	S	.	.	H	α-helix	trans	-54.2	-38.4	179.6	-64.8	177.8	0	0	0	111.4	I444 L445 P446 L451 A452 I453 L474	I444-I449 HydrophobicContact CG2-CG1 4.27Å; L445-I449 PolarHBondContact O-N 3.23Å; P446-I449 PolarHBondContact O-N 3.26Å; I449-L451 PolarHBondContact O-N 3Å; I449-A452 PolarHBondContact O-N 3.06Å; I449-A452 VanDerWaalsContact O-N 3.09Å; I449-I453 HydrophobicContact CG2-CD1 3.96Å; I449-I453 HydrophobicContact CG2-CG1 4.42Å; I449-I453 PolarHBondContact O-N 2.91Å; I449-L474 HydrophobicContact CG2-CD1 4.31Å; I449-L474 HydrophobicContact CG2-CD2 3.97Å; I449-L474 HydrophobicContact CG2-CG 4.41Å
450	G	91.4	Very high	91.5	Very high	52 Å²	52	61.2 Å²	61.2	54%	0.536	31%	0.309	S	S	.	.	H	α-helix	trans	-61	-26.7	176.5	0	0	0	0	0	114.6	L448 G454	L448-G450 PolarHBondContact O-N 3.13Å; G450-G454 PolarHBondContact O-N 2.99Å
451	L	92.1	Very high	91.7	Very high	71 Å²	71	67 Å²	67	37%	0.372	34%	0.337	S	S	.	.	H	α-helix	trans	-76.2	-33.3	174.6	-60.7	176.4	0	0	0	112.1	L448 I449 G454 F499 V610	L448-L451 HydrophobicContact CD2-CD1 4.12Å; L448-L451 WeakPolarHBondContact O-CB 3.23Å; L448-L451 PolarHBondContact O-N 2.94Å; I449-L451 PolarHBondContact O-N 3Å; L451-G454 PolarHBondContact O-N 3.35Å; L451-F499 HydrophobicContact CB-CD1 4Å; L451-F499 HydrophobicContact CB-CD2 4.28Å; L451-F499 HydrophobicContact CB-CE1 4.03Å; L451-F499 HydrophobicContact CB-CE2 4.3Å; L451-F499 HydrophobicContact CB-CG 4.13Å; L451-F499 HydrophobicContact CB-CZ 4.18Å; L451-F499 HydrophobicContact CD1-CD1 4.15Å; L451-F499 HydrophobicContact CD1-CE1 4.47Å; L451-V610 HydrophobicContact CD1-CG1 3.83Å
452	A	91.7	Very high	91.9	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.008	34%	0.336	C	S	.	.	H	α-helix	trans	-74	-36	177.3	0	0	0	0	0	112.3	I444 L448 I449 T459 I460 L497 F499	I444-A452 HydrophobicContact CD1-CB 3.58Å; L448-A452 PolarHBondContact O-N 3.07Å; I449-A452 PolarHBondContact O-N 3.06Å; I449-A452 VanDerWaalsContact O-N 3.09Å; A452-T459 WeakPolarHBondContact O-CB 3.44Å; A452-I460 PolarHBondContact O-N 3.03Å; A452-L497 HydrophobicContact CB-CD2 4.23Å; A452-L497 VanDerWaalsContact O-CD2 3.26Å; A452-L497 WeakPolarHBondContact O-CD2 3.49Å; A452-F499 HydrophobicContact CB-CD2 3.86Å; A452-F499 HydrophobicContact CB-CE2 4.34Å
453	I	92.6	Very high	92	Very high	65 Å²	65	65 Å²	65	33%	0.333	33%	0.334	S	S	.	.	H	α-helix	trans	-66.8	-48	168.7	-63	172.4	0	0	0	109.4	I449 G457 A458 T459 I460 L474	I449-I453 HydrophobicContact CG2-CD1 3.96Å; I449-I453 HydrophobicContact CG2-CG1 4.42Å; I449-I453 PolarHBondContact O-N 2.91Å; I453-G457 CarbonylContact O-C 3.53Å; I453-G457 WeakPolarHBondContact O-CA 3.48Å; I453-A458 PolarHBondContact O-N 3.22Å; I453-T459 PolarHBondContact O-N 2.85Å; I453-T459 VanDerWaalsContact O-N 3.12Å; I453-I460 HydrophobicContact CG2-CG2 4.4Å; I453-I460 PolarHBondContact O-N 3.43Å; I453-L474 HydrophobicContact CD1-CD2 3.88Å; I453-L474 HydrophobicContact CG1-CD2 3.4Å; I453-L474 VanDerWaalsContact CG1-CD2 3.4Å
454	G	91.1	Very high	92.2	Very high	17 Å²	17	63.7 Å²	63.7	18%	0.175	33%	0.329	C	S	.	.			trans	75.4	172.5	-174.4	0	0	0	0	0	112.9	G450 L451 R456 G457	G450-G454 PolarHBondContact O-N 2.99Å; L451-G454 PolarHBondContact O-N 3.35Å; G454-R456 PolarHBondContact O-N 3.49Å; G454-G457 PolarHBondContact O-N 2.96Å
455	H	92	Very high	92.3	Very high	114 Å²	114	66.6 Å²	66.6	53%	0.528	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-58.2	124.2	179.5	-171.1	80.4	0	0	0	110.3	G457 A458	H455-G457 PolarHBondContact O-N 2.84Å; H455-G457 VanDerWaalsContact O-N 3.09Å; H455-A458 WeakPolarHBondContact O-CB 3.45Å; H455-A458 PolarHBondContact O-N 3.17Å
456	R	92.7	Very high	92.5	Very high	219 Å²	219	64.9 Å²	64.9	83%	0.826	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	53.6	22.9	-175.4	-57.5	171.8	-165.3	-143.5	-1.6	115	G454 Q461	G454-R456 PolarHBondContact O-N 3.49Å; R456-Q461 PolarHBondContact O-NE2 3.35Å
457	G	91.7	Very high	92.8	Very high	10 Å²	10	66 Å²	66	10%	0.103	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	80	15.7	-178	0	0	0	0	0	114.9	I453 G454 H455 T459 I460 Q461	I453-G457 CarbonylContact O-C 3.53Å; I453-G457 WeakPolarHBondContact O-CA 3.48Å; G454-G457 PolarHBondContact O-N 2.96Å; H455-G457 PolarHBondContact O-N 2.84Å; H455-G457 VanDerWaalsContact O-N 3.09Å; G457-T459 PolarHBondContact O-N 3.38Å; G457-I460 VanDerWaalsContact O-CG2 3.31Å; G457-I460 WeakPolarHBondContact O-CG2 3.3Å; G457-Q461 WeakPolarHBondContact O-CB 3.47Å; G457-Q461 VanDerWaalsContact O-CG 3.26Å; G457-Q461 WeakPolarHBondContact O-CG 3.12Å; G457-Q461 PolarHBondContact O-N 3.04Å; G457-Q461 PolarHBondContact O-NE2 3.34Å
458	A	94.4	Very high	92.8	Very high	55 Å²	55	61.4 Å²	61.4	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-59.8	-41.6	-176.4	0	0	0	0	0	113.3	I453 H455 Q461 E462	I453-A458 PolarHBondContact O-N 3.22Å; H455-A458 WeakPolarHBondContact O-CB 3.45Å; H455-A458 PolarHBondContact O-N 3.17Å; A458-Q461 PolarHBondContact O-N 3.01Å; A458-E462 WeakPolarHBondContact O-CB 3.31Å; A458-E462 PolarHBondContact O-N 3.12Å
459	T	93.3	Very high	92.8	Very high	17 Å²	17	62.3 Å²	62.3	10%	0.104	35%	0.348	C	S	.	.	H	α-helix	trans	-73.2	-36.4	-175.3	-54.5	0	0	0	0	112.2	A452 I453 G457 A463 L496 L497	A452-T459 WeakPolarHBondContact O-CB 3.44Å; I453-T459 PolarHBondContact O-N 2.85Å; I453-T459 VanDerWaalsContact O-N 3.12Å; G457-T459 PolarHBondContact O-N 3.38Å; T459-A463 PolarHBondContact O-N 3.12Å; T459-L496 HydrophobicContact CG2-CD1 3.96Å; T459-L496 HydrophobicContact CG2-CG 4.01Å; T459-L497 HydrophobicContact CG2-CD2 3.92Å
460	I	93.8	Very high	92.8	Very high	25 Å²	25	64.6 Å²	64.6	13%	0.128	36%	0.355	C	S	.	.	H	α-helix	trans	-75.3	-26.4	172.2	-169.2	166.4	0	0	0	112.6	A452 I453 G457 R464 L474	A452-I460 PolarHBondContact O-N 3.03Å; I453-I460 HydrophobicContact CG2-CG2 4.4Å; I453-I460 PolarHBondContact O-N 3.43Å; G457-I460 VanDerWaalsContact O-CG2 3.31Å; G457-I460 WeakPolarHBondContact O-CG2 3.3Å; I460-R464 VanDerWaalsContact O-CG 3.3Å; I460-R464 WeakPolarHBondContact O-CG 3.43Å; I460-R464 PolarHBondContact O-N 3.49Å; I460-R464 VanDerWaalsContact O-N 3.12Å; I460-L474 HydrophobicContact CD1-CB 3.9Å; I460-L474 HydrophobicContact CD1-CD2 4.09Å
461	Q	94.6	Very high	92.8	Very high	125 Å²	125	63.2 Å²	63.2	58%	0.584	34%	0.338	S	S	*	.	H	α-helix	trans	-70.3	-41.7	169.9	-77.3	168	66.6	0	0	111.9	R456 G457 A458 R464 G465	R456-Q461 PolarHBondContact O-NE2 3.35Å; G457-Q461 WeakPolarHBondContact O-CB 3.47Å; G457-Q461 VanDerWaalsContact O-CG 3.26Å; G457-Q461 WeakPolarHBondContact O-CG 3.12Å; G457-Q461 PolarHBondContact O-N 3.04Å; G457-Q461 PolarHBondContact O-NE2 3.34Å; A458-Q461 PolarHBondContact O-N 3.01Å; Q461-R464 CarbonylContact O-C 3.47Å; Q461-R464 PolarHBondContact O-N 3.39Å; Q461-G465 PolarHBondContact O-N 3.18Å
462	E	94.5	Very high	92.9	Very high	116 Å²	116	59.9 Å²	59.9	54%	0.542	32%	0.321	S	S	.	.	H	α-helix	trans	-57.7	-47.5	171.9	-177.3	-176.8	-174.8	0	0	110.7	A458 R464 G465 I466 L496	A458-E462 WeakPolarHBondContact O-CB 3.31Å; A458-E462 PolarHBondContact O-N 3.12Å; E462-R464 VanDerWaalsContact C-N 3.31Å; E462-R464 PolarHBondContact O-N 3.4Å; E462-G465 WeakPolarHBondContact O-CA 3.49Å; E462-G465 PolarHBondContact O-N 3.26Å; E462-I466 PolarHBondContact O-N 2.84Å; E462-L496 HydrophobicContact CB-CD2 4.03Å; E462-L496 HydrophobicContact CG-CD2 3.71Å
463	A	94.5	Very high	93	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.4	-38.7	175.2	0	0	0	0	0	113.6	T459 G465 V493 L496 L497	T459-A463 PolarHBondContact O-N 3.12Å; A463-G465 VanDerWaalsContact C-N 3.27Å; A463-G465 PolarHBondContact O-N 3.34Å; A463-V493 HydrophobicContact CB-CG1 4.29Å; A463-L496 HydrophobicContact CB-CD2 3.95Å; A463-L497 HydrophobicContact CB-CD1 3.69Å; A463-L497 HydrophobicContact CB-CD2 4.26Å; A463-L497 HydrophobicContact CB-CG 3.98Å
464	R	95.3	Very high	92.9	Very high	134 Å²	134	62.3 Å²	62.3	51%	0.506	33%	0.334	S	S	.	.	H	α-helix	trans	-75.5	-11.4	175.1	-72.3	172.8	170.7	-159.8	-7.4	113.7	I460 Q461 E462 V472 D473	I460-R464 VanDerWaalsContact O-CG 3.3Å; I460-R464 WeakPolarHBondContact O-CG 3.43Å; I460-R464 PolarHBondContact O-N 3.49Å; I460-R464 VanDerWaalsContact O-N 3.12Å; Q461-R464 CarbonylContact O-C 3.47Å; Q461-R464 PolarHBondContact O-N 3.39Å; E462-R464 VanDerWaalsContact C-N 3.31Å; E462-R464 PolarHBondContact O-N 3.4Å; R464-V472 HydrophobicContact CG-CB 3.78Å; R464-V472 HydrophobicContact CG-CG2 3.99Å; R464-V472 PolarHBondContact NE-O 3.09Å; R464-V472 PolarHBondContact NH2-O 3.27Å; R464-D473 IonicContact NH2-OD1 3.62Å; R464-D473 PolarHBondContact NH2-OD1 3.23Å
465	G	93.6	Very high	92.8	Very high	62 Å²	62	65.3 Å²	65.3	64%	0.639	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-2.5	176.8	0	0	0	0	0	114.7	Q461 E462 A463	Q461-G465 PolarHBondContact O-N 3.18Å; E462-G465 WeakPolarHBondContact O-CA 3.49Å; E462-G465 PolarHBondContact O-N 3.26Å; A463-G465 VanDerWaalsContact C-N 3.27Å; A463-G465 PolarHBondContact O-N 3.34Å
466	I	93.5	Very high	92.2	Very high	33 Å²	33	69.1 Å²	69.1	17%	0.169	36%	0.361	C	S	.	.	S	Bend	trans	-69.1	131	178.9	-67	170.2	0	0	0	109.5	E462 G468 V469 A489 A492 V493	E462-I466 PolarHBondContact O-N 2.84Å; I466-G468 PolarHBondContact O-N 3.45Å; I466-V469 HydrophobicContact CB-CG2 3.69Å; I466-V469 HydrophobicContact CG2-CG2 3.73Å; I466-V469 WeakPolarHBondContact O-CB 3.46Å; I466-V469 WeakPolarHBondContact O-CG2 3.22Å; I466-V469 PolarHBondContact O-N 3.22Å; I466-V469 VanDerWaalsContact O-N 3.16Å; I466-A489 HydrophobicContact CG2-CB 4.42Å; I466-A492 HydrophobicContact CD1-CB 3.97Å; I466-A492 HydrophobicContact CG2-CB 3.98Å; I466-V493 HydrophobicContact CD1-CG2 3.89Å
467	P	92.6	Very high	91.7	Very high	115 Å²	115	61.3 Å²	61.3	75%	0.747	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	138	-178.8	25.8	-34.8	0	0	0	111.6	V469	P467-V469 VanDerWaalsContact C-N 3.28Å; P467-V469 PolarHBondContact O-N 3.4Å
468	G	89.8	Confident	91.4	Very high	26 Å²	26	60.9 Å²	60.9	27%	0.268	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-7.7	-175.9	0	0	0	0	0	114.8	I466 A484 E485	I466-G468 PolarHBondContact O-N 3.45Å; G468-A484 CarbonylContact O-C 3.27Å; G468-A484 VanDerWaalsContact O-CA 3.25Å; G468-A484 WeakPolarHBondContact O-CA 3.26Å; G468-A484 WeakPolarHBondContact O-CB 3.3Å; G468-E485 PolarHBondContact O-N 2.93Å
469	V	92.8	Very high	91.2	Very high	23 Å²	23	60.6 Å²	60.6	14%	0.139	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	137.5	171.2	-178.8	0	0	0	0	110.2	I466 P467 V472 A484 A489 V493	I466-V469 HydrophobicContact CB-CG2 3.69Å; I466-V469 HydrophobicContact CG2-CG2 3.73Å; I466-V469 WeakPolarHBondContact O-CB 3.46Å; I466-V469 WeakPolarHBondContact O-CG2 3.22Å; I466-V469 PolarHBondContact O-N 3.22Å; I466-V469 VanDerWaalsContact O-N 3.16Å; P467-V469 VanDerWaalsContact C-N 3.28Å; P467-V469 PolarHBondContact O-N 3.4Å; V469-V472 HydrophobicContact CG1-CG2 3.41Å; V469-V472 VanDerWaalsContact CG1-CG2 3.41Å; V469-A484 HydrophobicContact CG2-CB 4.46Å; V469-A489 HydrophobicContact CG2-CB 3.87Å; V469-V493 HydrophobicContact CG1-CG2 4.15Å; V469-V493 HydrophobicContact CG2-CG2 3.51Å
470	R	90.2	Very high	91.2	Very high	77 Å²	77	59.9 Å²	59.9	29%	0.291	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-41.6	-179.3	-63.4	178.9	66.1	99.2	-10	112.7	P421 T423 E483 E485	P421-R470 PolarHBondContact O-NH2 3.41Å; T423-R470 PolarHBondContact OG1-NH1 3Å; R470-E483 PolarHBondContact N-O 3.07Å; R470-E485 WeakPolarHBondContact CD-OE1 3.44Å; R470-E485 HydrophobicContact CG-CG 4.01Å; R470-E485 IonicContact CZ-OE1 2.88Å; R470-E485 IonicContact NE-OE1 2.79Å; R470-E485 IonicContact NH1-OE1 3.27Å; R470-E485 PolarHBondContact NH1-OE1 3.17Å
471	A	92.5	Very high	91.1	Very high	23 Å²	23	60.6 Å²	60.6	19%	0.19	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	143.1	175.9	0	0	0	0	0	110.9	V482 E483	A471-V482 WeakPolarHBondContact O-CA 3.15Å; A471-E483 HydrophobicContact CB-CB 4.11Å; A471-E483 HydrophobicContact CB-CG 4.33Å; A471-E483 PolarHBondContact N-O 3.41Å; A471-E483 VanDerWaalsContact N-O 3.17Å; A471-E483 PolarHBondContact O-N 2.83Å
472	V	94.3	Very high	91	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	105.2	168.8	-175	0	0	0	0	106.9	R464 V469 V480 H481 V482 V493 L497	R464-V472 HydrophobicContact CG-CB 3.78Å; R464-V472 HydrophobicContact CG-CG2 3.99Å; R464-V472 PolarHBondContact NE-O 3.09Å; R464-V472 PolarHBondContact NH2-O 3.27Å; V469-V472 HydrophobicContact CG1-CG2 3.41Å; V469-V472 VanDerWaalsContact CG1-CG2 3.41Å; V472-V480 HydrophobicContact CG1-CG1 4.17Å; V472-H481 CarbonylContact C-O 3.1Å; V472-H481 WeakPolarHBondContact CA-O 3.48Å; V472-V482 HydrophobicContact CG1-CG2 4.5Å; V472-V482 HydrophobicContact CG2-CG1 4.43Å; V472-V493 HydrophobicContact CG1-CG1 3.98Å; V472-V493 HydrophobicContact CG2-CG1 4.08Å; V472-V493 HydrophobicContact CG2-CG2 4.12Å; V472-L497 HydrophobicContact CG1-CD1 3.75Å
473	D	93.1	Very high	91	Very high	73 Å²	73	51.9 Å²	51.9	39%	0.39	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.5	-179.4	-71.5	-42.8	0	0	0	111.3	R464 V480 H481	R464-D473 IonicContact NH2-OD1 3.62Å; R464-D473 PolarHBondContact NH2-OD1 3.23Å; D473-V480 CarbonylContact O-C 3.31Å; D473-V480 WeakPolarHBondContact O-CA 3.33Å; D473-H481 PolarHBondContact N-O 3.22Å; D473-H481 PolarHBondContact O-N 3.31Å; D473-H481 IonicContact OD2-CE1 3.79Å
474	L	91.5	Very high	90.9	Very high	44 Å²	44	51.9 Å²	51.9	23%	0.23	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	108.8	-171.8	172.3	65.1	0	0	0	108.2	I449 I453 I460 V480	I449-L474 HydrophobicContact CG2-CD1 4.31Å; I449-L474 HydrophobicContact CG2-CD2 3.97Å; I449-L474 HydrophobicContact CG2-CG 4.41Å; I453-L474 HydrophobicContact CD1-CD2 3.88Å; I453-L474 HydrophobicContact CG1-CD2 3.4Å; I453-L474 VanDerWaalsContact CG1-CD2 3.4Å; I460-L474 HydrophobicContact CD1-CB 3.9Å; I460-L474 HydrophobicContact CD1-CD2 4.09Å; L474-V480 HydrophobicContact CD1-CG2 3.84Å
475	L	88	Confident	90.6	Very high	79 Å²	79	48.6 Å²	48.6	41%	0.414	27%	0.27	S	S	.	.			trans	-81.6	155	-179	-67.4	167.5	0	0	0	111.2	D477 G478 I479	L475-D477 WeakPolarHBondContact CB-OD1 3.35Å; L475-D477 PolarHBondContact O-N 3Å; L475-G478 PolarHBondContact O-N 2.87Å; L475-G478 VanDerWaalsContact O-N 3.12Å; L475-I479 HydrophobicContact CB-CB 4.36Å; L475-I479 WeakPolarHBondContact CB-O 3.44Å; L475-I479 HydrophobicContact CD1-CB 4.08Å; L475-I479 HydrophobicContact CD1-CG2 4.2Å; L475-I479 PolarHBondContact N-O 3.03Å
476	F	79	Confident	90.5	Very high	194 Å²	194	48.5 Å²	48.5	85%	0.851	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.3	-175.8	56.3	-96.5	0	0	0	114.1	G478	F476-G478 VanDerWaalsContact C-N 3.32Å
477	D	82.5	Confident	90.3	Very high	56 Å²	56	49.6 Å²	49.6	30%	0.299	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-0.6	175.3	62.5	-0.2	0	0	0	113.7	R443 L475 I479	R443-D477 PolarHBondContact NE-O 3.31Å; L475-D477 WeakPolarHBondContact CB-OD1 3.35Å; L475-D477 PolarHBondContact O-N 3Å; D477-I479 WeakPolarHBondContact OD1-CB 3.48Å; D477-I479 WeakPolarHBondContact OD1-CG1 3.44Å; D477-I479 PolarHBondContact OD1-N 3.06Å; D477-I479 WeakPolarHBondContact OD2-CD1 3.39Å
478	G	85.7	Confident	90.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	90.5	3.9	-177.2	0	0	0	0	0	115	R443 I444 L475 F476	R443-G478 WeakPolarHBondContact CA-O 3.36Å; I444-G478 PolarHBondContact N-O 3.4Å; L475-G478 PolarHBondContact O-N 2.87Å; L475-G478 VanDerWaalsContact O-N 3.12Å; F476-G478 VanDerWaalsContact C-N 3.32Å
479	I	90.3	Very high	90.4	Very high	50 Å²	50	50.1 Å²	50.1	26%	0.256	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	124.2	176.8	-61.3	179.2	0	0	0	110.2	R443 L475 D477	R443-I479 HydrophobicContact CB-CG1 4.44Å; R443-I479 HydrophobicContact CG-CG1 4.17Å; L475-I479 HydrophobicContact CB-CB 4.36Å; L475-I479 WeakPolarHBondContact CB-O 3.44Å; L475-I479 HydrophobicContact CD1-CB 4.08Å; L475-I479 HydrophobicContact CD1-CG2 4.2Å; L475-I479 PolarHBondContact N-O 3.03Å; D477-I479 WeakPolarHBondContact OD1-CB 3.48Å; D477-I479 WeakPolarHBondContact OD1-CG1 3.44Å; D477-I479 PolarHBondContact OD1-N 3.06Å; D477-I479 WeakPolarHBondContact OD2-CD1 3.39Å
480	V	92.3	Very high	90.4	Very high	2 Å²	2	49 Å²	49	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	135.6	165.7	-170.7	0	0	0	0	109	R441 F442 I444 V472 D473 L474 V482 L497	R441-V480 VanDerWaalsContact CA-O 3.27Å; R441-V480 WeakPolarHBondContact CA-O 3.25Å; F442-V480 HydrophobicContact CD1-CB 4.41Å; F442-V480 HydrophobicContact CD2-CB 4.09Å; F442-V480 HydrophobicContact CD2-CG2 4.06Å; F442-V480 HydrophobicContact CE1-CB 4.01Å; F442-V480 HydrophobicContact CE1-CG1 4.06Å; F442-V480 HydrophobicContact CE2-CB 3.65Å; F442-V480 HydrophobicContact CE2-CG1 4.17Å; F442-V480 HydrophobicContact CE2-CG2 3.5Å; F442-V480 HydrophobicContact CG-CB 4.45Å; F442-V480 HydrophobicContact CZ-CB 3.6Å; F442-V480 HydrophobicContact CZ-CG1 3.64Å; F442-V480 HydrophobicContact CZ-CG2 3.88Å; F442-V480 PolarHBondContact N-O 2.94Å; F442-V480 PolarHBondContact O-N 3.47Å; I444-V480 HydrophobicContact CD1-CG2 3.5Å; I444-V480 VanDerWaalsContact CD1-CG2 3.5Å; I444-V480 HydrophobicContact CG1-CG2 4.13Å; V472-V480 HydrophobicContact CG1-CG1 4.17Å; D473-V480 CarbonylContact O-C 3.31Å; D473-V480 WeakPolarHBondContact O-CA 3.33Å; L474-V480 HydrophobicContact CD1-CG2 3.84Å; V480-V482 HydrophobicContact CG1-CG2 3.92Å; V480-L497 HydrophobicContact CG1-CD1 4.34Å
481	H	92.6	Very high	90.5	Very high	40 Å²	40	47.7 Å²	47.7	19%	0.185	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.7	171.2	179.8	-118.9	0	0	0	109	E439 R441 V472 D473 E483	E439-H481 IonicContact OE1-CD2 3.35Å; R441-H481 PolarHBondContact NE-CD2 3.12Å; V472-H481 CarbonylContact C-O 3.1Å; V472-H481 WeakPolarHBondContact CA-O 3.48Å; D473-H481 PolarHBondContact N-O 3.22Å; D473-H481 PolarHBondContact O-N 3.31Å; D473-H481 IonicContact OD2-CE1 3.79Å; H481-E483 VanDerWaalsContact NE2-CG 3.31Å; H481-E483 WeakPolarHBondContact NE2-CG 3.31Å; H481-E483 IonicContact NE2-OE1 2.88Å; H481-E483 PolarHBondContact NE2-OE1 2.68Å
482	V	93.2	Very high	90.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127	-177.2	-173.2	0	0	0	0	109.2	E439 C440 F442 A471 V472 V480 V493	E439-V482 CarbonylContact C-O 3.58Å; E439-V482 VanDerWaalsContact CA-O 3.25Å; E439-V482 WeakPolarHBondContact CA-O 3.38Å; C440-V482 PolarHBondContact N-O 2.79Å; C440-V482 PolarHBondContact O-N 2.85Å; F442-V482 HydrophobicContact CE1-CG2 3.96Å; A471-V482 WeakPolarHBondContact O-CA 3.15Å; V472-V482 HydrophobicContact CG1-CG2 4.5Å; V472-V482 HydrophobicContact CG2-CG1 4.43Å; V480-V482 HydrophobicContact CG1-CG2 3.92Å; V482-V493 HydrophobicContact CB-CG1 4.41Å; V482-V493 HydrophobicContact CG1-CB 3.97Å; V482-V493 HydrophobicContact CG1-CG1 3.92Å; V482-V493 HydrophobicContact CG1-CG2 4Å; V482-V493 HydrophobicContact CG2-CB 4.33Å; V482-V493 HydrophobicContact CG2-CG1 3.54Å
483	E	92.8	Very high	90.5	Very high	57 Å²	57	48.3 Å²	48.3	27%	0.266	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.8	168.8	-62.3	179	-173.3	0	0	109.4	I418 R470 A471 H481	I418-E483 HydrophobicContact CD1-CB 4.36Å; I418-E483 HydrophobicContact CD1-CG 4.1Å; R470-E483 PolarHBondContact N-O 3.07Å; A471-E483 HydrophobicContact CB-CB 4.11Å; A471-E483 HydrophobicContact CB-CG 4.33Å; A471-E483 PolarHBondContact N-O 3.41Å; A471-E483 VanDerWaalsContact N-O 3.17Å; A471-E483 PolarHBondContact O-N 2.83Å; H481-E483 VanDerWaalsContact NE2-CG 3.31Å; H481-E483 WeakPolarHBondContact NE2-CG 3.31Å; H481-E483 IonicContact NE2-OE1 2.88Å; H481-E483 PolarHBondContact NE2-OE1 2.68Å
484	A	92.2	Very high	90.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	162.3	177.6	0	0	0	0	0	112.4	G437 Y438 G468 V469 A489	G437-A484 CarbonylContact C-O 3Å; G437-A484 WeakPolarHBondContact CA-O 3.36Å; Y438-A484 PolarHBondContact N-O 2.86Å; Y438-A484 PolarHBondContact O-N 3.47Å; G468-A484 CarbonylContact O-C 3.27Å; G468-A484 VanDerWaalsContact O-CA 3.25Å; G468-A484 WeakPolarHBondContact O-CA 3.26Å; G468-A484 WeakPolarHBondContact O-CB 3.3Å; V469-A484 HydrophobicContact CG2-CB 4.46Å; A484-A489 HydrophobicContact CB-CB 3.74Å
485	E	90.7	Very high	90.5	Very high	66 Å²	66	46.8 Å²	46.8	31%	0.308	24%	0.236	S	C	.	.	S	Bend	trans	-83.6	-23.3	177.9	-61.8	176.3	176.8	0	0	111.7	I435 G468 R470	I435-E485 HydrophobicContact CD1-CG 3.98Å; G468-E485 PolarHBondContact O-N 2.93Å; R470-E485 WeakPolarHBondContact CD-OE1 3.44Å; R470-E485 HydrophobicContact CG-CG 4.01Å; R470-E485 IonicContact CZ-OE1 2.88Å; R470-E485 IonicContact NE-OE1 2.79Å; R470-E485 IonicContact NH1-OE1 3.27Å; R470-E485 PolarHBondContact NH1-OE1 3.17Å
486	T	90.1	Very high	90.8	Very high	60 Å²	60	44.6 Å²	44.6	37%	0.368	22%	0.224	S	C	.	.	S	Bend	trans	-124.8	149.8	176.3	70.6	0	0	0	0	111.7	E488 A489 C490	T486-E488 PolarHBondContact O-N 2.93Å; T486-A489 PolarHBondContact O-N 2.69Å; T486-A489 WeakPolarHBondContact OG1-CB 3.18Å; T486-A489 PolarHBondContact OG1-N 2.92Å; T486-C490 PolarHBondContact O-N 2.85Å
487	I	90.3	Very high	91.5	Very high	56 Å²	56	35.4 Å²	35.4	29%	0.287	18%	0.184	S	C	.	.	H	α-helix	trans	-62.5	-35.1	174.3	-164	168.3	0	0	0	111.3	C415 Y438 A489 C490 H491	C415-I487 HydrophobicContact CB-CD1 3.98Å; C415-I487 HydrophobicContact CB-CG1 3.9Å; Y438-I487 HydrophobicContact CD1-CB 4.25Å; Y438-I487 HydrophobicContact CD1-CG1 4.43Å; Y438-I487 HydrophobicContact CD2-CB 4.21Å; Y438-I487 HydrophobicContact CE1-CB 4.35Å; Y438-I487 HydrophobicContact CE1-CD1 4.5Å; Y438-I487 HydrophobicContact CE2-CB 4.34Å; Y438-I487 HydrophobicContact CG-CB 4.18Å; I487-A489 PolarHBondContact O-N 3Å; I487-C490 WeakPolarHBondContact O-CB 3.39Å; I487-C490 PolarHBondContact O-N 3.5Å; I487-H491 PolarHBondContact O-CD2 3Å; I487-H491 PolarHBondContact O-N 2.99Å
488	E	91.8	Very high	91.9	Very high	149 Å²	149	32.9 Å²	32.9	70%	0.696	17%	0.17	S	C	*	.	H	α-helix	trans	-60.3	-42.1	177	-60.1	-175.9	157.7	0	0	112.6	T486 H491 A492	T486-E488 PolarHBondContact O-N 2.93Å; E488-H491 PolarHBondContact O-N 2.88Å; E488-A492 WeakPolarHBondContact O-CB 3.46Å; E488-A492 PolarHBondContact O-N 3.28Å
489	A	92.8	Very high	92.3	Very high	3 Å²	3	33 Å²	33	3%	0.025	17%	0.171	C	C	.	.	H	α-helix	trans	-64.5	-41.2	176.3	0	0	0	0	0	111.6	I466 V469 A484 T486 I487 A492 V493	I466-A489 HydrophobicContact CG2-CB 4.42Å; V469-A489 HydrophobicContact CG2-CB 3.87Å; A484-A489 HydrophobicContact CB-CB 3.74Å; T486-A489 PolarHBondContact O-N 2.69Å; T486-A489 WeakPolarHBondContact OG1-CB 3.18Å; T486-A489 PolarHBondContact OG1-N 2.92Å; I487-A489 PolarHBondContact O-N 3Å; A489-A492 PolarHBondContact O-N 3.27Å; A489-V493 WeakPolarHBondContact O-CG2 3.45Å; A489-V493 PolarHBondContact O-N 3.45Å
490	C	92.5	Very high	92.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.9	-44	170.2	-92.1	0	0	0	0	112.5	Y438 T486 I487 A492 R494	Y438-C490 PolarHBondContact O-SG 3.46Å; Y438-C490 VanDerWaalsContact O-SG 3.4Å; T486-C490 PolarHBondContact O-N 2.85Å; I487-C490 WeakPolarHBondContact O-CB 3.39Å; I487-C490 PolarHBondContact O-N 3.5Å; C490-A492 PolarHBondContact O-N 2.69Å; C490-R494 WeakPolarHBondContact O-CB 3.12Å; C490-R494 PolarHBondContact O-N 2.83Å
491	H	92.1	Very high	92.4	Very high	48 Å²	48	32.9 Å²	32.9	22%	0.222	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-38.8	174.2	-78.1	-76.8	0	0	0	112.6	I413 I487 E488 R494 N495	I413-H491 WeakPolarHBondContact CD1-ND1 3.26Å; I487-H491 PolarHBondContact O-CD2 3Å; I487-H491 PolarHBondContact O-N 2.99Å; E488-H491 PolarHBondContact O-N 2.88Å; H491-R494 PolarHBondContact O-N 2.96Å; H491-N495 WeakPolarHBondContact O-CB 3.44Å; H491-N495 VanDerWaalsContact O-CG 3.29Å; H491-N495 PolarHBondContact O-N 3.4Å; H491-N495 PolarHBondContact O-ND2 2.95Å; H491-N495 VanDerWaalsContact O-ND2 3.12Å
492	A	93.2	Very high	92.3	Very high	37 Å²	37	33.2 Å²	33.2	31%	0.306	18%	0.175	S	C	.	.	H	α-helix	trans	-65.6	-47.8	179.1	0	0	0	0	0	111.9	I466 E488 A489 C490 R494 N495 L496	I466-A492 HydrophobicContact CD1-CB 3.97Å; I466-A492 HydrophobicContact CG2-CB 3.98Å; E488-A492 WeakPolarHBondContact O-CB 3.46Å; E488-A492 PolarHBondContact O-N 3.28Å; A489-A492 PolarHBondContact O-N 3.27Å; C490-A492 PolarHBondContact O-N 2.69Å; A492-R494 VanDerWaalsContact C-N 3.31Å; A492-R494 PolarHBondContact O-N 3.45Å; A492-N495 PolarHBondContact O-N 3.23Å; A492-L496 PolarHBondContact O-N 3.04Å
493	V	94.1	Very high	92.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.1	-45.7	172.6	174.5	0	0	0	0	110.7	A463 I466 V469 V472 V482 A489 N495 L496 L497	A463-V493 HydrophobicContact CB-CG1 4.29Å; I466-V493 HydrophobicContact CD1-CG2 3.89Å; V469-V493 HydrophobicContact CG1-CG2 4.15Å; V469-V493 HydrophobicContact CG2-CG2 3.51Å; V472-V493 HydrophobicContact CG1-CG1 3.98Å; V472-V493 HydrophobicContact CG2-CG1 4.08Å; V472-V493 HydrophobicContact CG2-CG2 4.12Å; V482-V493 HydrophobicContact CB-CG1 4.41Å; V482-V493 HydrophobicContact CG1-CB 3.97Å; V482-V493 HydrophobicContact CG1-CG1 3.92Å; V482-V493 HydrophobicContact CG1-CG2 4Å; V482-V493 HydrophobicContact CG2-CB 4.33Å; V482-V493 HydrophobicContact CG2-CG1 3.54Å; A489-V493 WeakPolarHBondContact O-CG2 3.45Å; A489-V493 PolarHBondContact O-N 3.45Å; V493-N495 PolarHBondContact O-N 3.13Å; V493-L496 PolarHBondContact O-N 2.98Å; V493-L497 HydrophobicContact CG1-CD1 3.88Å; V493-L497 HydrophobicContact CG1-CG 4.41Å; V493-L497 WeakPolarHBondContact O-CB 3.14Å; V493-L497 PolarHBondContact O-N 3.29Å
494	R	92.7	Very high	92	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-64.5	-39.5	179.7	-170	173.1	-179	141.8	9.6	112.7	F442 C490 H491 A492 L496 L497 D498	F442-R494 HydrophobicContact CD1-CB 4.42Å; F442-R494 HydrophobicContact CD1-CG 3.88Å; F442-R494 HydrophobicContact CE1-CB 3.99Å; F442-R494 HydrophobicContact CE1-CG 3.86Å; F442-R494 HydrophobicContact CG-CG 4.36Å; F442-R494 HydrophobicContact CZ-CB 4.47Å; F442-R494 HydrophobicContact CZ-CG 4.32Å; C490-R494 WeakPolarHBondContact O-CB 3.12Å; C490-R494 PolarHBondContact O-N 2.83Å; H491-R494 PolarHBondContact O-N 2.96Å; A492-R494 VanDerWaalsContact C-N 3.31Å; A492-R494 PolarHBondContact O-N 3.45Å; R494-L496 PolarHBondContact O-N 3.01Å; R494-L497 PolarHBondContact O-N 3.08Å; R494-D498 HydrophobicContact CG-CB 3.8Å; R494-D498 IonicContact CZ-OD2 3.78Å; R494-D498 VanDerWaalsContact CZ-OD2 3.27Å; R494-D498 IonicContact NE-OD2 2.74Å; R494-D498 PolarHBondContact NE-OD2 3.14Å; R494-D498 IonicContact NH2-OD2 2.73Å; R494-D498 PolarHBondContact NH2-OD2 2.91Å; R494-D498 WeakPolarHBondContact O-CB 3.35Å; R494-D498 PolarHBondContact O-N 2.92Å
495	N	92.5	Very high	91.8	Very high	79 Å²	79	37.6 Å²	37.6	42%	0.422	20%	0.203	S	C	.	.	H	α-helix	trans	-64.8	-27.2	177	-80.4	-38	0	0	0	113	H491 A492 V493 T612	H491-N495 WeakPolarHBondContact O-CB 3.44Å; H491-N495 VanDerWaalsContact O-CG 3.29Å; H491-N495 PolarHBondContact O-N 3.4Å; H491-N495 PolarHBondContact O-ND2 2.95Å; H491-N495 VanDerWaalsContact O-ND2 3.12Å; A492-N495 PolarHBondContact O-N 3.23Å; V493-N495 PolarHBondContact O-N 3.13Å; N495-T612 VanDerWaalsContact O-CB 3.3Å; N495-T612 WeakPolarHBondContact O-CB 3.36Å; N495-T612 WeakPolarHBondContact O-CG2 3.23Å; N495-T612 PolarHBondContact O-OG1 2.74Å; N495-T612 VanDerWaalsContact O-OG1 3.1Å
496	L	92.8	Very high	91.7	Very high	32 Å²	32	35.4 Å²	35.4	17%	0.168	19%	0.194	C	C	.	.	H	α-helix	trans	-85.2	-34.3	176.1	-175.1	58.4	0	0	0	113.3	T459 E462 A463 A492 V493 R494 F499 T612	T459-L496 HydrophobicContact CG2-CD1 3.96Å; T459-L496 HydrophobicContact CG2-CG 4.01Å; E462-L496 HydrophobicContact CB-CD2 4.03Å; E462-L496 HydrophobicContact CG-CD2 3.71Å; A463-L496 HydrophobicContact CB-CD2 3.95Å; A492-L496 PolarHBondContact O-N 3.04Å; V493-L496 PolarHBondContact O-N 2.98Å; R494-L496 PolarHBondContact O-N 3.01Å; L496-F499 VanDerWaalsContact O-CE2 3.24Å; L496-F499 WeakPolarHBondContact O-CE2 3.25Å; L496-T612 WeakPolarHBondContact O-CG2 3.36Å
497	L	93.5	Very high	91.5	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-113.4	-16.5	-168.7	-62.1	-173	0	0	0	117.1	F442 I444 A452 T459 A463 V472 V480 V493 R494 F499	F442-L497 HydrophobicContact CE2-CB 3.98Å; F442-L497 HydrophobicContact CZ-CB 3.84Å; I444-L497 WeakPolarHBondContact CD1-O 3.29Å; A452-L497 HydrophobicContact CB-CD2 4.23Å; A452-L497 VanDerWaalsContact O-CD2 3.26Å; A452-L497 WeakPolarHBondContact O-CD2 3.49Å; T459-L497 HydrophobicContact CG2-CD2 3.92Å; A463-L497 HydrophobicContact CB-CD1 3.69Å; A463-L497 HydrophobicContact CB-CD2 4.26Å; A463-L497 HydrophobicContact CB-CG 3.98Å; V472-L497 HydrophobicContact CG1-CD1 3.75Å; V480-L497 HydrophobicContact CG1-CD1 4.34Å; V493-L497 HydrophobicContact CG1-CD1 3.88Å; V493-L497 HydrophobicContact CG1-CG 4.41Å; V493-L497 WeakPolarHBondContact O-CB 3.14Å; V493-L497 PolarHBondContact O-N 3.29Å; R494-L497 PolarHBondContact O-N 3.08Å; L497-F499 WeakPolarHBondContact O-CD2 3.18Å; L497-F499 PolarHBondContact O-N 3.49Å
498	D	92.6	Very high	91.3	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.016	20%	0.204	C	C	.	.			trans	-72.3	66.1	-179.2	-173	-8.8	0	0	0	111.2	F442 R494 T612 R613	F442-D498 HydrophobicContact CD2-CB 3.92Å; F442-D498 HydrophobicContact CE2-CB 4Å; R494-D498 HydrophobicContact CG-CB 3.8Å; R494-D498 IonicContact CZ-OD2 3.78Å; R494-D498 VanDerWaalsContact CZ-OD2 3.27Å; R494-D498 IonicContact NE-OD2 2.74Å; R494-D498 PolarHBondContact NE-OD2 3.14Å; R494-D498 IonicContact NH2-OD2 2.73Å; R494-D498 PolarHBondContact NH2-OD2 2.91Å; R494-D498 WeakPolarHBondContact O-CB 3.35Å; R494-D498 PolarHBondContact O-N 2.92Å; D498-T612 CarbonylContact O-C 3.46Å; D498-T612 VanDerWaalsContact O-CA 3.29Å; D498-T612 WeakPolarHBondContact O-CA 3.34Å; D498-R613 HydrophobicContact CB-CB 4.27Å; D498-R613 PolarHBondContact O-N 2.91Å; D498-R613 IonicContact OD1-CZ 2.69Å; D498-R613 IonicContact OD1-NE 2.68Å; D498-R613 PolarHBondContact OD1-NE 2.98Å; D498-R613 IonicContact OD1-NH2 3.66Å; D498-R613 PolarHBondContact OD1-NH2 2.74Å; D498-R613 WeakPolarHBondContact OD2-CD 3.28Å; D498-R613 IonicContact OD2-NE 2.65Å; D498-R613 PolarHBondContact OD2-NE 3.16Å
499	F	93.6	Very high	91	Very high	2 Å²	2	39 Å²	39	1%	0.009	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.8	-179.2	-80.5	-81.9	0	0	0	111.8	I444 L448 L451 A452 L496 L497 R532 G611 T612	I444-F499 HydrophobicContact CG2-CB 4.15Å; L448-F499 HydrophobicContact CB-CB 4.27Å; L451-F499 HydrophobicContact CB-CD1 4Å; L451-F499 HydrophobicContact CB-CD2 4.28Å; L451-F499 HydrophobicContact CB-CE1 4.03Å; L451-F499 HydrophobicContact CB-CE2 4.3Å; L451-F499 HydrophobicContact CB-CG 4.13Å; L451-F499 HydrophobicContact CB-CZ 4.18Å; L451-F499 HydrophobicContact CD1-CD1 4.15Å; L451-F499 HydrophobicContact CD1-CE1 4.47Å; A452-F499 HydrophobicContact CB-CD2 3.86Å; A452-F499 HydrophobicContact CB-CE2 4.34Å; L496-F499 VanDerWaalsContact O-CE2 3.24Å; L496-F499 WeakPolarHBondContact O-CE2 3.25Å; L497-F499 WeakPolarHBondContact O-CD2 3.18Å; L497-F499 PolarHBondContact O-N 3.49Å; F499-R532 HydrophobicContact CE1-CG 4.03Å; F499-G611 WeakPolarHBondContact CA-O 3.45Å; F499-T612 HydrophobicContact CD1-CG2 4.18Å; F499-T612 HydrophobicContact CD2-CG2 4.36Å; F499-T612 HydrophobicContact CE1-CG2 3.83Å; F499-T612 HydrophobicContact CE2-CG2 4.03Å; F499-T612 HydrophobicContact CG-CG2 4.43Å; F499-T612 HydrophobicContact CZ-CG2 3.75Å
500	T	92.9	Very high	90.8	Very high	12 Å²	12	39.1 Å²	39.1	7%	0.074	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	159.1	-179.1	-167.6	0	0	0	0	111.3	L448 V502 G611 R613 V616	L448-T500 VanDerWaalsContact CD1-C 3.46Å; T500-V502 HydrophobicContact CG2-CG2 4.24Å; T500-G611 PolarHBondContact N-O 2.9Å; T500-G611 PolarHBondContact O-N 3.23Å; T500-R613 HydrophobicContact CG2-CB 4.15Å; T500-R613 HydrophobicContact CG2-CG 4.39Å; T500-V616 HydrophobicContact CG2-CB 4.26Å; T500-V616 HydrophobicContact CG2-CG2 4.08Å
501	E	91.2	Very high	90.6	Very high	38 Å²	38	39.4 Å²	39.4	18%	0.178	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.8	170.7	176.5	168.2	-168	0	0	109.1	H447 L448 R545 S608 L609 V610	H447-E501 IonicContact CD2-OE2 2.66Å; H447-E501 IonicContact CE1-OE2 2.78Å; H447-E501 IonicContact NE2-OE2 3.15Å; H447-E501 PolarHBondContact NE2-OE2 3.35Å; L448-E501 HydrophobicContact CD1-CB 4.1Å; E501-R545 IonicContact OE1-CZ 3.76Å; E501-R545 IonicContact OE1-NH1 3.69Å; E501-R545 PolarHBondContact OE1-NH1 2.94Å; E501-R545 IonicContact OE1-NH2 3.71Å; E501-R545 PolarHBondContact OE1-NH2 3.03Å; E501-R545 IonicContact OE2-NH2 3.84Å; E501-S608 PolarHBondContact OE1-OG 3.17Å; E501-L609 VanDerWaalsContact CA-O 3.29Å; E501-L609 WeakPolarHBondContact CA-O 3.42Å; E501-V610 HydrophobicContact CB-CG2 4.13Å; E501-V610 HydrophobicContact CG-CG2 3.91Å
502	V	91.4	Very high	90.4	Very high	47 Å²	47	39.8 Å²	39.8	29%	0.285	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	137.8	-177.6	179.8	0	0	0	0	109.8	T500 I504 L609 V616	T500-V502 HydrophobicContact CG2-CG2 4.24Å; V502-I504 HydrophobicContact CG1-CG1 4.2Å; V502-L609 PolarHBondContact N-O 3.03Å; V502-L609 PolarHBondContact O-N 3.23Å; V502-V616 HydrophobicContact CB-CG1 3.88Å; V502-V616 HydrophobicContact CG2-CG1 3.77Å
503	E	90.1	Very high	90.1	Very high	52 Å²	52	41.5 Å²	41.5	24%	0.243	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	108.7	174.9	-65.9	-170.6	-179.3	0	0	111.3	L537 R542 R545 A606 F607	E503-L537 HydrophobicContact CG-CD1 3.88Å; E503-L537 WeakPolarHBondContact OE1-CD1 3.3Å; E503-R542 WeakPolarHBondContact OE2-CG 3.38Å; E503-R545 WeakPolarHBondContact OE1-CD 3.45Å; E503-R545 IonicContact OE1-CZ 3.81Å; E503-R545 IonicContact OE1-NE 3.39Å; E503-R545 IonicContact OE1-NH1 3.87Å; E503-R545 PolarHBondContact OE1-NH1 3.11Å; E503-A606 HydrophobicContact CB-CB 4.39Å; E503-F607 WeakPolarHBondContact CA-O 3.25Å
504	I	88.8	Confident	90	Very high	12 Å²	12	41.6 Å²	41.6	6%	0.062	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	116.1	-179.8	-57.2	177.9	0	0	0	109.5	V502 A606 F607 L609 R620 L623	V502-I504 HydrophobicContact CG1-CG1 4.2Å; I504-A606 CarbonylContact O-C 3.57Å; I504-A606 WeakPolarHBondContact O-CA 3.37Å; I504-A606 WeakPolarHBondContact O-CB 3.48Å; I504-F607 PolarHBondContact N-O 3.32Å; I504-F607 PolarHBondContact O-N 3.41Å; I504-L609 HydrophobicContact CD1-CD1 3.54Å; I504-L609 HydrophobicContact CD1-CG 4.48Å; I504-L609 HydrophobicContact CG1-CD1 4.37Å; I504-R620 HydrophobicContact CD1-CB 3.63Å; I504-R620 HydrophobicContact CD1-CG 3.79Å; I504-L623 HydrophobicContact CD1-CD1 4.33Å
505	P	88.8	Confident	89.8	Confident	85 Å²	85	42 Å²	42	55%	0.552	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	140.7	175.8	30	-34.5	0	0	0	111.6
506	V	88.2	Confident	89.6	Confident	19 Å²	19	39.4 Å²	39.4	12%	0.115	21%	0.206	C	C	.	.			trans	-138.4	143.4	-179.2	172	0	0	0	0	109.9	L510 A511 L514 P605 F607	V506-L510 HydrophobicContact CG1-CB 4.22Å; V506-A511 HydrophobicContact CG1-CB 4.17Å; V506-L514 HydrophobicContact CG1-CD1 3.67Å; V506-P605 PolarHBondContact N-O 2.91Å; V506-P605 WeakPolarHBondContact O-CD 3.27Å; V506-P605 WeakPolarHBondContact O-CG 3.36Å; V506-F607 HydrophobicContact CB-CE2 4.46Å; V506-F607 HydrophobicContact CG1-CE2 4.43Å; V506-F607 HydrophobicContact CG2-CD2 3.73Å; V506-F607 HydrophobicContact CG2-CE2 3.91Å
507	Q	86.5	Confident	89.3	Confident	108 Å²	108	42.7 Å²	42.7	51%	0.505	23%	0.232	S	C	.	.			trans	-64.2	137.5	176.8	-60.1	-173.9	15.2	0	0	111.2	R509 L510 A511	Q507-R509 PolarHBondContact O-N 3.05Å; Q507-R509 VanDerWaalsContact O-N 3.12Å; Q507-L510 HydrophobicContact CB-CD1 4.25Å; Q507-L510 HydrophobicContact CB-CG 4.29Å; Q507-L510 HydrophobicContact CG-CD1 4.45Å; Q507-L510 PolarHBondContact O-N 2.91Å; Q507-A511 PolarHBondContact O-N 3.15Å; Q507-A511 VanDerWaalsContact O-N 3.13Å
508	P	84.9	Confident	89	Confident	58 Å²	58	52 Å²	52	38%	0.377	27%	0.272	S	S	.	.	H	α-helix	trans	-52.8	-37.7	-179.3	-27.7	33.3	0	0	0	114.5	L510 P605	P508-L510 VanDerWaalsContact C-N 3.32Å; P508-L510 PolarHBondContact O-N 2.86Å; P508-P605 HydrophobicContact CG-CG 4.31Å
509	R	85.4	Confident	88.7	Confident	174 Å²	174	52 Å²	52	66%	0.657	27%	0.273	S	S	*	.	H	α-helix	trans	-61	-35.3	176.8	-75.6	175.3	60	164.3	-4.1	113.6	Q507 S512 D634	Q507-R509 PolarHBondContact O-N 3.05Å; Q507-R509 VanDerWaalsContact O-N 3.12Å; R509-S512 PolarHBondContact O-OG 2.91Å; R509-D634 IonicContact CZ-OD2 3.52Å; R509-D634 IonicContact NH2-OD2 3.88Å; R509-D634 PolarHBondContact NH2-OD2 2.88Å
510	L	88.8	Confident	88.5	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-89.8	-29	-175.1	-60.9	178.1	0	0	0	112.2	V506 Q507 P508 S512 R513 L514 A627 W630	V506-L510 HydrophobicContact CG1-CB 4.22Å; Q507-L510 HydrophobicContact CB-CD1 4.25Å; Q507-L510 HydrophobicContact CB-CG 4.29Å; Q507-L510 HydrophobicContact CG-CD1 4.45Å; Q507-L510 PolarHBondContact O-N 2.91Å; P508-L510 VanDerWaalsContact C-N 3.32Å; P508-L510 PolarHBondContact O-N 2.86Å; L510-S512 VanDerWaalsContact C-N 3.28Å; L510-S512 PolarHBondContact O-N 2.96Å; L510-R513 PolarHBondContact O-N 3.4Å; L510-L514 HydrophobicContact CB-CD1 4.05Å; L510-L514 WeakPolarHBondContact O-CB 3.45Å; L510-L514 WeakPolarHBondContact O-CG 3.39Å; L510-L514 PolarHBondContact O-N 2.9Å; L510-A627 HydrophobicContact CD1-CB 4.08Å; L510-W630 HydrophobicContact CD2-CB 3.82Å
511	A	88.7	Confident	88.4	Confident	6 Å²	6	57.5 Å²	57.5	5%	0.05	30%	0.301	C	S	.	.	H	α-helix	trans	-54.3	-41.7	-177.2	0	0	0	0	0	113	V506 Q507 I515 L536 P605	V506-A511 HydrophobicContact CG1-CB 4.17Å; Q507-A511 PolarHBondContact O-N 3.15Å; Q507-A511 VanDerWaalsContact O-N 3.13Å; A511-I515 WeakPolarHBondContact O-CB 3.39Å; A511-I515 VanDerWaalsContact O-CG1 3.25Å; A511-I515 WeakPolarHBondContact O-CG1 3.49Å; A511-I515 PolarHBondContact O-N 3.45Å; A511-L536 HydrophobicContact CB-CD1 4.22Å; A511-P605 HydrophobicContact CB-CG 4.48Å
512	S	87	Confident	88.4	Confident	56 Å²	56	56 Å²	56	39%	0.392	29%	0.294	S	S	.	.	H	α-helix	trans	-66	-39.7	177.3	59	0	0	0	0	113	R509 L510 G516	R509-S512 PolarHBondContact O-OG 2.91Å; L510-S512 VanDerWaalsContact C-N 3.28Å; L510-S512 PolarHBondContact O-N 2.96Å; S512-G516 PolarHBondContact O-N 3.34Å
513	R	88.5	Confident	88.4	Confident	73 Å²	73	58.4 Å²	58.4	28%	0.275	30%	0.298	S	S	.	.	H	α-helix	trans	-70.9	-38.5	176.9	-61.1	-174.7	177.3	176.1	-1.8	112.6	L510 G516 N521 W630 D634	L510-R513 PolarHBondContact O-N 3.4Å; R513-G516 PolarHBondContact O-N 3.26Å; R513-N521 PolarHBondContact O-ND2 3.18Å; R513-W630 HydrophobicContact CB-CD2 4.07Å; R513-W630 HydrophobicContact CB-CG 4.26Å; R513-W630 HydrophobicContact CB-CZ2 4.11Å; R513-W630 HydrophobicContact CG-CD2 4.45Å; R513-W630 PolarHBondContact NH1-O 3.15Å; R513-D634 IonicContact CZ-OD1 2.78Å; R513-D634 IonicContact NH1-OD1 2.84Å; R513-D634 PolarHBondContact NH1-OD1 2.73Å; R513-D634 IonicContact NH1-OD2 3.95Å; R513-D634 IonicContact NH2-OD1 2.72Å; R513-D634 PolarHBondContact NH2-OD1 3.31Å; R513-D634 IonicContact NH2-OD2 3.19Å
514	L	90.1	Very high	88.5	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-69	-35.6	176.5	-70.8	164.9	0	0	0	112.2	V506 L510 N521 I522 F607 L623 Q626 A627	V506-L514 HydrophobicContact CG1-CD1 3.67Å; L510-L514 HydrophobicContact CB-CD1 4.05Å; L510-L514 WeakPolarHBondContact O-CB 3.45Å; L510-L514 WeakPolarHBondContact O-CG 3.39Å; L510-L514 PolarHBondContact O-N 2.9Å; L514-N521 WeakPolarHBondContact O-CB 3.48Å; L514-I522 PolarHBondContact O-N 3.46Å; L514-F607 HydrophobicContact CB-CE2 4.2Å; L514-F607 HydrophobicContact CB-CZ 4.11Å; L514-F607 HydrophobicContact CD1-CE2 4.28Å; L514-L623 HydrophobicContact CD2-CD2 4.24Å; L514-Q626 HydrophobicContact CD2-CB 3.76Å; L514-Q626 HydrophobicContact CD2-CG 3.6Å; L514-A627 HydrophobicContact CD1-CB 4.43Å
515	I	89.9	Confident	88.7	Confident	16 Å²	16	62.3 Å²	62.3	8%	0.082	31%	0.314	C	S	.	.	H	α-helix	trans	-68.8	-45.7	169.4	-69	170.3	0	0	0	110.6	A511 G519 N521 I522 L536 V585 F607	A511-I515 WeakPolarHBondContact O-CB 3.39Å; A511-I515 VanDerWaalsContact O-CG1 3.25Å; A511-I515 WeakPolarHBondContact O-CG1 3.49Å; A511-I515 PolarHBondContact O-N 3.45Å; I515-G519 CarbonylContact O-C 3.54Å; I515-G519 VanDerWaalsContact O-C 3.31Å; I515-G519 VanDerWaalsContact O-CA 3.31Å; I515-G519 WeakPolarHBondContact O-CA 3.48Å; I515-N521 WeakPolarHBondContact O-CB 3.05Å; I515-N521 PolarHBondContact O-N 3.39Å; I515-N521 VanDerWaalsContact O-N 3.09Å; I515-I522 HydrophobicContact CB-CG2 4.35Å; I515-I522 HydrophobicContact CG1-CG2 4.35Å; I515-I522 HydrophobicContact CG2-CG2 4.18Å; I515-I522 PolarHBondContact O-N 2.86Å; I515-L536 HydrophobicContact CD1-CB 4.11Å; I515-L536 HydrophobicContact CD1-CD1 4.39Å; I515-L536 HydrophobicContact CD1-CD2 3.92Å; I515-L536 HydrophobicContact CD1-CG 4.35Å; I515-V585 HydrophobicContact CD1-CG1 4.37Å; I515-V585 HydrophobicContact CD1-CG2 4.38Å; I515-V585 HydrophobicContact CG2-CG2 4.34Å; I515-F607 HydrophobicContact CD1-CE1 4.31Å; I515-F607 HydrophobicContact CD1-CZ 4.5Å; I515-F607 HydrophobicContact CG1-CE1 3.86Å; I515-F607 HydrophobicContact CG1-CZ 3.92Å
516	G	87.7	Confident	88.9	Confident	24 Å²	24	58.9 Å²	58.9	25%	0.247	29%	0.293	C	S	.	.			trans	69.7	177.6	-176.8	0	0	0	0	0	113.1	S512 R513 K518 G519	S512-G516 PolarHBondContact O-N 3.34Å; R513-G516 PolarHBondContact O-N 3.26Å; G516-K518 PolarHBondContact O-N 2.96Å; G516-G519 PolarHBondContact O-N 2.65Å; G516-G519 VanDerWaalsContact O-N 3.14Å
517	S	87.8	Confident	89.1	Confident	101 Å²	101	64.1 Å²	64.1	71%	0.706	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-58.8	125.5	-178.2	54.5	0	0	0	0	111.5	G519 M520	S517-G519 PolarHBondContact O-N 3.03Å; S517-G519 VanDerWaalsContact O-N 3.1Å; S517-M520 WeakPolarHBondContact O-CB 3.5Å; S517-M520 PolarHBondContact O-N 2.85Å
518	K	85.4	Confident	89.4	Confident	197 Å²	197	62.3 Å²	62.3	86%	0.857	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	55.3	24	-178.4	-53.1	177.2	-178.4	175.9	0	114.8	G516 M520	G516-K518 PolarHBondContact O-N 2.96Å; K518-M520 VanDerWaalsContact C-N 3.26Å; K518-M520 PolarHBondContact O-N 3.44Å
519	G	86.7	Confident	89.7	Confident	3 Å²	3	59.7 Å²	59.7	3%	0.031	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	72	15.7	-175.3	0	0	0	0	0	114.6	I515 G516 S517 N521 I522 R523	I515-G519 CarbonylContact O-C 3.54Å; I515-G519 VanDerWaalsContact O-C 3.31Å; I515-G519 VanDerWaalsContact O-CA 3.31Å; I515-G519 WeakPolarHBondContact O-CA 3.48Å; G516-G519 PolarHBondContact O-N 2.65Å; G516-G519 VanDerWaalsContact O-N 3.14Å; S517-G519 PolarHBondContact O-N 3.03Å; S517-G519 VanDerWaalsContact O-N 3.1Å; G519-N521 VanDerWaalsContact C-N 3.32Å; G519-N521 PolarHBondContact O-N 3.17Å; G519-I522 WeakPolarHBondContact O-CG2 3.42Å; G519-R523 VanDerWaalsContact O-CB 3.3Å; G519-R523 WeakPolarHBondContact O-CB 3.37Å; G519-R523 PolarHBondContact O-N 3.36Å
520	M	89.7	Confident	90	Very high	90 Å²	90	53.6 Å²	53.6	44%	0.443	29%	0.294	S	S	.	.	H	α-helix	trans	-63.2	-35.8	-177.5	-177.4	62.3	71.8	0	0	112.7	S517 K518 K524	S517-M520 WeakPolarHBondContact O-CB 3.5Å; S517-M520 PolarHBondContact O-N 2.85Å; K518-M520 VanDerWaalsContact C-N 3.26Å; K518-M520 PolarHBondContact O-N 3.44Å; M520-K524 WeakPolarHBondContact O-CG 3.5Å; M520-K524 PolarHBondContact O-N 2.99Å; M520-K524 VanDerWaalsContact O-N 3.16Å
521	N	91.2	Very high	90.2	Very high	40 Å²	40	53.8 Å²	53.8	21%	0.214	30%	0.296	C	S	.	.	H	α-helix	trans	-74.5	-53.6	-176.9	-163.5	21.8	0	0	0	110.5	R513 L514 I515 G519 R523 K524 L525	R513-N521 PolarHBondContact O-ND2 3.18Å; L514-N521 WeakPolarHBondContact O-CB 3.48Å; I515-N521 WeakPolarHBondContact O-CB 3.05Å; I515-N521 PolarHBondContact O-N 3.39Å; I515-N521 VanDerWaalsContact O-N 3.09Å; G519-N521 VanDerWaalsContact C-N 3.32Å; G519-N521 PolarHBondContact O-N 3.17Å; N521-R523 PolarHBondContact O-N 3.48Å; N521-K524 PolarHBondContact O-N 3.23Å; N521-K524 VanDerWaalsContact O-N 3.13Å; N521-L525 WeakPolarHBondContact O-CG 3.36Å; N521-L525 PolarHBondContact O-N 3.49Å
522	I	91.5	Very high	90.2	Very high	6 Å²	6	61.7 Å²	61.7	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-59.3	-33	176.5	-171	70.1	0	0	0	112.7	L514 I515 G519 A526 A534 L583 F607 M619 L623	L514-I522 PolarHBondContact O-N 3.46Å; I515-I522 HydrophobicContact CB-CG2 4.35Å; I515-I522 HydrophobicContact CG1-CG2 4.35Å; I515-I522 HydrophobicContact CG2-CG2 4.18Å; I515-I522 PolarHBondContact O-N 2.86Å; G519-I522 WeakPolarHBondContact O-CG2 3.42Å; I522-A526 VanDerWaalsContact O-CB 3.3Å; I522-A526 WeakPolarHBondContact O-CB 3.3Å; I522-A526 PolarHBondContact O-N 2.69Å; I522-A534 HydrophobicContact CD1-CB 4.41Å; I522-A534 HydrophobicContact CG1-CB 4.19Å; I522-L583 HydrophobicContact CG2-CD1 3.86Å; I522-F607 HydrophobicContact CD1-CD1 3.98Å; I522-F607 HydrophobicContact CD1-CE1 3.69Å; I522-F607 HydrophobicContact CD1-CZ 4.04Å; I522-F607 HydrophobicContact CG1-CD1 4.47Å; I522-F607 HydrophobicContact CG1-CE1 4.05Å; I522-M619 HydrophobicContact CD1-CE 3.4Å; I522-M619 HydrophobicContact CG1-CE 4.35Å; I522-L623 HydrophobicContact CD1-CD2 3.97Å
523	R	91.6	Very high	90.4	Very high	99 Å²	99	65 Å²	65	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-64.8	-52.3	173.2	-173.6	-177.3	-59.9	129.6	8.1	111.6	G519 N521 L525 A526 E527	G519-R523 VanDerWaalsContact O-CB 3.3Å; G519-R523 WeakPolarHBondContact O-CB 3.37Å; G519-R523 PolarHBondContact O-N 3.36Å; N521-R523 PolarHBondContact O-N 3.48Å; R523-L525 VanDerWaalsContact C-N 3.28Å; R523-L525 PolarHBondContact O-N 2.99Å; R523-A526 PolarHBondContact O-N 3.45Å; R523-A526 VanDerWaalsContact O-N 3.14Å; R523-E527 VanDerWaalsContact CD-OE1 3.25Å; R523-E527 WeakPolarHBondContact CD-OE1 3.25Å; R523-E527 HydrophobicContact CG-CG 4.25Å; R523-E527 WeakPolarHBondContact CG-OE1 3.4Å; R523-E527 WeakPolarHBondContact O-CB 3.41Å; R523-E527 WeakPolarHBondContact O-CG 3.41Å; R523-E527 PolarHBondContact O-N 2.84Å
524	K	92.2	Very high	90.5	Very high	125 Å²	125	62.3 Å²	62.3	54%	0.543	32%	0.321	S	S	.	.	H	α-helix	trans	-57.2	-41.3	177.3	-76.3	-179.2	174.2	-167	0	112.3	M520 N521 A528	M520-K524 WeakPolarHBondContact O-CG 3.5Å; M520-K524 PolarHBondContact O-N 2.99Å; M520-K524 VanDerWaalsContact O-N 3.16Å; N521-K524 PolarHBondContact O-N 3.23Å; N521-K524 VanDerWaalsContact O-N 3.13Å; K524-A528 VanDerWaalsContact O-CB 3.3Å; K524-A528 WeakPolarHBondContact O-CB 3.25Å; K524-A528 PolarHBondContact O-N 3.22Å
525	L	92.7	Very high	90.5	Very high	21 Å²	21	66 Å²	66	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-65.3	-43.6	176.4	-65.5	176.3	0	0	0	111.6	N521 R523 A528 A529 M619 L622 L623	N521-L525 WeakPolarHBondContact O-CG 3.36Å; N521-L525 PolarHBondContact O-N 3.49Å; R523-L525 VanDerWaalsContact C-N 3.28Å; R523-L525 PolarHBondContact O-N 2.99Å; L525-A528 PolarHBondContact O-N 2.86Å; L525-A529 WeakPolarHBondContact O-CB 3.34Å; L525-A529 PolarHBondContact O-N 3.25Å; L525-M619 VanDerWaalsContact C-SD 3.54Å; L525-M619 HydrophobicContact CB-CE 3.8Å; L525-M619 HydrophobicContact CB-SD 3.98Å; L525-L622 HydrophobicContact CD2-CB 4.37Å; L525-L623 HydrophobicContact CD1-CD2 4.32Å
526	A	92.4	Very high	90.5	Very high	13 Å²	13	66.5 Å²	66.5	11%	0.107	34%	0.34	C	S	.	.	H	α-helix	trans	-66.4	-39.2	177	0	0	0	0	0	112.9	I522 R523 A529 G530 V531 A534 M619	I522-A526 VanDerWaalsContact O-CB 3.3Å; I522-A526 WeakPolarHBondContact O-CB 3.3Å; I522-A526 PolarHBondContact O-N 2.69Å; R523-A526 PolarHBondContact O-N 3.45Å; R523-A526 VanDerWaalsContact O-N 3.14Å; A526-A529 PolarHBondContact O-N 3.1Å; A526-G530 PolarHBondContact O-N 3Å; A526-V531 PolarHBondContact O-N 3.03Å; A526-A534 HydrophobicContact CB-CB 4.36Å; A526-M619 HydrophobicContact CB-CE 4.19Å
527	E	92.2	Very high	90.4	Very high	129 Å²	129	66.4 Å²	66.4	60%	0.603	33%	0.334	S	S	*	.	H	α-helix	trans	-62.4	-49.5	173.7	-74	165.7	174.6	0	0	111	R523 A529 G530	R523-E527 VanDerWaalsContact CD-OE1 3.25Å; R523-E527 WeakPolarHBondContact CD-OE1 3.25Å; R523-E527 HydrophobicContact CG-CG 4.25Å; R523-E527 WeakPolarHBondContact CG-OE1 3.4Å; R523-E527 WeakPolarHBondContact O-CB 3.41Å; R523-E527 WeakPolarHBondContact O-CG 3.41Å; R523-E527 PolarHBondContact O-N 2.84Å; E527-A529 VanDerWaalsContact C-N 3.28Å; E527-A529 PolarHBondContact O-N 2.89Å; E527-G530 PolarHBondContact O-N 2.73Å
528	A	92.2	Very high	90.2	Very high	69 Å²	69	65.6 Å²	65.6	57%	0.57	32%	0.321	S	S	*	.	H	α-helix	trans	-64.9	-29.9	175.5	0	0	0	0	0	113.1	K524 L525	K524-A528 VanDerWaalsContact O-CB 3.3Å; K524-A528 WeakPolarHBondContact O-CB 3.25Å; K524-A528 PolarHBondContact O-N 3.22Å; L525-A528 PolarHBondContact O-N 2.86Å
529	A	92.9	Very high	89.9	Confident	3 Å²	3	57.4 Å²	57.4	3%	0.025	29%	0.289	C	S	.	.	H	α-helix	trans	-77.8	-28.4	176.1	0	0	0	0	0	113.8	L525 A526 E527 V531 S615 K618 M619 L622	L525-A529 WeakPolarHBondContact O-CB 3.34Å; L525-A529 PolarHBondContact O-N 3.25Å; A526-A529 PolarHBondContact O-N 3.1Å; E527-A529 VanDerWaalsContact C-N 3.28Å; E527-A529 PolarHBondContact O-N 2.89Å; A529-V531 HydrophobicContact CB-CG2 3.95Å; A529-S615 WeakPolarHBondContact O-CA 3.16Å; A529-S615 VanDerWaalsContact O-CB 3.31Å; A529-S615 WeakPolarHBondContact O-CB 3.42Å; A529-K618 HydrophobicContact CB-CD 4.5Å; A529-M619 HydrophobicContact CB-CB 3.63Å; A529-M619 HydrophobicContact CB-CG 4.22Å; A529-M619 HydrophobicContact CB-SD 3.71Å; A529-L622 HydrophobicContact CB-CD1 4.23Å
530	G	91.7	Very high	89.6	Confident	46 Å²	46	63.5 Å²	63.5	47%	0.474	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	20.1	-169.4	0	0	0	0	0	114.2	A526 E527 S615	A526-G530 PolarHBondContact O-N 3Å; E527-G530 PolarHBondContact O-N 2.73Å; G530-S615 WeakPolarHBondContact O-CB 3.35Å
531	V	92.7	Very high	89.1	Confident	12 Å²	12	60.8 Å²	60.8	7%	0.073	31%	0.306	C	S	.	.			trans	-80.6	130.2	-178	168.7	0	0	0	0	110.4	A526 A529 R533 L609 V610 S615 V616 M619	A526-V531 PolarHBondContact O-N 3.03Å; A529-V531 HydrophobicContact CB-CG2 3.95Å; V531-R533 VanDerWaalsContact CG1-O 3.3Å; V531-R533 WeakPolarHBondContact CG1-O 3.34Å; V531-L609 HydrophobicContact CG1-CB 4.41Å; V531-V610 WeakPolarHBondContact CG1-O 3.31Å; V531-S615 VanDerWaalsContact CG2-O 3.31Å; V531-S615 WeakPolarHBondContact CG2-O 3.36Å; V531-V616 HydrophobicContact CG2-CG2 4.42Å; V531-M619 HydrophobicContact CG2-CB 3.61Å; V531-M619 HydrophobicContact CG2-CG 4.08Å
532	R	89.4	Confident	88.7	Confident	171 Å²	171	60.2 Å²	60.2	65%	0.645	30%	0.301	S	S	*	.	S	Bend	trans	-71.9	-29.7	-175.2	-63.2	-63.5	-170.4	169.4	1	113.4	F499 V610	F499-R532 HydrophobicContact CE1-CG 4.03Å; R532-V610 WeakPolarHBondContact CB-O 3.37Å; R532-V610 PolarHBondContact N-O 2.9Å
533	R	89.9	Confident	88.1	Confident	127 Å²	127	62.8 Å²	62.8	48%	0.479	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	128.9	179.7	-177.5	-177.6	-72.3	169.4	-4.8	110.4	V531 K535 L609 V610	V531-R533 VanDerWaalsContact CG1-O 3.3Å; V531-R533 WeakPolarHBondContact CG1-O 3.34Å; R533-K535 HydrophobicContact CG-CD 4.32Å; R533-K535 HydrophobicContact CG-CG 4.07Å; R533-L609 CarbonylContact O-C 3.43Å; R533-L609 WeakPolarHBondContact O-CA 3.39Å; R533-V610 HydrophobicContact CB-CB 4.12Å; R533-V610 HydrophobicContact CB-CG2 4.4Å; R533-V610 PolarHBondContact N-O 3.2Å; R533-V610 PolarHBondContact O-N 3.47Å
534	A	91.6	Very high	87.6	Confident	15 Å²	15	67.3 Å²	67.3	12%	0.124	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	118.9	167.2	0	0	0	0	0	108.5	I522 A526 S608 L609	I522-A534 HydrophobicContact CD1-CB 4.41Å; I522-A534 HydrophobicContact CG1-CB 4.19Å; A526-A534 HydrophobicContact CB-CB 4.36Å; A534-S608 WeakPolarHBondContact CA-O 3.49Å; A534-L609 HydrophobicContact CB-CD2 3.64Å
535	K	88.8	Confident	86.9	Confident	79 Å²	79	65.7 Å²	65.7	34%	0.343	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	134.9	177.6	-68.3	-170.6	176.6	-171.4	0	109.6	R533 E581 S608	R533-K535 HydrophobicContact CG-CD 4.32Å; R533-K535 HydrophobicContact CG-CG 4.07Å; K535-E581 IonicContact NZ-OE2 3.68Å; K535-E581 PolarHBondContact NZ-OE2 3.44Å; K535-S608 PolarHBondContact N-O 3.25Å; K535-S608 PolarHBondContact O-N 3.21Å
536	L	89.6	Confident	86.3	Confident	26 Å²	26	68.2 Å²	68.2	14%	0.136	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	129	169.9	-166.1	81	0	0	0	108.7	A511 I515 V585 P605 A606 F607	A511-L536 HydrophobicContact CB-CD1 4.22Å; I515-L536 HydrophobicContact CD1-CB 4.11Å; I515-L536 HydrophobicContact CD1-CD1 4.39Å; I515-L536 HydrophobicContact CD1-CD2 3.92Å; I515-L536 HydrophobicContact CD1-CG 4.35Å; L536-V585 HydrophobicContact CB-CG1 4.44Å; L536-P605 HydrophobicContact CD1-CB 4.35Å; L536-P605 HydrophobicContact CG-CB 4.49Å; L536-A606 CarbonylContact C-O 3.52Å; L536-A606 WeakPolarHBondContact CA-O 3.41Å; L536-F607 HydrophobicContact CB-CD1 4.42Å; L536-F607 HydrophobicContact CB-CE1 4.3Å; L536-F607 HydrophobicContact CD1-CD1 3.93Å; L536-F607 HydrophobicContact CD1-CD2 4.48Å; L536-F607 HydrophobicContact CD1-CE1 3.69Å; L536-F607 HydrophobicContact CD1-CE2 4.27Å; L536-F607 HydrophobicContact CD1-CG 4.32Å; L536-F607 HydrophobicContact CD1-CZ 3.87Å
537	L	86.5	Confident	85.6	Confident	22 Å²	22	72.6 Å²	72.6	12%	0.115	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	118.6	169.2	-72.4	169.7	0	0	0	108.9	E503 A541 P605 A606	E503-L537 HydrophobicContact CG-CD1 3.88Å; E503-L537 WeakPolarHBondContact OE1-CD1 3.3Å; L537-A541 HydrophobicContact CD2-CB 3.96Å; L537-P605 WeakPolarHBondContact O-CA 3.45Å; L537-A606 PolarHBondContact N-O 3.43Å; L537-A606 PolarHBondContact O-N 2.92Å
538	D	82.6	Confident	84.9	Confident	84 Å²	84	69.4 Å²	69.4	45%	0.449	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-63.9	156	168.7	-58.8	-52.3	0	0	0	111.1	F540 A541 R542	D538-F540 PolarHBondContact O-N 2.75Å; D538-F540 VanDerWaalsContact O-N 3.12Å; D538-A541 HydrophobicContact CB-CB 4.45Å; D538-A541 WeakPolarHBondContact O-CA 3.29Å; D538-A541 WeakPolarHBondContact O-CB 3.42Å; D538-A541 PolarHBondContact O-N 3.47Å; D538-R542 PolarHBondContact O-N 3.25Å
539	P	80.3	Confident	83.8	Confident	26 Å²	26	72.9 Å²	72.9	17%	0.169	35%	0.352	C	S	.	.	H	α-helix	trans	-48.4	-41.7	175.8	-32	38.9	0	0	0	113.8	K543 L603	P539-K543 WeakPolarHBondContact O-CB 3.41Å; P539-K543 PolarHBondContact O-N 3.03Å; P539-L603 HydrophobicContact CB-CB 3.96Å; P539-L603 WeakPolarHBondContact CB-O 3.26Å; P539-L603 WeakPolarHBondContact CG-O 3.24Å
540	F	79.2	Confident	82.5	Confident	130 Å²	130	83.3 Å²	83.3	57%	0.57	39%	0.391	S	S	*	.	H	α-helix	trans	-67.6	-38	177	-63.2	-88.3	0	0	0	113.2	D538 R544 I600	D538-F540 PolarHBondContact O-N 2.75Å; D538-F540 VanDerWaalsContact O-N 3.12Å; F540-R544 WeakPolarHBondContact O-CB 3.42Å; F540-R544 PolarHBondContact O-N 3.38Å; F540-I600 HydrophobicContact CD1-CG2 4.29Å; F540-I600 HydrophobicContact CE1-CD1 4.15Å; F540-I600 HydrophobicContact CE1-CG2 3.52Å; F540-I600 HydrophobicContact CE2-CG2 4.44Å; F540-I600 HydrophobicContact CZ-CG2 3.61Å
541	A	81.1	Confident	80.9	Confident	33 Å²	33	88.8 Å²	88.8	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-69.1	-43.3	177.4	0	0	0	0	0	110.8	L537 D538 R544 R545	L537-A541 HydrophobicContact CD2-CB 3.96Å; D538-A541 HydrophobicContact CB-CB 4.45Å; D538-A541 WeakPolarHBondContact O-CA 3.29Å; D538-A541 WeakPolarHBondContact O-CB 3.42Å; D538-A541 PolarHBondContact O-N 3.47Å; A541-R544 PolarHBondContact O-N 3.18Å; A541-R545 PolarHBondContact O-N 3.14Å
542	R	81	Confident	78.9	Confident	29 Å²	29	91.5 Å²	91.5	11%	0.109	44%	0.435	C	S	.	.	H	α-helix	trans	-61	-46	173.8	-152.9	-144.5	-69.3	-111.7	12.2	111.4	E503 D538 R544 R545 L546 S604 P605 A606	E503-R542 WeakPolarHBondContact OE2-CG 3.38Å; D538-R542 PolarHBondContact O-N 3.25Å; R542-R544 VanDerWaalsContact C-N 3.31Å; R542-R544 PolarHBondContact O-N 2.95Å; R542-R545 PolarHBondContact O-N 3.04Å; R542-L546 HydrophobicContact CG-CD1 4.34Å; R542-L546 WeakPolarHBondContact O-CG 3.35Å; R542-L546 PolarHBondContact O-N 3.4Å; R542-S604 PolarHBondContact NE-O 3.43Å; R542-S604 PolarHBondContact NH2-O 3.39Å; R542-P605 PolarHBondContact NH2-O 3.17Å; R542-P605 VanDerWaalsContact NH2-O 3.13Å; R542-A606 VanDerWaalsContact CZ-CB 3.47Å
543	K	79.6	Confident	76.4	Confident	60 Å²	60	91.7 Å²	91.7	26%	0.261	44%	0.442	S	S	.	.	H	α-helix	trans	-57.4	-42	175.3	-167.8	170	-179.7	176.4	0	112.2	P539 L546 M547 G599 L603	P539-K543 WeakPolarHBondContact O-CB 3.41Å; P539-K543 PolarHBondContact O-N 3.03Å; K543-L546 PolarHBondContact O-N 2.93Å; K543-M547 HydrophobicContact CG-CE 4.24Å; K543-M547 HydrophobicContact CG-SD 4.24Å; K543-M547 WeakPolarHBondContact O-CB 3.15Å; K543-M547 VanDerWaalsContact O-CG 3.3Å; K543-M547 WeakPolarHBondContact O-CG 3.47Å; K543-M547 PolarHBondContact O-N 2.93Å; K543-G599 PolarHBondContact NZ-O 3.17Å; K543-L603 HydrophobicContact CB-CD1 3.68Å; K543-L603 HydrophobicContact CD-CD1 4.22Å; K543-L603 HydrophobicContact CG-CD1 4.07Å
544	R	81.9	Confident	73.4	Confident	194 Å²	194	90.9 Å²	90.9	73%	0.732	46%	0.455	S	S	*	.	H	α-helix	trans	-65.3	-42.3	177.1	-163.3	-174.7	-58.3	-171.4	2.5	112.3	F540 A541 R542 M547 A548	F540-R544 WeakPolarHBondContact O-CB 3.42Å; F540-R544 PolarHBondContact O-N 3.38Å; A541-R544 PolarHBondContact O-N 3.18Å; R542-R544 VanDerWaalsContact C-N 3.31Å; R542-R544 PolarHBondContact O-N 2.95Å; R544-M547 PolarHBondContact O-N 3.48Å; R544-A548 PolarHBondContact O-N 3.24Å
545	R	77.5	Confident	70.7	Confident	91 Å²	91	96 Å²	96	34%	0.343	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-49.1	173.8	-82.1	-174.9	150.5	-153.6	-9.3	112.3	E501 E503 A541 R542 M547 A548 Q549	E501-R545 IonicContact OE1-CZ 3.76Å; E501-R545 IonicContact OE1-NH1 3.69Å; E501-R545 PolarHBondContact OE1-NH1 2.94Å; E501-R545 IonicContact OE1-NH2 3.71Å; E501-R545 PolarHBondContact OE1-NH2 3.03Å; E501-R545 IonicContact OE2-NH2 3.84Å; E503-R545 WeakPolarHBondContact OE1-CD 3.45Å; E503-R545 IonicContact OE1-CZ 3.81Å; E503-R545 IonicContact OE1-NE 3.39Å; E503-R545 IonicContact OE1-NH1 3.87Å; E503-R545 PolarHBondContact OE1-NH1 3.11Å; A541-R545 PolarHBondContact O-N 3.14Å; R542-R545 PolarHBondContact O-N 3.04Å; R545-M547 VanDerWaalsContact C-N 3.29Å; R545-M547 PolarHBondContact O-N 2.78Å; R545-A548 PolarHBondContact O-N 3.38Å; R545-Q549 PolarHBondContact O-N 3.09Å
546	L	78.6	Confident	68	Low	74 Å²	74	99.4 Å²	99.4	39%	0.387	51%	0.514	S	S	.	.	H	α-helix	trans	-61.7	-36.5	178.3	-68.5	167.4	0	0	0	112.1	R542 K543 R550	R542-L546 HydrophobicContact CG-CD1 4.34Å; R542-L546 WeakPolarHBondContact O-CG 3.35Å; R542-L546 PolarHBondContact O-N 3.4Å; K543-L546 PolarHBondContact O-N 2.93Å; L546-R550 WeakPolarHBondContact O-CG 3.09Å; L546-R550 PolarHBondContact O-N 2.82Å
547	M	78.1	Confident	65.4	Low	105 Å²	105	109.9 Å²	109.9	52%	0.517	55%	0.552	S	S	.	*	H	α-helix	trans	-66.9	-43.1	173.4	-76	173.1	162.2	0	0	112.5	K543 R544 R545 R550 Q551	K543-M547 HydrophobicContact CG-CE 4.24Å; K543-M547 HydrophobicContact CG-SD 4.24Å; K543-M547 WeakPolarHBondContact O-CB 3.15Å; K543-M547 VanDerWaalsContact O-CG 3.3Å; K543-M547 WeakPolarHBondContact O-CG 3.47Å; K543-M547 PolarHBondContact O-N 2.93Å; R544-M547 PolarHBondContact O-N 3.48Å; R545-M547 VanDerWaalsContact C-N 3.29Å; R545-M547 PolarHBondContact O-N 2.78Å; M547-R550 PolarHBondContact O-N 3.17Å; M547-Q551 PolarHBondContact O-N 2.88Å
548	A	78	Confident	62.7	Low	62 Å²	62	112.6 Å²	112.6	51%	0.512	59%	0.586	S	S	.	*	H	α-helix	trans	-63.5	-43.6	177.9	0	0	0	0	0	112.3	R544 R545 R550 Q551 G552	R544-A548 PolarHBondContact O-N 3.24Å; R545-A548 PolarHBondContact O-N 3.38Å; A548-R550 VanDerWaalsContact C-N 3.29Å; A548-R550 PolarHBondContact O-N 2.86Å; A548-Q551 PolarHBondContact O-N 2.85Å; A548-Q551 VanDerWaalsContact O-N 3.1Å; A548-G552 PolarHBondContact O-N 2.74Å
549	Q	69.9	Low	60.4	Low	141 Å²	141	112.2 Å²	112.2	66%	0.659	60%	0.602	S	S	*	*	H	α-helix	trans	-57.7	-41.3	175.2	-74.6	174.9	-20.4	0	0	112.1	R545 Q551 G552	R545-Q549 PolarHBondContact O-N 3.09Å; Q549-Q551 VanDerWaalsContact C-N 3.25Å; Q549-Q551 PolarHBondContact O-N 2.81Å; Q549-G552 PolarHBondContact O-N 2.85Å
550	R	65.5	Low	58.3	Low	223 Å²	223	116 Å²	116	84%	0.842	63%	0.629	S	S	*	*	H	α-helix	trans	-71.4	-13.2	178.3	-70.1	-176.1	71.5	167.2	5	114.8	L546 M547 A548	L546-R550 WeakPolarHBondContact O-CG 3.09Å; L546-R550 PolarHBondContact O-N 2.82Å; M547-R550 PolarHBondContact O-N 3.17Å; A548-R550 VanDerWaalsContact C-N 3.29Å; A548-R550 PolarHBondContact O-N 2.86Å
551	Q	58.2	Low	56.4	Low	160 Å²	160	115.9 Å²	115.9	75%	0.748	64%	0.638	S	S	*	*	H	α-helix	trans	-97.1	-10.5	176.9	-71.4	-180	-15.5	0	0	113.3	M547 A548 Q549 H553	M547-Q551 PolarHBondContact O-N 2.88Å; A548-Q551 PolarHBondContact O-N 2.85Å; A548-Q551 VanDerWaalsContact O-N 3.1Å; Q549-Q551 VanDerWaalsContact C-N 3.25Å; Q549-Q551 PolarHBondContact O-N 2.81Å; Q551-H553 VanDerWaalsContact C-N 3.27Å; Q551-H553 PolarHBondContact O-N 3.38Å
552	G	49.8	Very low	54.4	Low	69 Å²	69	120.3 Å²	120.3	71%	0.711	66%	0.662	S	S	*	*	S	Bend	trans	-76.9	0.7	-178.4	0	0	0	0	0	116.1	A548 Q549	A548-G552 PolarHBondContact O-N 2.74Å; Q549-G552 PolarHBondContact O-N 2.85Å
553	H	35.8	Very low	52.2	Low	175 Å²	175	126.3 Å²	126.3	81%	0.81	70%	0.696	S	S	*	*			trans	-120.2	85.3	-173.1	-154	100	0	0	0	111.7	Q551	Q551-H553 VanDerWaalsContact C-N 3.27Å; Q551-H553 PolarHBondContact O-N 3.38Å
554	C	28.9	Very low	50.4	Low	111 Å²	111	127 Å²	127	75%	0.75	72%	0.72	S	S	*	*			trans	-138.8	134.9	170.1	-80.4	0	0	0	0	109
555	P	34.4	Very low	48.1	Very low	123 Å²	123	125.9 Å²	125.9	80%	0.799	73%	0.729	S	S	*	*			trans	-73.8	138.8	-173.6	29.5	-34.9	0	0	0	112	R557	P555-R557 PolarHBondContact O-N 2.84Å
556	V	31.6	Very low	46.3	Very low	150 Å²	150	126.5 Å²	126.5	91%	0.909	75%	0.753	S	S	*	*			trans	-63.6	115.4	175	178.4	0	0	0	0	109.7
557	R	34.4	Very low	44.5	Very low	245 Å²	245	130.9 Å²	130.9	93%	0.925	77%	0.772	S	S	*	*			trans	-114.3	120.5	169.3	-138.8	179.5	-163.8	-157.5	4	108.6	P555	P555-R557 PolarHBondContact O-N 2.84Å
558	G	30.7	Very low	42.7	Very low	80 Å²	80	134 Å²	134	83%	0.825	79%	0.785	S	S	*	*			trans	-71.3	155.9	-170.6	0	0	0	0	0	114.9
559	G	33.7	Very low	40.6	Very low	76 Å²	76	137.5 Å²	137.5	78%	0.784	80%	0.795	S	S	*	*			trans	142	80.6	-175.8	0	0	0	0	0	110
560	S	36.3	Very low	38.8	Very low	106 Å²	106	137.2 Å²	137.2	74%	0.741	80%	0.803	S	S	*	*				80.4	91.1	60.9	-174.4	0	0	0	0	113.6
561	V	39.1	Very low	37.3	Very low	127 Å²	127	132 Å²	132	77%	0.77	80%	0.801	S	S	*	*			trans	51.6	137.4	164	-91.8	0	0	0	0	117.4
562	T	40.2	Very low	35.8	Very low	126 Å²	126	132.5 Å²	132.5	77%	0.773	81%	0.809	S	S	*	*			cis	-147.4	176.9	43	47.3	0	0	0	0	113.8
563	D	34.2	Very low	35	Very low	155 Å²	155	132.5 Å²	132.5	83%	0.829	81%	0.808	S	S	*	*			trans	-66.5	163.8	-172.3	-41.6	-87.7	0	0	0	116.3
564	G	40.7	Very low	34.6	Very low	74 Å²	74	133 Å²	133	76%	0.763	81%	0.811	S	S	*	*			trans	179.6	106.8	171.7	0	0	0	0	0	112
565	D	33.8	Very low	34.7	Very low	170 Å²	170	137.2 Å²	137.2	91%	0.909	82%	0.82	S	S	*	*			trans	-69	141.6	-168.2	-57.4	-89.3	0	0	0	115.5
566	A	40	Very low	34.7	Very low	104 Å²	104	136.6 Å²	136.6	86%	0.86	81%	0.814	S	S	*	*			trans	-144.4	123	157.6	0	0	0	0	0	109.9
567	H	40.7	Very low	34.6	Very low	166 Å²	166	135.2 Å²	135.2	77%	0.769	80%	0.801	S	S	*	*			trans	-84	138.4	-174.6	-161.2	-89.2	0	0	0	110.6
568	E	40.9	Very low	34.6	Very low	170 Å²	170	130.9 Å²	130.9	79%	0.794	80%	0.797	S	S	*	*				175.6	130.7	119.4	-94.2	175.4	179.2	0	0	114.8
569	D	33.5	Very low	34.5	Very low	136 Å²	136	129.8 Å²	129.8	73%	0.727	79%	0.785	S	S	*	*			trans	60.4	107.8	140.5	-65.9	17.4	0	0	0	122.4
570	T	31.6	Very low	34.4	Very low	135 Å²	135	133.6 Å²	133.6	83%	0.828	79%	0.788	S	S	*	*			trans	-69.4	143.7	167.3	48.3	0	0	0	0	113.4
571	S	35.2	Very low	34.4	Very low	114 Å²	114	134.9 Å²	134.9	80%	0.797	78%	0.782	S	S	*	*			trans	-151.3	126.4	133.5	59.6	0	0	0	0	110.7
572	N	26.9	Very low	34.2	Very low	171 Å²	171	137.6 Å²	137.6	91%	0.914	78%	0.783	S	S	*	*			trans	-83.7	127.1	169.5	-63.3	-52.8	0	0	0	108
573	G	31.5	Very low	34.1	Very low	68 Å²	68	134.2 Å²	134.2	70%	0.701	76%	0.76	S	S	*	*			trans	-129.6	117.8	176.9	0	0	0	0	0	111	E575	G573-E575 PolarHBondContact O-N 2.99Å
574	E	27.9	Very low	34.1	Very low	185 Å²	185	131 Å²	131	86%	0.864	75%	0.751	S	S	*	*			trans	-79.2	94.7	176.5	-65.4	176.4	105.3	0	0	110.3	T576	E574-T576 PolarHBondContact O-N 2.84Å
575	E	31.7	Very low	34	Very low	201 Å²	201	130.6 Å²	130.6	94%	0.939	73%	0.733	S	S	*	*			trans	-72.9	81.7	168.5	-72.5	-160.9	145.9	0	0	110.6	G573	G573-E575 PolarHBondContact O-N 2.99Å
576	T	33.5	Very low	33.8	Very low	110 Å²	110	129.2 Å²	129.2	68%	0.675	73%	0.726	S	S	*	*			trans	-66.7	142	166.7	49.6	0	0	0	0	111.5	E574 N578	E574-T576 PolarHBondContact O-N 2.84Å; T576-N578 PolarHBondContact O-N 2.87Å
577	D	30.4	Very low	34	Very low	120 Å²	120	128.8 Å²	128.8	64%	0.642	71%	0.708	S	S	*	*			trans	-26.1	118.9	163.5	176.9	28.3	0	0	0	114.9
578	N	33.9	Very low	33.8	Very low	154 Å²	154	128.4 Å²	128.4	82%	0.824	71%	0.712	S	S	*	*			trans	-165.7	134	141.5	-100.3	-70.6	0	0	0	109.6	T576	T576-N578 PolarHBondContact O-N 2.87Å
579	G	29.1	Very low	33.6	Very low	57 Å²	57	124 Å²	124	59%	0.588	71%	0.712	S	S	*	*			trans	-75.9	164.5	175.3	0	0	0	0	0	113.3
580	N	31.8	Very low	34	Very low	157 Å²	157	125.4 Å²	125.4	84%	0.84	71%	0.708	S	S	*	*			trans	110.8	19.9	173.3	86.4	38.6	0	0	0	119.5	K582	N580-K582 PolarHBondContact O-N 3.06Å
581	E	36	Very low	34.5	Very low	132 Å²	132	126.7 Å²	126.7	62%	0.617	71%	0.71	S	S	*	*			trans	-36.8	116.5	165.1	-94.6	-171.9	-119.7	0	0	112.8	K535 L583	K535-E581 IonicContact NZ-OE2 3.68Å; K535-E581 PolarHBondContact NZ-OE2 3.44Å; E581-L583 PolarHBondContact O-N 3.1Å
582	K	35.4	Very low	34.6	Very low	184 Å²	184	128.4 Å²	128.4	80%	0.8	71%	0.709	S	S	*	*			trans	-70.4	113.9	-171.3	-179.2	-176.4	176.5	-172.4	0	111.1	N580 S584	N580-K582 PolarHBondContact O-N 3.06Å; K582-S584 VanDerWaalsContact C-N 3.3Å; K582-S584 PolarHBondContact O-N 2.89Å
583	L	37.4	Very low	35.2	Very low	55 Å²	55	126.1 Å²	126.1	29%	0.288	70%	0.698	S	S	.	*			trans	-65.9	82.2	171.7	-73.3	171	0	0	0	111.7	I522 E581	I522-L583 HydrophobicContact CG2-CD1 3.86Å; E581-L583 PolarHBondContact O-N 3.1Å
584	S	33.5	Very low	35.6	Very low	89 Å²	89	128.9 Å²	128.9	62%	0.622	70%	0.696	S	S	*	*			trans	-90.9	91.7	166.5	54.2	0	0	0	0	110.2	K582	K582-S584 VanDerWaalsContact C-N 3.3Å; K582-S584 PolarHBondContact O-N 2.89Å
585	V	38.9	Very low	35.9	Very low	64 Å²	64	129.5 Å²	129.5	39%	0.388	70%	0.696	S	S	.	*			trans	-90	106.7	167.6	-78.1	0	0	0	0	109.4	I515 L536 L587	I515-V585 HydrophobicContact CD1-CG1 4.37Å; I515-V585 HydrophobicContact CD1-CG2 4.38Å; I515-V585 HydrophobicContact CG2-CG2 4.34Å; L536-V585 HydrophobicContact CB-CG1 4.44Å; V585-L587 PolarHBondContact O-N 3.12Å; V585-L587 VanDerWaalsContact O-N 3.08Å
586	N	29.4	Very low	35.9	Very low	142 Å²	142	127.7 Å²	127.7	76%	0.759	69%	0.693	S	S	*	*			trans	-80.4	84	175.3	-74.1	1.3	0	0	0	109.5	D588	N586-D588 PolarHBondContact O-N 3.44Å
587	L	45.8	Very low	36.3	Very low	94 Å²	94	126.2 Å²	126.2	49%	0.492	69%	0.687	S	S	.	*	G	3₁₀ helix	trans	-82	0.8	-178.3	-154.2	67.9	0	0	0	113.5	V585 G589	V585-L587 PolarHBondContact O-N 3.12Å; V585-L587 VanDerWaalsContact O-N 3.08Å; L587-G589 PolarHBondContact O-N 3.23Å
588	D	36.2	Very low	36.4	Very low	158 Å²	158	125.3 Å²	125.3	85%	0.845	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-73	-7.6	-175.9	-57.5	-45.9	0	0	0	114	N586 Y590	N586-D588 PolarHBondContact O-N 3.44Å; D588-Y590 VanDerWaalsContact C-N 3.35Å; D588-Y590 PolarHBondContact O-N 3.12Å
589	G	36.8	Very low	37	Very low	78 Å²	78	120.4 Å²	120.4	80%	0.804	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-85.8	11.3	-179.2	0	0	0	0	0	116.1	L587	L587-G589 PolarHBondContact O-N 3.23Å
590	Y	41.7	Very low	38	Very low	165 Å²	165	120.3 Å²	120.3	65%	0.647	68%	0.678	S	S	*	*	S	Bend	trans	-98.8	4.3	-169.9	-153.4	-103	0	0	0	115.1	D588	D588-Y590 VanDerWaalsContact C-N 3.35Å; D588-Y590 PolarHBondContact O-N 3.12Å
591	L	42.3	Very low	38.9	Very low	163 Å²	163	118 Å²	118	85%	0.853	68%	0.68	S	S	*	*	S	Bend	trans	-140.8	53.6	-175.4	-75.7	176.4	0	0	0	113.9
592	D	36.6	Very low	39.9	Very low	149 Å²	149	119.3 Å²	119.3	80%	0.797	69%	0.691	S	S	*	*			trans	-157.2	165.9	147.2	-130.9	-29.6	0	0	0	115.5
593	D	40.6	Very low	41.5	Very low	124 Å²	124	113.1 Å²	113.1	66%	0.663	67%	0.667	S	S	*	*			trans	63.3	111.1	159.5	-83.4	-28.6	0	0	0	123.2
594	N	38.7	Very low	43.4	Very low	126 Å²	126	113.1 Å²	113.1	67%	0.674	67%	0.671	S	S	*	*				66	90.2	128.8	-60.9	-38.7	0	0	0	122.3	N596	N594-N596 PolarHBondContact O-N 3.45Å
595	K	34.9	Very low	45.9	Very low	198 Å²	198	109.5 Å²	109.5	86%	0.861	65%	0.645	S	S	*	*				27.1	63.7	114.9	-60.3	179.5	179.3	172.7	0	119
596	N	32	Very low	48.3	Very low	162 Å²	162	106.4 Å²	106.4	87%	0.866	63%	0.627	S	S	*	*			trans	-178.3	83.5	138.9	-100.4	-19.2	0	0	0	113.6	N594	N594-N596 PolarHBondContact O-N 3.45Å
597	S	40.4	Very low	51.3	Low	79 Å²	79	99.8 Å²	99.8	55%	0.552	59%	0.591	S	S	*	*			trans	-166.9	88.2	157.5	45.7	0	0	0	0	112.2	G599	S597-G599 PolarHBondContact O-N 2.88Å
598	G	34.1	Very low	53.5	Low	101 Å²	101	95.5 Å²	95.5	100%	1.041	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	46.9	-178.4	0	0	0	0	0	115.7
599	G	45	Very low	56.2	Low	52 Å²	52	88 Å²	88	54%	0.536	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-170.1	26.8	-178.6	0	0	0	0	0	114.1	K543 S597	K543-G599 PolarHBondContact NZ-O 3.17Å; S597-G599 PolarHBondContact O-N 2.88Å
600	I	50.1	Low	58.9	Low	55 Å²	55	84.4 Å²	84.4	28%	0.282	49%	0.492	S	S	.	.	S	Bend	trans	-125.8	-30.1	-179.1	-64	-173.9	0	0	0	112.2	F540 D602	F540-I600 HydrophobicContact CD1-CG2 4.29Å; F540-I600 HydrophobicContact CE1-CD1 4.15Å; F540-I600 HydrophobicContact CE1-CG2 3.52Å; F540-I600 HydrophobicContact CE2-CG2 4.44Å; F540-I600 HydrophobicContact CZ-CG2 3.61Å; I600-D602 VanDerWaalsContact C-N 3.28Å; I600-D602 PolarHBondContact O-N 3.04Å
601	A	50.5	Low	61.4	Low	108 Å²	108	76.6 Å²	76.6	89%	0.893	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-12	-172.5	0	0	0	0	0	116.2
602	D	58.7	Low	63.8	Low	159 Å²	159	69.8 Å²	69.8	85%	0.85	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-3.4	-166	-158.1	40	0	0	0	114.4	I600	I600-D602 VanDerWaalsContact C-N 3.28Å; I600-D602 PolarHBondContact O-N 3.04Å
603	L	67.7	Low	66.4	Low	55 Å²	55	65.1 Å²	65.1	29%	0.288	40%	0.397	S	S	.	.			trans	-94.4	115.1	175.7	-74.7	168.9	0	0	0	110	P539 K543	P539-L603 HydrophobicContact CB-CB 3.96Å; P539-L603 WeakPolarHBondContact CB-O 3.26Å; P539-L603 WeakPolarHBondContact CG-O 3.24Å; K543-L603 HydrophobicContact CB-CD1 3.68Å; K543-L603 HydrophobicContact CD-CD1 4.22Å; K543-L603 HydrophobicContact CG-CD1 4.07Å
604	S	77.9	Confident	68.8	Low	55 Å²	55	61.1 Å²	61.1	39%	0.385	38%	0.379	S	S	.	.			trans	-69.6	155.7	166	-73.4	0	0	0	0	111.3	R542	R542-S604 PolarHBondContact NE-O 3.43Å; R542-S604 PolarHBondContact NH2-O 3.39Å
605	P	86	Confident	71.4	Confident	12 Å²	12	55.4 Å²	55.4	8%	0.078	35%	0.349	C	S	.	.			trans	-63.7	165.5	169.1	28.5	-33.7	0	0	0	111.5	V506 P508 A511 L536 L537 R542	V506-P605 PolarHBondContact N-O 2.91Å; V506-P605 WeakPolarHBondContact O-CD 3.27Å; V506-P605 WeakPolarHBondContact O-CG 3.36Å; P508-P605 HydrophobicContact CG-CG 4.31Å; A511-P605 HydrophobicContact CB-CG 4.48Å; L536-P605 HydrophobicContact CD1-CB 4.35Å; L536-P605 HydrophobicContact CG-CB 4.49Å; L537-P605 WeakPolarHBondContact O-CA 3.45Å; R542-P605 PolarHBondContact NH2-O 3.17Å; R542-P605 VanDerWaalsContact NH2-O 3.13Å
606	A	89.7	Confident	74.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	157.2	175.1	0	0	0	0	0	112.7	E503 I504 L536 L537 R542	E503-A606 HydrophobicContact CB-CB 4.39Å; I504-A606 CarbonylContact O-C 3.57Å; I504-A606 WeakPolarHBondContact O-CA 3.37Å; I504-A606 WeakPolarHBondContact O-CB 3.48Å; L536-A606 CarbonylContact C-O 3.52Å; L536-A606 WeakPolarHBondContact CA-O 3.41Å; L537-A606 PolarHBondContact N-O 3.43Å; L537-A606 PolarHBondContact O-N 2.92Å; R542-A606 VanDerWaalsContact CZ-CB 3.47Å
607	F	91.3	Very high	77	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.009	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	118.3	159.2	-68.4	-73.5	0	0	0	109.6	E503 I504 V506 L514 I515 I522 L536 L609 L623	E503-F607 WeakPolarHBondContact CA-O 3.25Å; I504-F607 PolarHBondContact N-O 3.32Å; I504-F607 PolarHBondContact O-N 3.41Å; V506-F607 HydrophobicContact CB-CE2 4.46Å; V506-F607 HydrophobicContact CG1-CE2 4.43Å; V506-F607 HydrophobicContact CG2-CD2 3.73Å; V506-F607 HydrophobicContact CG2-CE2 3.91Å; L514-F607 HydrophobicContact CB-CE2 4.2Å; L514-F607 HydrophobicContact CB-CZ 4.11Å; L514-F607 HydrophobicContact CD1-CE2 4.28Å; I515-F607 HydrophobicContact CD1-CE1 4.31Å; I515-F607 HydrophobicContact CD1-CZ 4.5Å; I515-F607 HydrophobicContact CG1-CE1 3.86Å; I515-F607 HydrophobicContact CG1-CZ 3.92Å; I522-F607 HydrophobicContact CD1-CD1 3.98Å; I522-F607 HydrophobicContact CD1-CE1 3.69Å; I522-F607 HydrophobicContact CD1-CZ 4.04Å; I522-F607 HydrophobicContact CG1-CD1 4.47Å; I522-F607 HydrophobicContact CG1-CE1 4.05Å; L536-F607 HydrophobicContact CB-CD1 4.42Å; L536-F607 HydrophobicContact CB-CE1 4.3Å; L536-F607 HydrophobicContact CD1-CD1 3.93Å; L536-F607 HydrophobicContact CD1-CD2 4.48Å; L536-F607 HydrophobicContact CD1-CE1 3.69Å; L536-F607 HydrophobicContact CD1-CE2 4.27Å; L536-F607 HydrophobicContact CD1-CG 4.32Å; L536-F607 HydrophobicContact CD1-CZ 3.87Å; F607-L609 HydrophobicContact CB-CD2 4.06Å; F607-L609 HydrophobicContact CB-CG 4.37Å; F607-L623 HydrophobicContact CB-CD1 4.38Å; F607-L623 HydrophobicContact CD2-CD1 3.93Å; F607-L623 HydrophobicContact CD2-CD2 4.21Å; F607-L623 HydrophobicContact CE2-CD2 4.04Å; F607-L623 HydrophobicContact CG-CD1 4.31Å
608	S	91.5	Very high	79.5	Confident	5 Å²	5	43 Å²	43	4%	0.035	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	119.6	158.4	156.9	0	0	0	0	107.7	E501 A534 K535	E501-S608 PolarHBondContact OE1-OG 3.17Å; A534-S608 WeakPolarHBondContact CA-O 3.49Å; K535-S608 PolarHBondContact N-O 3.25Å; K535-S608 PolarHBondContact O-N 3.21Å
609	L	93.6	Very high	82.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.4	177	-57.9	-177.3	0	0	0	109.2	E501 V502 I504 V531 R533 A534 F607 V616 M619 L623	E501-L609 VanDerWaalsContact CA-O 3.29Å; E501-L609 WeakPolarHBondContact CA-O 3.42Å; V502-L609 PolarHBondContact N-O 3.03Å; V502-L609 PolarHBondContact O-N 3.23Å; I504-L609 HydrophobicContact CD1-CD1 3.54Å; I504-L609 HydrophobicContact CD1-CG 4.48Å; I504-L609 HydrophobicContact CG1-CD1 4.37Å; V531-L609 HydrophobicContact CG1-CB 4.41Å; R533-L609 CarbonylContact O-C 3.43Å; R533-L609 WeakPolarHBondContact O-CA 3.39Å; A534-L609 HydrophobicContact CB-CD2 3.64Å; F607-L609 HydrophobicContact CB-CD2 4.06Å; F607-L609 HydrophobicContact CB-CG 4.37Å; L609-V616 HydrophobicContact CB-CG1 4.17Å; L609-V616 HydrophobicContact CD1-CG1 4.31Å; L609-M619 HydrophobicContact CD1-CB 3.9Å; L609-M619 HydrophobicContact CD1-CG 3.54Å; L609-M619 HydrophobicContact CD2-CE 4.42Å; L609-M619 HydrophobicContact CD2-CG 3.93Å; L609-M619 HydrophobicContact CG-CG 4.38Å; L609-L623 HydrophobicContact CD1-CD1 4.23Å
610	V	93.7	Very high	84.6	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.018	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.9	173.5	-169.3	0	0	0	0	109.7	L448 L451 E501 V531 R532 R533	L448-V610 HydrophobicContact CD1-CG1 4.42Å; L448-V610 HydrophobicContact CD2-CG1 3.58Å; L451-V610 HydrophobicContact CD1-CG1 3.83Å; E501-V610 HydrophobicContact CB-CG2 4.13Å; E501-V610 HydrophobicContact CG-CG2 3.91Å; V531-V610 WeakPolarHBondContact CG1-O 3.31Å; R532-V610 WeakPolarHBondContact CB-O 3.37Å; R532-V610 PolarHBondContact N-O 2.9Å; R533-V610 HydrophobicContact CB-CB 4.12Å; R533-V610 HydrophobicContact CB-CG2 4.4Å; R533-V610 PolarHBondContact N-O 3.2Å; R533-V610 PolarHBondContact O-N 3.47Å
611	G	93.5	Very high	86.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	-172.4	-179.2	0	0	0	0	0	110.8	F499 T500	F499-G611 WeakPolarHBondContact CA-O 3.45Å; T500-G611 PolarHBondContact N-O 2.9Å; T500-G611 PolarHBondContact O-N 3.23Å
612	T	93.7	Very high	88.7	Confident	20 Å²	20	40.1 Å²	40.1	12%	0.123	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	149.9	170.2	73.8	0	0	0	0	109.6	N495 L496 D498 F499 S614 S615 V616	N495-T612 VanDerWaalsContact O-CB 3.3Å; N495-T612 WeakPolarHBondContact O-CB 3.36Å; N495-T612 WeakPolarHBondContact O-CG2 3.23Å; N495-T612 PolarHBondContact O-OG1 2.74Å; N495-T612 VanDerWaalsContact O-OG1 3.1Å; L496-T612 WeakPolarHBondContact O-CG2 3.36Å; D498-T612 CarbonylContact O-C 3.46Å; D498-T612 VanDerWaalsContact O-CA 3.29Å; D498-T612 WeakPolarHBondContact O-CA 3.34Å; F499-T612 HydrophobicContact CD1-CG2 4.18Å; F499-T612 HydrophobicContact CD2-CG2 4.36Å; F499-T612 HydrophobicContact CE1-CG2 3.83Å; F499-T612 HydrophobicContact CE2-CG2 4.03Å; F499-T612 HydrophobicContact CG-CG2 4.43Å; F499-T612 HydrophobicContact CZ-CG2 3.75Å; T612-S614 PolarHBondContact O-N 2.99Å; T612-S615 PolarHBondContact N-OG 2.86Å; T612-S615 WeakPolarHBondContact O-CA 3.43Å; T612-S615 PolarHBondContact O-N 3.08Å; T612-S615 PolarHBondContact O-OG 2.91Å; T612-V616 PolarHBondContact O-N 2.96Å
613	R	90.5	Very high	90.3	Very high	51 Å²	51	32.8 Å²	32.8	19%	0.192	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-28.6	-174.4	-168.5	177.6	-63.8	-97.9	-3.9	113	D498 T500 A617	D498-R613 HydrophobicContact CB-CB 4.27Å; D498-R613 PolarHBondContact O-N 2.91Å; D498-R613 IonicContact OD1-CZ 2.69Å; D498-R613 IonicContact OD1-NE 2.68Å; D498-R613 PolarHBondContact OD1-NE 2.98Å; D498-R613 IonicContact OD1-NH2 3.66Å; D498-R613 PolarHBondContact OD1-NH2 2.74Å; D498-R613 WeakPolarHBondContact OD2-CD 3.28Å; D498-R613 IonicContact OD2-NE 2.65Å; D498-R613 PolarHBondContact OD2-NE 3.16Å; T500-R613 HydrophobicContact CG2-CB 4.15Å; T500-R613 HydrophobicContact CG2-CG 4.39Å; R613-A617 WeakPolarHBondContact O-CB 3.3Å; R613-A617 PolarHBondContact O-N 2.89Å
614	S	90.8	Very high	91.4	Very high	40 Å²	40	33.4 Å²	33.4	28%	0.28	18%	0.175	S	C	.	.	H	α-helix	trans	-69.3	-49.2	171.5	-172.2	0	0	0	0	112.4	T612 V616 A617 K618	T612-S614 PolarHBondContact O-N 2.99Å; S614-V616 PolarHBondContact O-N 2.98Å; S614-A617 PolarHBondContact O-N 3.24Å; S614-K618 WeakPolarHBondContact O-CB 3.4Å; S614-K618 PolarHBondContact O-N 2.87Å
615	S	93.5	Very high	92.1	Very high	7 Å²	7	36.7 Å²	36.7	5%	0.049	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-40.6	176.1	69.8	0	0	0	0	113	A529 G530 V531 T612 K618 M619	A529-S615 WeakPolarHBondContact O-CA 3.16Å; A529-S615 VanDerWaalsContact O-CB 3.31Å; A529-S615 WeakPolarHBondContact O-CB 3.42Å; G530-S615 WeakPolarHBondContact O-CB 3.35Å; V531-S615 VanDerWaalsContact CG2-O 3.31Å; V531-S615 WeakPolarHBondContact CG2-O 3.36Å; T612-S615 PolarHBondContact N-OG 2.86Å; T612-S615 WeakPolarHBondContact O-CA 3.43Å; T612-S615 PolarHBondContact O-N 3.08Å; T612-S615 PolarHBondContact O-OG 2.91Å; S615-K618 PolarHBondContact O-N 3.02Å; S615-M619 WeakPolarHBondContact O-CB 3.4Å; S615-M619 PolarHBondContact O-N 3.17Å
616	V	92.7	Very high	92.3	Very high	8 Å²	8	38.2 Å²	38.2	5%	0.048	19%	0.189	C	C	.	.	H	α-helix	trans	-69.1	-39.9	179.9	177.3	0	0	0	0	111.2	T500 V502 V531 L609 T612 S614 M619 R620	T500-V616 HydrophobicContact CG2-CB 4.26Å; T500-V616 HydrophobicContact CG2-CG2 4.08Å; V502-V616 HydrophobicContact CB-CG1 3.88Å; V502-V616 HydrophobicContact CG2-CG1 3.77Å; V531-V616 HydrophobicContact CG2-CG2 4.42Å; L609-V616 HydrophobicContact CB-CG1 4.17Å; L609-V616 HydrophobicContact CD1-CG1 4.31Å; T612-V616 PolarHBondContact O-N 2.96Å; S614-V616 PolarHBondContact O-N 2.98Å; V616-M619 PolarHBondContact O-N 3Å; V616-R620 WeakPolarHBondContact O-CB 3.42Å; V616-R620 PolarHBondContact O-N 3.32Å
617	A	91.7	Very high	92.3	Very high	57 Å²	57	39 Å²	39	47%	0.471	20%	0.195	S	C	.	.	H	α-helix	trans	-64.1	-41.2	173.2	0	0	0	0	0	112.3	R613 S614 R620 L621	R613-A617 WeakPolarHBondContact O-CB 3.3Å; R613-A617 PolarHBondContact O-N 2.89Å; S614-A617 PolarHBondContact O-N 3.24Å; A617-R620 PolarHBondContact O-N 2.82Å; A617-L621 PolarHBondContact O-N 3.18Å; A617-L621 VanDerWaalsContact O-N 3.15Å
618	K	93.6	Very high	92.3	Very high	112 Å²	112	43.5 Å²	43.5	49%	0.487	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-44.5	174.1	-174.3	-172.6	-76.2	177.1	0	111.7	A529 S614 S615 L621 L622	A529-K618 HydrophobicContact CB-CD 4.5Å; S614-K618 WeakPolarHBondContact O-CB 3.4Å; S614-K618 PolarHBondContact O-N 2.87Å; S615-K618 PolarHBondContact O-N 3.02Å; K618-L621 PolarHBondContact O-N 3.35Å; K618-L622 HydrophobicContact CG-CD1 4.37Å; K618-L622 WeakPolarHBondContact O-CG 3.36Å; K618-L622 PolarHBondContact O-N 2.84Å
619	M	93.7	Very high	92.3	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.6	-38.9	177.4	-172.7	63.2	178.5	0	0	112.6	I522 L525 A526 A529 V531 L609 S615 V616 L622 L623	I522-M619 HydrophobicContact CD1-CE 3.4Å; I522-M619 HydrophobicContact CG1-CE 4.35Å; L525-M619 VanDerWaalsContact C-SD 3.54Å; L525-M619 HydrophobicContact CB-CE 3.8Å; L525-M619 HydrophobicContact CB-SD 3.98Å; A526-M619 HydrophobicContact CB-CE 4.19Å; A529-M619 HydrophobicContact CB-CB 3.63Å; A529-M619 HydrophobicContact CB-CG 4.22Å; A529-M619 HydrophobicContact CB-SD 3.71Å; V531-M619 HydrophobicContact CG2-CB 3.61Å; V531-M619 HydrophobicContact CG2-CG 4.08Å; L609-M619 HydrophobicContact CD1-CB 3.9Å; L609-M619 HydrophobicContact CD1-CG 3.54Å; L609-M619 HydrophobicContact CD2-CE 4.42Å; L609-M619 HydrophobicContact CD2-CG 3.93Å; L609-M619 HydrophobicContact CG-CG 4.38Å; S615-M619 WeakPolarHBondContact O-CB 3.4Å; S615-M619 PolarHBondContact O-N 3.17Å; V616-M619 PolarHBondContact O-N 3Å; M619-L622 PolarHBondContact O-N 2.79Å; M619-L623 HydrophobicContact CE-CD1 4.18Å; M619-L623 HydrophobicContact CE-CD2 4.26Å; M619-L623 HydrophobicContact CE-CG 4.15Å; M619-L623 HydrophobicContact CG-CD1 4.2Å; M619-L623 WeakPolarHBondContact O-CB 3.17Å; M619-L623 WeakPolarHBondContact O-CG 3.37Å; M619-L623 PolarHBondContact O-N 2.88Å
620	R	92.9	Very high	92.1	Very high	125 Å²	125	49.1 Å²	49.1	47%	0.472	24%	0.244	S	C	.	.	H	α-helix	trans	-57	-52.9	174.3	174.6	163.9	-177.3	169.2	4.2	111.1	I504 V616 A617 L622 L623 E624	I504-R620 HydrophobicContact CD1-CB 3.63Å; I504-R620 HydrophobicContact CD1-CG 3.79Å; V616-R620 WeakPolarHBondContact O-CB 3.42Å; V616-R620 PolarHBondContact O-N 3.32Å; A617-R620 PolarHBondContact O-N 2.82Å; R620-L622 VanDerWaalsContact C-N 3.3Å; R620-L622 PolarHBondContact O-N 3.5Å; R620-L623 PolarHBondContact O-N 2.98Å; R620-L623 VanDerWaalsContact O-N 3.14Å; R620-E624 HydrophobicContact CG-CG 4.43Å; R620-E624 WeakPolarHBondContact CG-OE1 3.17Å; R620-E624 WeakPolarHBondContact CG-OE2 3.38Å; R620-E624 IonicContact CZ-OE1 2.73Å; R620-E624 IonicContact NE-OE1 3.2Å; R620-E624 PolarHBondContact NE-OE1 3.23Å; R620-E624 IonicContact NE-OE2 2.37Å; R620-E624 IonicContact NH2-OE1 3.87Å; R620-E624 PolarHBondContact NH2-OE1 2.84Å; R620-E624 VanDerWaalsContact NH2-OE1 3.16Å; R620-E624 WeakPolarHBondContact O-CB 3.39Å; R620-E624 WeakPolarHBondContact O-CG 3.07Å; R620-E624 PolarHBondContact O-N 3.46Å
621	L	93.1	Very high	91.9	Very high	80 Å²	80	51.3 Å²	51.3	42%	0.419	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-38.2	178.6	-173.8	66.6	0	0	0	112.5	L383 A617 K618 F625	L383-L621 HydrophobicContact CD2-CD2 3.65Å; A617-L621 PolarHBondContact O-N 3.18Å; A617-L621 VanDerWaalsContact O-N 3.15Å; K618-L621 PolarHBondContact O-N 3.35Å; L621-F625 VanDerWaalsContact O-CB 3.28Å; L621-F625 WeakPolarHBondContact O-CB 3.28Å; L621-F625 PolarHBondContact O-N 2.92Å
622	L	93.2	Very high	91.7	Very high	51 Å²	51	56.9 Å²	56.9	27%	0.267	28%	0.282	S	S	.	.	H	α-helix	trans	-67.3	-37.6	175.5	-74	172.5	0	0	0	113	L525 A529 K618 M619 R620 Q626	L525-L622 HydrophobicContact CD2-CB 4.37Å; A529-L622 HydrophobicContact CB-CD1 4.23Å; K618-L622 HydrophobicContact CG-CD1 4.37Å; K618-L622 WeakPolarHBondContact O-CG 3.36Å; K618-L622 PolarHBondContact O-N 2.84Å; M619-L622 PolarHBondContact O-N 2.79Å; R620-L622 VanDerWaalsContact C-N 3.3Å; R620-L622 PolarHBondContact O-N 3.5Å; L622-Q626 WeakPolarHBondContact O-CB 3.42Å; L622-Q626 PolarHBondContact O-N 2.91Å
623	L	92.4	Very high	91.6	Very high	5 Å²	5	59.4 Å²	59.4	3%	0.026	29%	0.294	C	S	.	.	H	α-helix	trans	-70.6	-40.3	175.4	-75.2	171.2	0	0	0	112.1	I504 L514 I522 L525 F607 L609 M619 R620 A627	I504-L623 HydrophobicContact CD1-CD1 4.33Å; L514-L623 HydrophobicContact CD2-CD2 4.24Å; I522-L623 HydrophobicContact CD1-CD2 3.97Å; L525-L623 HydrophobicContact CD1-CD2 4.32Å; F607-L623 HydrophobicContact CB-CD1 4.38Å; F607-L623 HydrophobicContact CD2-CD1 3.93Å; F607-L623 HydrophobicContact CD2-CD2 4.21Å; F607-L623 HydrophobicContact CE2-CD2 4.04Å; F607-L623 HydrophobicContact CG-CD1 4.31Å; L609-L623 HydrophobicContact CD1-CD1 4.23Å; M619-L623 HydrophobicContact CE-CD1 4.18Å; M619-L623 HydrophobicContact CE-CD2 4.26Å; M619-L623 HydrophobicContact CE-CG 4.15Å; M619-L623 HydrophobicContact CG-CD1 4.2Å; M619-L623 WeakPolarHBondContact O-CB 3.17Å; M619-L623 WeakPolarHBondContact O-CG 3.37Å; M619-L623 PolarHBondContact O-N 2.88Å; R620-L623 PolarHBondContact O-N 2.98Å; R620-L623 VanDerWaalsContact O-N 3.14Å; L623-A627 VanDerWaalsContact O-CB 3.27Å; L623-A627 WeakPolarHBondContact O-CB 3.45Å; L623-A627 PolarHBondContact O-N 2.8Å
624	E	91.2	Very high	91.5	Very high	69 Å²	69	58.2 Å²	58.2	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-63.1	-55.7	175.8	-71.9	165.3	165.8	0	0	109.9	R620 Q626 A627 D628	R620-E624 HydrophobicContact CG-CG 4.43Å; R620-E624 WeakPolarHBondContact CG-OE1 3.17Å; R620-E624 WeakPolarHBondContact CG-OE2 3.38Å; R620-E624 IonicContact CZ-OE1 2.73Å; R620-E624 IonicContact NE-OE1 3.2Å; R620-E624 PolarHBondContact NE-OE1 3.23Å; R620-E624 IonicContact NE-OE2 2.37Å; R620-E624 IonicContact NH2-OE1 3.87Å; R620-E624 PolarHBondContact NH2-OE1 2.84Å; R620-E624 VanDerWaalsContact NH2-OE1 3.16Å; R620-E624 WeakPolarHBondContact O-CB 3.39Å; R620-E624 WeakPolarHBondContact O-CG 3.07Å; R620-E624 PolarHBondContact O-N 3.46Å; E624-Q626 VanDerWaalsContact C-N 3.34Å; E624-Q626 PolarHBondContact O-N 3.5Å; E624-A627 WeakPolarHBondContact O-CB 3.46Å; E624-A627 PolarHBondContact O-N 2.81Å; E624-D628 PolarHBondContact O-N 2.37Å
625	F	92.7	Very high	91.5	Very high	124 Å²	124	63 Å²	63	54%	0.544	31%	0.309	S	S	.	.	H	α-helix	trans	-55.3	-44	175.4	174.5	-111.7	0	0	0	113.3	L621 A627 D628 N629	L621-F625 VanDerWaalsContact O-CB 3.28Å; L621-F625 WeakPolarHBondContact O-CB 3.28Å; L621-F625 PolarHBondContact O-N 2.92Å; F625-A627 VanDerWaalsContact C-N 3.32Å; F625-A627 PolarHBondContact O-N 2.94Å; F625-D628 PolarHBondContact O-N 2.87Å; F625-N629 WeakPolarHBondContact CD1-ND2 3.3Å; F625-N629 WeakPolarHBondContact CE1-ND2 3.38Å; F625-N629 WeakPolarHBondContact CZ-ND2 3.29Å; F625-N629 VanDerWaalsContact O-CG 3.25Å; F625-N629 PolarHBondContact O-N 2.91Å; F625-N629 VanDerWaalsContact O-N 3.08Å; F625-N629 PolarHBondContact O-ND2 3.08Å
626	Q	90.2	Very high	91.3	Very high	44 Å²	44	67.6 Å²	67.6	21%	0.206	33%	0.333	C	S	.	.	H	α-helix	trans	-70	-29.3	179.3	-172.2	60.5	76.9	0	0	112.6	L514 L622 E624 W630	L514-Q626 HydrophobicContact CD2-CB 3.76Å; L514-Q626 HydrophobicContact CD2-CG 3.6Å; L622-Q626 WeakPolarHBondContact O-CB 3.42Å; L622-Q626 PolarHBondContact O-N 2.91Å; E624-Q626 VanDerWaalsContact C-N 3.34Å; E624-Q626 PolarHBondContact O-N 3.5Å; Q626-W630 PolarHBondContact O-N 3.37Å
627	A	89.8	Confident	91.2	Very high	15 Å²	15	70.8 Å²	70.8	12%	0.124	35%	0.347	C	S	.	.	H	α-helix	trans	-68.8	-44.4	172.8	0	0	0	0	0	111.3	L510 L514 L623 E624 F625 N629 W630 N631	L510-A627 HydrophobicContact CD1-CB 4.08Å; L514-A627 HydrophobicContact CD1-CB 4.43Å; L623-A627 VanDerWaalsContact O-CB 3.27Å; L623-A627 WeakPolarHBondContact O-CB 3.45Å; L623-A627 PolarHBondContact O-N 2.8Å; E624-A627 WeakPolarHBondContact O-CB 3.46Å; E624-A627 PolarHBondContact O-N 2.81Å; F625-A627 VanDerWaalsContact C-N 3.32Å; F625-A627 PolarHBondContact O-N 2.94Å; A627-N629 PolarHBondContact O-N 2.68Å; A627-W630 WeakPolarHBondContact O-CA 3.37Å; A627-W630 WeakPolarHBondContact O-CB 3.46Å; A627-W630 PolarHBondContact O-N 3Å; A627-N631 PolarHBondContact O-N 2.92Å; A627-N631 PolarHBondContact O-ND2 3.46Å
628	D	90.6	Very high	91.2	Very high	98 Å²	98	73.1 Å²	73.1	52%	0.524	35%	0.348	S	S	.	.	H	α-helix	trans	-62.3	-44.5	178.8	-64.3	-26.6	0	0	0	111.6	E624 F625 W630 N631 E632	E624-D628 PolarHBondContact O-N 2.37Å; F625-D628 PolarHBondContact O-N 2.87Å; D628-W630 PolarHBondContact O-N 2.94Å; D628-N631 WeakPolarHBondContact O-CB 3.27Å; D628-N631 PolarHBondContact O-N 3.1Å; D628-E632 PolarHBondContact O-N 3.12Å
629	N	90.5	Very high	91.1	Very high	55 Å²	55	70.2 Å²	70.2	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-57.6	-32.4	172.5	-67.6	-37.9	0	0	0	113.1	F625 A627 L633	F625-N629 WeakPolarHBondContact CD1-ND2 3.3Å; F625-N629 WeakPolarHBondContact CE1-ND2 3.38Å; F625-N629 WeakPolarHBondContact CZ-ND2 3.29Å; F625-N629 VanDerWaalsContact O-CG 3.25Å; F625-N629 PolarHBondContact O-N 2.91Å; F625-N629 VanDerWaalsContact O-N 3.08Å; F625-N629 PolarHBondContact O-ND2 3.08Å; A627-N629 PolarHBondContact O-N 2.68Å; N629-L633 WeakPolarHBondContact O-CB 3.25Å; N629-L633 PolarHBondContact O-N 3.13Å
630	W	90	Very high	90.9	Very high	68 Å²	68	77.9 Å²	77.9	26%	0.258	37%	0.374	S	S	.	.	H	α-helix	trans	-79	-25	175.6	-76.2	126.4	0	0	0	113.1	L510 R513 Q626 A627 D628 L633 D634	L510-W630 HydrophobicContact CD2-CB 3.82Å; R513-W630 HydrophobicContact CB-CD2 4.07Å; R513-W630 HydrophobicContact CB-CG 4.26Å; R513-W630 HydrophobicContact CB-CZ2 4.11Å; R513-W630 HydrophobicContact CG-CD2 4.45Å; R513-W630 PolarHBondContact NH1-O 3.15Å; Q626-W630 PolarHBondContact O-N 3.37Å; A627-W630 WeakPolarHBondContact O-CA 3.37Å; A627-W630 WeakPolarHBondContact O-CB 3.46Å; A627-W630 PolarHBondContact O-N 3Å; D628-W630 PolarHBondContact O-N 2.94Å; W630-L633 HydrophobicContact CE3-CD2 3.85Å; W630-L633 HydrophobicContact CZ3-CD2 3.7Å; W630-D634 PolarHBondContact O-N 3.38Å
631	N	90.3	Very high	90.7	Very high	48 Å²	48	77.6 Å²	77.6	26%	0.257	37%	0.373	S	S	.	.	H	α-helix	trans	-74.9	-48.9	173.8	-64.1	-33.6	0	0	0	110.3	A627 D628 L633 D634 E635	A627-N631 PolarHBondContact O-N 2.92Å; A627-N631 PolarHBondContact O-ND2 3.46Å; D628-N631 WeakPolarHBondContact O-CB 3.27Å; D628-N631 PolarHBondContact O-N 3.1Å; N631-L633 PolarHBondContact O-N 2.77Å; N631-D634 PolarHBondContact O-N 2.73Å; N631-E635 PolarHBondContact O-N 2.74Å
632	E	89.8	Confident	90.6	Very high	118 Å²	118	76.5 Å²	76.5	55%	0.551	37%	0.372	S	S	*	.	H	α-helix	trans	-57	-39.4	175.2	-174.4	177.5	-172.6	0	0	111.2	D628 E635 L636	D628-E632 PolarHBondContact O-N 3.12Å; E632-E635 PolarHBondContact O-N 3.04Å; E632-L636 HydrophobicContact CG-CD1 4.07Å; E632-L636 WeakPolarHBondContact O-CB 3.31Å; E632-L636 VanDerWaalsContact O-CG 3.26Å; E632-L636 WeakPolarHBondContact O-CG 3.46Å; E632-L636 PolarHBondContact O-N 2.88Å
633	L	90.1	Very high	90.3	Very high	72 Å²	72	78.9 Å²	78.9	38%	0.377	39%	0.385	S	S	.	.	H	α-helix	trans	-67	-39.5	174.4	-172.2	64.5	0	0	0	113.1	N629 W630 N631 E635 L636 E637	N629-L633 WeakPolarHBondContact O-CB 3.25Å; N629-L633 PolarHBondContact O-N 3.13Å; W630-L633 HydrophobicContact CE3-CD2 3.85Å; W630-L633 HydrophobicContact CZ3-CD2 3.7Å; N631-L633 PolarHBondContact O-N 2.77Å; L633-E635 VanDerWaalsContact C-N 3.34Å; L633-L636 PolarHBondContact O-N 3.39Å; L633-E637 WeakPolarHBondContact O-CB 3.31Å; L633-E637 WeakPolarHBondContact O-CG 3.09Å; L633-E637 PolarHBondContact O-N 2.77Å
634	D	88.7	Confident	90.1	Very high	26 Å²	26	84.1 Å²	84.1	14%	0.139	41%	0.408	C	S	.	.	H	α-helix	trans	-64.7	-38	174.7	-93.5	18	0	0	0	111.4	R509 R513 W630 N631 E638	R509-D634 IonicContact CZ-OD2 3.52Å; R509-D634 IonicContact NH2-OD2 3.88Å; R509-D634 PolarHBondContact NH2-OD2 2.88Å; R513-D634 IonicContact CZ-OD1 2.78Å; R513-D634 IonicContact NH1-OD1 2.84Å; R513-D634 PolarHBondContact NH1-OD1 2.73Å; R513-D634 IonicContact NH1-OD2 3.95Å; R513-D634 IonicContact NH2-OD1 2.72Å; R513-D634 PolarHBondContact NH2-OD1 3.31Å; R513-D634 IonicContact NH2-OD2 3.19Å; W630-D634 PolarHBondContact O-N 3.38Å; N631-D634 PolarHBondContact O-N 2.73Å; D634-E638 WeakPolarHBondContact O-CB 3.42Å; D634-E638 PolarHBondContact O-N 3.11Å
635	E	91.1	Very high	89.9	Confident	141 Å²	141	83.7 Å²	83.7	66%	0.659	41%	0.412	S	S	*	.	H	α-helix	trans	-66.6	-45.3	174.8	-71.8	-179.7	-161.3	0	0	112.1	N631 E632 L633 E638 A639	N631-E635 PolarHBondContact O-N 2.74Å; E632-E635 PolarHBondContact O-N 3.04Å; L633-E635 VanDerWaalsContact C-N 3.34Å; E635-E638 PolarHBondContact O-N 3.08Å; E635-A639 WeakPolarHBondContact O-CB 3.45Å; E635-A639 PolarHBondContact O-N 2.83Å
636	L	89.8	Confident	89.7	Confident	104 Å²	104	82.7 Å²	82.7	55%	0.545	41%	0.409	S	S	.	.	H	α-helix	trans	-64.6	-38.2	175.5	-73.2	169.7	0	0	0	112.1	E632 L633 R640	E632-L636 HydrophobicContact CG-CD1 4.07Å; E632-L636 WeakPolarHBondContact O-CB 3.31Å; E632-L636 VanDerWaalsContact O-CG 3.26Å; E632-L636 WeakPolarHBondContact O-CG 3.46Å; E632-L636 PolarHBondContact O-N 2.88Å; L633-L636 PolarHBondContact O-N 3.39Å; L636-R640 VanDerWaalsContact O-CB 3.25Å; L636-R640 WeakPolarHBondContact O-CB 3.49Å; L636-R640 PolarHBondContact O-N 3.12Å
637	E	89.6	Confident	89.5	Confident	75 Å²	75	85.3 Å²	85.3	35%	0.35	42%	0.424	S	S	.	.	H	α-helix	trans	-64	-39.9	171.8	-79.3	-164.5	167.6	0	0	112	L633 R640 R641	L633-E637 WeakPolarHBondContact O-CB 3.31Å; L633-E637 WeakPolarHBondContact O-CG 3.09Å; L633-E637 PolarHBondContact O-N 2.77Å; E637-R640 WeakPolarHBondContact O-CB 3.13Å; E637-R640 PolarHBondContact O-N 2.83Å; E637-R641 WeakPolarHBondContact O-CG 3.21Å; E637-R641 PolarHBondContact O-N 2.9Å; E637-R641 IonicContact OE2-CZ 2.59Å; E637-R641 IonicContact OE2-NH1 2.87Å; E637-R641 IonicContact OE2-NH2 3.28Å; E637-R641 PolarHBondContact OE2-NH2 2.86Å
638	E	91.9	Very high	89.2	Confident	105 Å²	105	93.4 Å²	93.4	49%	0.491	45%	0.451	S	S	.	.	H	α-helix	trans	-73.5	-40	-179.9	-161.8	56.7	-140.7	0	0	112.3	D634 E635 R640 R641 S642	D634-E638 WeakPolarHBondContact O-CB 3.42Å; D634-E638 PolarHBondContact O-N 3.11Å; E635-E638 PolarHBondContact O-N 3.08Å; E638-R640 VanDerWaalsContact C-N 3.28Å; E638-R640 PolarHBondContact O-N 3.39Å; E638-R641 PolarHBondContact O-N 3.23Å; E638-R641 VanDerWaalsContact O-N 3.14Å; E638-R641 WeakPolarHBondContact OE2-CD 3.21Å; E638-R641 IonicContact OE2-CZ 2.6Å; E638-R641 IonicContact OE2-NE 3.05Å; E638-R641 IonicContact OE2-NH1 2.89Å; E638-R641 PolarHBondContact OE2-NH1 3.22Å; E638-S642 WeakPolarHBondContact O-CB 3.34Å; E638-S642 PolarHBondContact O-N 2.66Å
639	A	90.8	Very high	88.7	Confident	52 Å²	52	94.2 Å²	94.2	43%	0.43	45%	0.452	S	S	.	.	H	α-helix	trans	-57.1	-43.6	169.5	0	0	0	0	0	111	E635 S642 L643	E635-A639 WeakPolarHBondContact O-CB 3.45Å; E635-A639 PolarHBondContact O-N 2.83Å; A639-S642 PolarHBondContact O-N 2.78Å; A639-L643 WeakPolarHBondContact O-CG 3.46Å; A639-L643 PolarHBondContact O-N 3.07Å
640	R	90.2	Very high	88	Confident	161 Å²	161	95.1 Å²	95.1	61%	0.608	46%	0.46	S	S	*	.	H	α-helix	trans	-61.3	-46	172.5	172.7	-179	165.8	-179.3	-3.1	112.2	L636 E637 E638 S642 L643 F644	L636-R640 VanDerWaalsContact O-CB 3.25Å; L636-R640 WeakPolarHBondContact O-CB 3.49Å; L636-R640 PolarHBondContact O-N 3.12Å; E637-R640 WeakPolarHBondContact O-CB 3.13Å; E637-R640 PolarHBondContact O-N 2.83Å; E638-R640 VanDerWaalsContact C-N 3.28Å; E638-R640 PolarHBondContact O-N 3.39Å; R640-S642 VanDerWaalsContact C-N 3.33Å; R640-S642 PolarHBondContact O-N 3.26Å; R640-L643 PolarHBondContact O-N 3.21Å; R640-F644 HydrophobicContact CG-CD2 3.72Å; R640-F644 HydrophobicContact CG-CE2 3.77Å; R640-F644 VanDerWaalsContact O-CD2 3.3Å; R640-F644 WeakPolarHBondContact O-CD2 3.43Å; R640-F644 PolarHBondContact O-N 3.02Å
641	R	89.4	Confident	86.9	Confident	118 Å²	118	96.9 Å²	96.9	45%	0.445	47%	0.474	S	S	.	.	H	α-helix	trans	-59.7	-43.8	176.6	-74.4	177.6	-162	100.5	13.2	111.4	E637 E638 F644 S645	E637-R641 WeakPolarHBondContact O-CG 3.21Å; E637-R641 PolarHBondContact O-N 2.9Å; E637-R641 IonicContact OE2-CZ 2.59Å; E637-R641 IonicContact OE2-NH1 2.87Å; E637-R641 IonicContact OE2-NH2 3.28Å; E637-R641 PolarHBondContact OE2-NH2 2.86Å; E638-R641 PolarHBondContact O-N 3.23Å; E638-R641 VanDerWaalsContact O-N 3.14Å; E638-R641 WeakPolarHBondContact OE2-CD 3.21Å; E638-R641 IonicContact OE2-CZ 2.6Å; E638-R641 IonicContact OE2-NE 3.05Å; E638-R641 IonicContact OE2-NH1 2.89Å; E638-R641 PolarHBondContact OE2-NH1 3.22Å; R641-F644 PolarHBondContact O-N 2.93Å; R641-S645 WeakPolarHBondContact O-CB 3.49Å; R641-S645 PolarHBondContact O-N 3.01Å
642	S	90	Very high	85.5	Confident	57 Å²	57	100.5 Å²	100.5	40%	0.399	49%	0.489	S	S	.	.	H	α-helix	trans	-59.1	-50.1	176.6	-172.9	0	0	0	0	111.6	E638 A639 R640 F644 S645 Q646	E638-S642 WeakPolarHBondContact O-CB 3.34Å; E638-S642 PolarHBondContact O-N 2.66Å; A639-S642 PolarHBondContact O-N 2.78Å; R640-S642 VanDerWaalsContact C-N 3.33Å; R640-S642 PolarHBondContact O-N 3.26Å; S642-F644 PolarHBondContact O-N 3.4Å; S642-S645 WeakPolarHBondContact O-CA 3.39Å; S642-S645 WeakPolarHBondContact O-CB 3.39Å; S642-S645 PolarHBondContact O-N 3.26Å; S642-S645 VanDerWaalsContact O-N 3.09Å; S642-Q646 WeakPolarHBondContact O-CG 3.14Å; S642-Q646 PolarHBondContact O-N 2.96Å
643	L	88	Confident	83.8	Confident	101 Å²	101	100.7 Å²	100.7	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-60.3	-43.1	176.3	-71.7	168.8	0	0	0	112.7	A639 R640 S645 Q646 L647	A639-L643 WeakPolarHBondContact O-CG 3.46Å; A639-L643 PolarHBondContact O-N 3.07Å; R640-L643 PolarHBondContact O-N 3.21Å; L643-S645 VanDerWaalsContact C-N 3.3Å; L643-S645 PolarHBondContact O-N 3.35Å; L643-Q646 PolarHBondContact O-N 3.5Å; L643-L647 WeakPolarHBondContact O-CB 3.2Å; L643-L647 WeakPolarHBondContact O-CG 3.45Å; L643-L647 PolarHBondContact O-N 3.21Å
644	F	87.7	Confident	82	Confident	116 Å²	116	103.4 Å²	103.4	51%	0.509	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-29.4	174.9	-85.8	-69.2	0	0	0	113.1	R640 R641 S642 R648	R640-F644 HydrophobicContact CG-CD2 3.72Å; R640-F644 HydrophobicContact CG-CE2 3.77Å; R640-F644 VanDerWaalsContact O-CD2 3.3Å; R640-F644 WeakPolarHBondContact O-CD2 3.43Å; R640-F644 PolarHBondContact O-N 3.02Å; R641-F644 PolarHBondContact O-N 2.93Å; S642-F644 PolarHBondContact O-N 3.4Å; F644-R648 WeakPolarHBondContact O-CB 3.36Å; F644-R648 WeakPolarHBondContact O-CG 3.34Å; F644-R648 PolarHBondContact O-N 2.99Å
645	S	87.8	Confident	80.2	Confident	59 Å²	59	110 Å²	110	41%	0.413	54%	0.538	S	S	.	.	H	α-helix	trans	-69.5	-47.8	172.1	-169	0	0	0	0	111.2	R641 S642 L643 L647 R648 Q649	R641-S645 WeakPolarHBondContact O-CB 3.49Å; R641-S645 PolarHBondContact O-N 3.01Å; S642-S645 WeakPolarHBondContact O-CA 3.39Å; S642-S645 WeakPolarHBondContact O-CB 3.39Å; S642-S645 PolarHBondContact O-N 3.26Å; S642-S645 VanDerWaalsContact O-N 3.09Å; L643-S645 VanDerWaalsContact C-N 3.3Å; L643-S645 PolarHBondContact O-N 3.35Å; S645-L647 PolarHBondContact O-N 2.99Å; S645-R648 WeakPolarHBondContact O-CB 3.34Å; S645-R648 PolarHBondContact O-N 3.17Å; S645-R648 VanDerWaalsContact O-N 3.13Å; S645-Q649 WeakPolarHBondContact O-CG 3.38Å; S645-Q649 PolarHBondContact O-N 2.97Å
646	Q	88.6	Confident	78.2	Confident	104 Å²	104	111.3 Å²	111.3	49%	0.486	54%	0.544	S	S	.	.	H	α-helix	trans	-58.7	-45.6	176.3	-70.6	175.1	-6.6	0	0	112	S642 L643 R648 Q649 T650	S642-Q646 WeakPolarHBondContact O-CG 3.14Å; S642-Q646 PolarHBondContact O-N 2.96Å; L643-Q646 PolarHBondContact O-N 3.5Å; Q646-R648 VanDerWaalsContact C-N 3.31Å; Q646-R648 PolarHBondContact O-N 3.35Å; Q646-Q649 WeakPolarHBondContact O-CB 3.3Å; Q646-Q649 PolarHBondContact O-N 3.16Å; Q646-T650 PolarHBondContact O-N 2.78Å; Q646-T650 PolarHBondContact O-OG1 3Å
647	L	84.5	Confident	75.7	Confident	99 Å²	99	110.6 Å²	110.6	52%	0.518	55%	0.548	S	S	.	.	H	α-helix	trans	-64	-32.2	176	-72	168.9	0	0	0	113.2	L643 S645 Q649 T650 N651	L643-L647 WeakPolarHBondContact O-CB 3.2Å; L643-L647 WeakPolarHBondContact O-CG 3.45Å; L643-L647 PolarHBondContact O-N 3.21Å; S645-L647 PolarHBondContact O-N 2.99Å; L647-Q649 VanDerWaalsContact C-N 3.32Å; L647-T650 PolarHBondContact O-OG1 3.38Å; L647-N651 WeakPolarHBondContact O-CB 3.47Å; L647-N651 PolarHBondContact O-N 3.3Å; L647-N651 PolarHBondContact O-ND2 3.35Å
648	R	83.4	Confident	73.2	Confident	185 Å²	185	115.3 Å²	115.3	70%	0.698	58%	0.575	S	S	*	*	H	α-helix	trans	-71.7	-24.6	171.2	-78.4	177.9	178	-126.3	2.6	112.8	F644 S645 Q646 Q652	F644-R648 WeakPolarHBondContact O-CB 3.36Å; F644-R648 WeakPolarHBondContact O-CG 3.34Å; F644-R648 PolarHBondContact O-N 2.99Å; S645-R648 WeakPolarHBondContact O-CB 3.34Å; S645-R648 PolarHBondContact O-N 3.17Å; S645-R648 VanDerWaalsContact O-N 3.13Å; Q646-R648 VanDerWaalsContact C-N 3.31Å; Q646-R648 PolarHBondContact O-N 3.35Å; R648-Q652 WeakPolarHBondContact O-CG 3.38Å; R648-Q652 PolarHBondContact O-NE2 3.37Å
649	Q	80.6	Confident	70.7	Confident	115 Å²	115	116.2 Å²	116.2	54%	0.537	59%	0.593	S	S	.	*	H	α-helix	trans	-82	-46.4	176.3	-68.6	174.4	16.9	0	0	111.8	S645 Q646 L647 N651 Q652 L653	S645-Q649 WeakPolarHBondContact O-CG 3.38Å; S645-Q649 PolarHBondContact O-N 2.97Å; Q646-Q649 WeakPolarHBondContact O-CB 3.3Å; Q646-Q649 PolarHBondContact O-N 3.16Å; L647-Q649 VanDerWaalsContact C-N 3.32Å; Q649-N651 PolarHBondContact O-N 3.29Å; Q649-Q652 PolarHBondContact O-N 3.31Å; Q649-L653 PolarHBondContact O-N 3.38Å
650	T	75.6	Confident	68.4	Low	74 Å²	74	119.9 Å²	119.9	45%	0.454	61%	0.61	S	S	.	*	H	α-helix	trans	-62.2	-40.3	177.2	46.8	0	0	0	0	112.5	Q646 L647 Q652 L653 N654	Q646-T650 PolarHBondContact O-N 2.78Å; Q646-T650 PolarHBondContact O-OG1 3Å; L647-T650 PolarHBondContact O-OG1 3.38Å; T650-Q652 PolarHBondContact O-N 2.72Å; T650-L653 PolarHBondContact O-N 3.31Å; T650-N654 PolarHBondContact O-N 2.97Å
651	N	68.1	Low	65.7	Low	105 Å²	105	116.9 Å²	116.9	56%	0.561	61%	0.614	S	S	*	*	H	α-helix	trans	-66.5	-17.6	174.2	-76.5	-14.2	0	0	0	114.1	L647 Q649	L647-N651 WeakPolarHBondContact O-CB 3.47Å; L647-N651 PolarHBondContact O-N 3.3Å; L647-N651 PolarHBondContact O-ND2 3.35Å; Q649-N651 PolarHBondContact O-N 3.29Å
652	Q	60.7	Low	63.3	Low	124 Å²	124	117.8 Å²	117.8	58%	0.579	64%	0.635	S	S	*	*	H	α-helix	trans	-87	-28.6	172.7	-79.1	176.1	89.7	0	0	112.9	R648 Q649 T650	R648-Q652 WeakPolarHBondContact O-CG 3.38Å; R648-Q652 PolarHBondContact O-NE2 3.37Å; Q649-Q652 PolarHBondContact O-N 3.31Å; T650-Q652 PolarHBondContact O-N 2.72Å
653	L	54.4	Low	60.9	Low	122 Å²	122	121.8 Å²	121.8	64%	0.639	66%	0.657	S	S	*	*	H	α-helix	trans	-70.8	-40.5	175.7	-67.8	171.4	0	0	0	111.4	Q649 T650 H655 Q656	Q649-L653 PolarHBondContact O-N 3.38Å; T650-L653 PolarHBondContact O-N 3.31Å; L653-H655 PolarHBondContact O-N 3.05Å; L653-Q656 PolarHBondContact O-N 3.25Å
654	N	50.7	Low	58.4	Low	129 Å²	129	128.3 Å²	128.3	69%	0.69	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	5.5	177.7	-86.5	20.5	0	0	0	115.5	T650	T650-N654 PolarHBondContact O-N 2.97Å
655	H	52	Low	56.3	Low	165 Å²	165	130.5 Å²	130.5	76%	0.764	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	12.9	178.7	-71.9	-21.3	0	0	0	114.2	L653	L653-H655 PolarHBondContact O-N 3.05Å
656	Q	48.4	Very low	54.1	Low	168 Å²	168	131.7 Å²	131.7	79%	0.785	70%	0.698	S	S	*	*	S	Bend	trans	-120	2.6	177.4	-64.2	-173.1	48	0	0	114.6	L653	L653-Q656 PolarHBondContact O-N 3.25Å
657	S	37.1	Very low	51.8	Low	89 Å²	89	134.6 Å²	134.6	62%	0.622	72%	0.717	S	S	*	*			trans	-129.6	82.9	177.6	61	0	0	0	0	112.2
658	D	37.9	Very low	49.7	Very low	173 Å²	173	134 Å²	134	93%	0.925	74%	0.735	S	S	*	*			trans	-172.6	104.7	145.5	-101.6	-20.7	0	0	0	110.1
659	S	38.2	Very low	47.4	Very low	124 Å²	124	135.6 Å²	135.6	87%	0.867	74%	0.741	S	S	*	*			trans	-133	33.7	-174.2	55.2	0	0	0	0	113.5
660	V	44.5	Very low	45.9	Very low	130 Å²	130	136.3 Å²	136.3	79%	0.788	76%	0.756	S	S	*	*	S	Bend	trans	-126.7	105.5	177.2	-175.1	0	0	0	0	112.4
661	S	32.5	Very low	44.4	Very low	98 Å²	98	136.7 Å²	136.7	69%	0.685	76%	0.761	S	S	*	*			trans	33	105.6	146.3	-57.2	0	0	0	0	120.3	T663	S661-T663 PolarHBondContact O-N 3.32Å
662	P	38.2	Very low	43.2	Very low	136 Å²	136	143.8 Å²	143.8	88%	0.883	78%	0.78	S	S	*	*			trans	-82.2	108.9	172.2	31.9	-33.3	0	0	0	113.3
663	T	40.6	Very low	42.1	Very low	141 Å²	141	141.8 Å²	141.8	87%	0.865	79%	0.793	S	S	*	*			trans	-92.1	143.2	175.3	-7	0	0	0	0	112.4	S661	S661-T663 PolarHBondContact O-N 3.32Å
664	R	35.4	Very low	41.4	Very low	239 Å²	239	140 Å²	140	90%	0.902	80%	0.804	S	S	*	*			trans	-92.8	130.9	-172.1	-51.8	178.9	-160.2	176.6	5.8	113.3
665	I	43.8	Very low	40.8	Very low	161 Å²	161	137.6 Å²	137.6	83%	0.826	81%	0.81	S	S	*	*			trans	-142.1	90.9	156.7	-52	178.3	0	0	0	105.3
666	S	40.3	Very low	40.4	Very low	84 Å²	84	136.7 Å²	136.7	59%	0.587	81%	0.81	S	S	*	*				78.2	113.6	65.3	81.7	0	0	0	0	114.9
667	N	41.3	Very low	40.1	Very low	166 Å²	166	139 Å²	139	89%	0.888	82%	0.818	S	S	*	*			trans	78.5	107.2	152	-51.3	-19.1	0	0	0	119.5
668	G	39.9	Very low	40.3	Very low	86 Å²	86	138 Å²	138	89%	0.887	82%	0.822	S	S	*	*			trans	174.4	109.7	164.4	0	0	0	0	0	111.3
669	R	36.3	Very low	40.5	Very low	219 Å²	219	141 Å²	141	83%	0.826	82%	0.821	S	S	*	*			trans	-136.4	135.2	-171.5	-156.9	-166.6	-169.9	-156	6.5	110.3
670	P	47.6	Very low	40.7	Very low	130 Å²	130	141 Å²	141	84%	0.844	81%	0.811	S	S	*	*				-139	154.4	107.5	36.7	-25.3	0	0	0	112.6
671	S	44.3	Very low	40.6	Very low	81 Å²	81	144.2 Å²	144.2	57%	0.566	81%	0.809	S	S	*	*			cis	115.9	58.7	7.5	-168	0	0	0	0	116.3
672	R	43.2	Very low	41.2	Very low	254 Å²	254	144.9 Å²	144.9	96%	0.958	81%	0.809	S	S	*	*			trans	-173	138.3	152.3	-98.8	164.3	178.9	-176.2	-1.3	105
673	G	37.9	Very low	41.2	Very low	83 Å²	83	145.5 Å²	145.5	86%	0.856	81%	0.81	S	S	*	*			cis	129.8	134.7	11.2	0	0	0	0	0	108.1
674	G	38.9	Very low	41.1	Very low	84 Å²	84	142.3 Å²	142.3	87%	0.866	81%	0.805	S	S	*	*			cis	-178.8	173	-3.6	0	0	0	0	0	110.8
675	G	39.4	Very low	41.2	Very low	79 Å²	79	143.5 Å²	143.5	81%	0.814	81%	0.809	S	S	*	*			trans	93.2	110.3	-177.9	0	0	0	0	0	113.4
676	N	42.9	Very low	40.9	Very low	145 Å²	145	139.7 Å²	139.7	78%	0.775	81%	0.81	S	S	*	*			cis	87	70.8	6.8	-159.7	96.3	0	0	0	118.1
677	F	41.5	Very low	40.9	Very low	218 Å²	218	146.8 Å²	146.8	96%	0.956	82%	0.824	S	S	*	*			trans	-150.2	156	144.4	-76.7	-70.5	0	0	0	108.4
678	G	41.9	Very low	40.7	Very low	68 Å²	68	150 Å²	150	70%	0.701	82%	0.823	S	S	*	*			cis	170.4	102.1	-4.9	0	0	0	0	0	110.8
679	R	42.3	Very low	40.6	Very low	236 Å²	236	154.5 Å²	154.5	89%	0.891	82%	0.822	S	S	*	*			trans	-49.1	150.8	-173	-56.7	172.8	180	174.3	-1.6	115.3
680	N	42.6	Very low	41	Very low	123 Å²	123	149 Å²	149	66%	0.658	81%	0.814	S	S	*	*			trans	125.4	146.9	155.8	-71.5	-38.1	0	0	0	112.3
681	R	41.7	Very low	40.4	Very low	197 Å²	197	151.2 Å²	151.2	74%	0.743	81%	0.813	S	S	*	*			cis	-168.8	156.9	-21.9	-129.6	-174.4	-86	170.6	-4.3	108.1
682	T	46.1	Very low	39.9	Very low	113 Å²	113	151.8 Å²	151.8	69%	0.693	82%	0.817	S	S	*	*			trans	44.3	124	150.2	53.5	0	0	0	0	122.6
683	V	37.2	Very low	39.5	Very low	148 Å²	148	149.8 Å²	149.8	90%	0.897	82%	0.816	S	S	*	*			trans	69.5	124.4	132.5	179.3	0	0	0	0	119.2
684	G	39.1	Very low	39.4	Very low	75 Å²	75	152.1 Å²	152.1	77%	0.773	81%	0.813	S	S	*	*			trans	165	113.6	159.8	0	0	0	0	0	113.9
685	R	37.7	Very low	39.4	Very low	263 Å²	263	153.4 Å²	153.4	99%	0.992	81%	0.806	S	S	*	*			trans	-85.7	135.7	165.5	-66.5	176.5	174	-176.7	-2.3	108.8
686	G	36.2	Very low	39.3	Very low	81 Å²	81	157.2 Å²	157.2	84%	0.835	80%	0.803	S	S	*	*			trans	-169.2	115.3	172.9	0	0	0	0	0	114.3
687	R	40.3	Very low	39	Very low	233 Å²	233	158.8 Å²	158.8	88%	0.879	81%	0.805	S	S	*	*			trans	-79.4	158.4	176	-74.5	173.4	153.1	-170.5	-6.3	112.6
688	R	38.5	Very low	38.8	Very low	233 Å²	233	153 Å²	153	88%	0.879	79%	0.792	S	S	*	*			trans	109.6	155.5	153.5	-70.8	176.4	167.4	162.2	-5.6	117.2
689	Q	37.7	Very low	38.7	Very low	182 Å²	182	157 Å²	157	85%	0.85	80%	0.797	S	S	*	*			trans	-83.6	179.3	-170.4	-55.5	154.2	-62.1	0	0	111.4
690	P	43.6	Very low	38.8	Very low	103 Å²	103	152.9 Å²	152.9	67%	0.669	79%	0.792	S	S	*	*				-146.7	171.6	85.4	41.7	-25.7	0	0	0	116.2
691	E	34.9	Very low	38.6	Very low	177 Å²	177	153.9 Å²	153.9	83%	0.827	80%	0.798	S	S	*	*			trans	47.1	158.2	138.1	-72.5	152.7	-140.5	0	0	123.3
692	S	34.4	Very low	38.7	Very low	92 Å²	92	153.1 Å²	153.1	64%	0.643	80%	0.8	S	S	*	*			cis	-179.5	133.9	-33.4	55.3	0	0	0	0	109.5
693	F	34	Very low	38.3	Very low	212 Å²	212	155.6 Å²	155.6	93%	0.93	80%	0.804	S	S	*	*			trans	-155.5	136.9	168.4	-104.2	-79.1	0	0	0	113.3
694	V	35.5	Very low	38.6	Very low	132 Å²	132	154.8 Å²	154.8	80%	0.8	80%	0.798	S	S	*	*			trans	-160	137.3	-176.5	174.8	0	0	0	0	105
695	P	39.6	Very low	38.5	Very low	112 Å²	112	155.2 Å²	155.2	73%	0.727	79%	0.79	S	S	*	*				-140.3	-163.7	65.7	32.3	-5.8	0	0	0	112.8
696	E	37.6	Very low	38.8	Very low	158 Å²	158	151.1 Å²	151.1	74%	0.738	78%	0.782	S	S	*	*			cis	-141.5	145.7	23.4	-65.8	177.2	112	0	0	111.9
697	Q	36.9	Very low	39	Very low	178 Å²	178	152.5 Å²	152.5	83%	0.832	78%	0.776	S	S	*	*				54.1	137.9	109.4	-49.5	-172.5	16.3	0	0	116
698	S	36.2	Very low	39	Very low	97 Å²	97	147.5 Å²	147.5	68%	0.678	77%	0.773	S	S	*	*			cis	-160.1	150.8	26.6	58.1	0	0	0	0	114.5
699	L	39.9	Very low	39	Very low	153 Å²	153	144.5 Å²	144.5	80%	0.801	78%	0.775	S	S	*	*			trans	58.8	144.7	150.7	-60.4	166.8	0	0	0	118.4
700	D	44.2	Very low	38.9	Very low	148 Å²	148	139.3 Å²	139.3	79%	0.791	76%	0.763	S	S	*	*			cis	-141.4	171	23.8	-97.1	-42.7	0	0	0	113.6
701	D	38.5	Very low	38.6	Very low	145 Å²	145	144.2 Å²	144.2	78%	0.775	78%	0.777	S	S	*	*			trans	-94	145.7	-170.2	-67.5	-66.1	0	0	0	117.2
702	K	45.4	Very low	38.7	Very low	181 Å²	181	138.7 Å²	138.7	79%	0.787	77%	0.767	S	S	*	*				-179.5	136.5	120.5	-101.6	164	-178.3	170.8	0	117
703	E	37	Very low	39.1	Very low	165 Å²	165	143.5 Å²	143.5	77%	0.771	78%	0.779	S	S	*	*			trans	27	139.6	130.3	-67.7	-175.8	111.2	0	0	120.7
704	V	42.5	Very low	39.3	Very low	130 Å²	130	141 Å²	141	79%	0.788	77%	0.77	S	S	*	*			cis	-141.9	160.9	19.3	-175.2	0	0	0	0	110.9
705	S	38.4	Very low	39.6	Very low	85 Å²	85	141.6 Å²	141.6	59%	0.594	77%	0.768	S	S	*	*			trans	-86.2	159.4	177.5	57	0	0	0	0	115.5
706	H	42.7	Very low	39.3	Very low	177 Å²	177	147.4 Å²	147.4	82%	0.819	78%	0.775	S	S	*	*				177.8	155	118.5	-87.7	-53.1	0	0	0	113.2
707	P	41.4	Very low	39.1	Very low	109 Å²	109	143.4 Å²	143.4	71%	0.708	78%	0.777	S	S	*	*			trans	-101.2	165.9	-170	39.4	-36.1	0	0	0	115.2
708	P	40.5	Very low	39.4	Very low	128 Å²	128	144.9 Å²	144.9	83%	0.831	78%	0.781	S	S	*	*			trans	-83.8	153.8	178	34.7	-36.1	0	0	0	113.6
709	N	38.2	Very low	39.1	Very low	170 Å²	170	147.9 Å²	147.9	91%	0.909	79%	0.789	S	S	*	*			trans	-151.4	162.9	165.1	-154.7	-3.8	0	0	0	111.1
710	A	36.6	Very low	39.1	Very low	73 Å²	73	148.1 Å²	148.1	60%	0.603	79%	0.789	S	S	*	*			trans	-115	148.7	-168.5	0	0	0	0	0	114.1
711	H	37.2	Very low	38.8	Very low	207 Å²	207	148.6 Å²	148.6	96%	0.958	79%	0.786	S	S	*	*			trans	178.4	158.9	137.9	-93.8	-46.4	0	0	0	112.7
712	G	36.8	Very low	38.6	Very low	60 Å²	60	149.6 Å²	149.6	62%	0.619	79%	0.787	S	S	*	*			trans	135.5	96.5	-177.7	0	0	0	0	0	109.9
713	Q	42.7	Very low	38.2	Very low	194 Å²	194	146 Å²	146	91%	0.907	78%	0.784	S	S	*	*				63	135.1	77.9	-65.9	-171.4	30.1	0	0	113.8
714	H	37.7	Very low	38.1	Very low	160 Å²	160	145.5 Å²	145.5	74%	0.741	79%	0.787	S	S	*	*			cis	-168.8	172.6	-17.2	-163.3	-111.4	0	0	0	108.1
715	L	41.2	Very low	37.9	Very low	143 Å²	143	145.9 Å²	145.9	75%	0.749	79%	0.789	S	S	*	*			trans	72.4	158.7	168.7	-50	169.5	0	0	0	118.4
716	R	33.3	Very low	37.8	Very low	234 Å²	234	147.2 Å²	147.2	88%	0.883	80%	0.796	S	S	*	*			cis	-170.2	118.3	-37.1	-177.2	179.4	-175.3	-160.2	2.5	112.5
717	G	34.6	Very low	37.3	Very low	75 Å²	75	145.1 Å²	145.1	77%	0.773	79%	0.791	S	S	*	*			trans	79.7	162.8	161.3	0	0	0	0	0	116.3
718	K	41.7	Very low	37.1	Very low	209 Å²	209	147.4 Å²	147.4	91%	0.909	80%	0.797	S	S	*	*			cis	-136.9	152.4	-1.3	-77	177.6	175.4	174.4	0	110.5
719	N	30.2	Very low	36.8	Very low	160 Å²	160	147.1 Å²	147.1	86%	0.856	79%	0.789	S	S	*	*			trans	-101.7	147.2	169	-80.4	-19.3	0	0	0	111.8
720	I	40.8	Very low	36.7	Very low	157 Å²	157	145.9 Å²	145.9	81%	0.805	78%	0.779	S	S	*	*			trans	-142.9	110.9	155.3	-50	-177.9	0	0	0	103
721	H	37.6	Very low	36.7	Very low	158 Å²	158	150.6 Å²	150.6	73%	0.731	79%	0.786	S	S	*	*				51.9	138.9	86.6	-77	-36	0	0	0	113.2
722	Q	35.2	Very low	36.6	Very low	167 Å²	167	146.4 Å²	146.4	78%	0.78	78%	0.78	S	S	*	*			cis	-164.5	150.1	-10.3	-149.3	165.5	-7.9	0	0	103.6
723	S	35.5	Very low	36.4	Very low	105 Å²	105	154.1 Å²	154.1	73%	0.734	79%	0.79	S	S	*	*				178.9	158.5	56.7	44.1	0	0	0	0	110.6
724	D	34.6	Very low	36.1	Very low	154 Å²	154	153.1 Å²	153.1	82%	0.824	79%	0.785	S	S	*	*			trans	-89.7	145.5	175.3	-50	-94.7	0	0	0	113.3
725	V	38.1	Very low	36	Very low	139 Å²	139	150 Å²	150	84%	0.842	78%	0.781	S	S	*	*			trans	-141.4	120.3	156.5	-177	0	0	0	0	109.4
726	P	37.6	Very low	35.4	Very low	112 Å²	112	148.3 Å²	148.3	73%	0.727	78%	0.782	S	S	*	*			trans	-112.7	155.3	-173.1	40.2	-34.1	0	0	0	115.7
727	N	31.3	Very low	35.4	Very low	134 Å²	134	143.3 Å²	143.3	72%	0.717	78%	0.777	S	S	*	*			trans	64.1	114.5	140.7	-153.5	6.7	0	0	0	120.9
728	N	37.4	Very low	35.1	Very low	157 Å²	157	147.3 Å²	147.3	84%	0.84	78%	0.78	S	S	*	*			trans	-174.3	102.7	141.6	-91.9	-41.6	0	0	0	107.8
729	N	34.1	Very low	34.6	Very low	122 Å²	122	143.4 Å²	143.4	65%	0.652	77%	0.77	S	S	*	*				63.5	98.3	61.4	-171.3	10.5	0	0	0	114.7
730	M	37.1	Very low	34.6	Very low	143 Å²	143	141 Å²	141	70%	0.704	77%	0.765	S	S	*	*			trans	-168.4	118.3	141.4	-92.3	-61.3	168.6	0	0	110.7
731	K	36	Very low	34.2	Very low	173 Å²	173	142.7 Å²	142.7	75%	0.752	76%	0.763	S	S	*	*			trans	26.7	132.7	140.1	-55.5	157.3	-165.2	158.2	0	118.2
732	S	35.7	Very low	33.9	Very low	119 Å²	119	139.8 Å²	139.8	83%	0.832	76%	0.76	S	S	*	*				-156	160.4	57.6	58.2	0	0	0	0	117.1
733	R	32.8	Very low	33.5	Very low	221 Å²	221	137.4 Å²	137.4	83%	0.834	76%	0.761	S	S	*	*			trans	-43.8	152.8	176.2	-63.5	161.8	175.1	167.5	-4.8	114.2
734	H	36.4	Very low	33.3	Very low	173 Å²	173	143 Å²	143	80%	0.801	77%	0.768	S	S	*	*				-161.2	153.3	72.1	-97.8	-95.8	0	0	0	115.1
735	S	33.9	Very low	32.9	Very low	94 Å²	94	140.9 Å²	140.9	66%	0.657	77%	0.765	S	S	*	*			trans	32.7	109.1	159	50.5	0	0	0	0	119.5
736	S	30.3	Very low	32.8	Very low	109 Å²	109	142.4 Å²	142.4	76%	0.762	77%	0.768	S	S	*	*				55.8	125.9	80.6	73.9	0	0	0	0	113.7
737	V	33.4	Very low	32.4	Very low	128 Å²	128	140.1 Å²	140.1	78%	0.776	77%	0.765	S	S	*	*				-136	142.7	50.7	170	0	0	0	0	112.9
738	N	27.4	Very low	32.4	Very low	159 Å²	159	140.5 Å²	140.5	85%	0.85	77%	0.772	S	S	*	*			trans	-88.4	141.6	161.7	-81.2	-4	0	0	0	109.5
739	D	30.4	Very low	32.1	Very low	128 Å²	128	141.8 Å²	141.8	68%	0.684	78%	0.775	S	S	*	*			trans	-141.7	121.7	157.1	-140.2	-2.7	0	0	0	109.9	Y741	D739-Y741 HydrophobicContact CB-CE2 4.29Å
740	S	30.6	Very low	31.8	Very low	108 Å²	108	141.2 Å²	141.2	76%	0.755	78%	0.781	S	S	*	*			trans	-118.2	108.8	-168	58.4	0	0	0	0	111
741	Y	32	Very low	31.7	Very low	193 Å²	193	142.3 Å²	142.3	76%	0.757	79%	0.787	S	S	*	*			trans	-107.6	110.5	179.7	-76.8	-83.6	0	0	0	112.4	D739	D739-Y741 HydrophobicContact CB-CE2 4.29Å
742	S	31.7	Very low	31.4	Very low	98 Å²	98	136.5 Å²	136.5	69%	0.685	78%	0.777	S	S	*	*			trans	-87.4	147.7	163.2	54.2	0	0	0	0	110.4
743	C	26.4	Very low	31.2	Very low	117 Å²	117	137.9 Å²	137.9	79%	0.791	78%	0.775	S	S	*	*			trans	38.8	103	151.9	-57.7	0	0	0	0	118.7
744	Y	31.4	Very low	31.3	Very low	223 Å²	223	135 Å²	135	88%	0.875	77%	0.77	S	S	*	*			trans	-129.4	120.7	143.8	-93.8	-81.6	0	0	0	110.5
745	S	27.9	Very low	31	Very low	109 Å²	109	134 Å²	134	76%	0.762	77%	0.766	S	S	*	*			trans	-97.9	132.6	169.6	-60	0	0	0	0	109.6
746	N	35.2	Very low	30.7	Very low	170 Å²	170	137 Å²	137	91%	0.909	78%	0.775	S	S	*	*			trans	-175.8	128.1	160.6	-83.9	-35.4	0	0	0	103
747	G	28.3	Very low	30.9	Very low	65 Å²	65	136.6 Å²	136.6	67%	0.67	77%	0.768	S	S	*	*			cis	121.7	155.9	32.6	0	0	0	0	0	107
748	V	33.1	Very low	30.7	Very low	141 Å²	141	139.4 Å²	139.4	86%	0.855	77%	0.773	S	S	*	*			trans	74.1	123.1	-172.8	-175.6	0	0	0	0	112
749	M	30.6	Very low	31.1	Very low	184 Å²	184	137.7 Å²	137.7	91%	0.906	77%	0.768	S	S	*	*			cis	-141.8	170.2	-3.6	-93.7	-97.3	-176.1	0	0	109.8
750	S	26.9	Very low	31.2	Very low	111 Å²	111	138.7 Å²	138.7	78%	0.776	77%	0.773	S	S	*	*			trans	-138.8	128.4	-176.3	-176.4	0	0	0	0	113.4
751	I	35.3	Very low	31.2	Very low	165 Å²	165	141.5 Å²	141.5	85%	0.846	78%	0.78	S	S	*	*			trans	-146.9	125	160.3	-49.4	179.9	0	0	0	102.2
752	G	29.1	Very low	31.2	Very low	51 Å²	51	142 Å²	142	53%	0.526	79%	0.786	S	S	.	*				85.9	117	59.8	0	0	0	0	0	107.7
753	D	32.6	Very low	31.1	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	79%	0.794	S	S	*	*			cis	-147.8	176.3	14.8	-72.3	-50	0	0	0	113.1
754	H	33.9	Very low	31.4	Very low	160 Å²	160	144.1 Å²	144.1	74%	0.741	79%	0.794	S	S	*	*			trans	10.9	145.2	147.4	-70.3	-110.8	0	0	0	120.2
755	E	31.1	Very low	31.5	Very low	153 Å²	153	142 Å²	142	72%	0.715	79%	0.79	S	S	*	*			cis	-154.2	163.6	12.1	-147	158.1	-114.1	0	0	112.5
756	N	27.7	Very low	31.6	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	78%	0.782	S	S	*	*			trans	-143.3	78.1	179.5	-175.7	25.6	0	0	0	112	Q758	N756-Q758 PolarHBondContact O-N 3.29Å
757	T	33.4	Very low	31.6	Very low	101 Å²	101	140.8 Å²	140.8	62%	0.62	77%	0.774	S	S	*	*			trans	-97.3	96.6	-170.4	-48.3	0	0	0	0	111.6	V759	T757-V759 HydrophobicContact CG2-CG2 4.08Å; T757-V759 PolarHBondContact O-N 3.1Å
758	Q	29.2	Very low	31.8	Very low	187 Å²	187	144.1 Å²	144.1	87%	0.874	78%	0.777	S	S	*	*			trans	-78.2	98.6	-178.4	-179	-179.3	51.5	0	0	111.7	N756	N756-Q758 PolarHBondContact O-N 3.29Å
759	V	35.5	Very low	31.8	Very low	123 Å²	123	144.7 Å²	144.7	75%	0.745	77%	0.774	S	S	*	*			trans	-121.6	131.5	176.8	-174.4	0	0	0	0	112.8	T757	T757-V759 HydrophobicContact CG2-CG2 4.08Å; T757-V759 PolarHBondContact O-N 3.1Å
760	N	33.2	Very low	32	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	77%	0.769	S	S	*	*			trans	-58.5	142.6	-172	-61.2	-66.9	0	0	0	115.8	K762	N760-K762 PolarHBondContact O-N 3.17Å
761	N	29.6	Very low	32.5	Very low	168 Å²	168	138.1 Å²	138.1	90%	0.898	76%	0.763	S	S	*	*			trans	-59	129.7	159.6	-73	-46.1	0	0	0	111.5
762	K	32.1	Very low	32.6	Very low	204 Å²	204	137.3 Å²	137.3	89%	0.887	76%	0.761	S	S	*	*			trans	-151.5	128.6	155.6	-120.8	177.8	-176.4	179	0	110.6	N760	N760-K762 PolarHBondContact O-N 3.17Å
763	A	29.6	Very low	33	Very low	103 Å²	103	141.7 Å²	141.7	85%	0.851	77%	0.772	S	S	*	*			trans	-97.1	119	-174.8	0	0	0	0	0	112.2
764	I	33.8	Very low	33.4	Very low	155 Å²	155	139.7 Å²	139.7	80%	0.795	77%	0.765	S	S	*	*			trans	-142.8	96.2	165.3	-58.1	178.9	0	0	0	103.4
765	K	33.1	Very low	33.5	Very low	180 Å²	180	138 Å²	138	78%	0.783	76%	0.761	S	S	*	*				55.4	123.7	72.2	-106.7	-161.8	175.2	-165.7	0	114.9
766	N	29.9	Very low	33.9	Very low	112 Å²	112	137.2 Å²	137.2	60%	0.599	76%	0.762	S	S	*	*			trans	81.3	133.9	146.6	-84	72.8	0	0	0	120.2
767	D	35.3	Very low	34.6	Very low	140 Å²	140	135.9 Å²	135.9	75%	0.749	76%	0.755	S	S	*	*			trans	69.3	152.9	142.2	-48.6	-12.8	0	0	0	119.6
768	D	32.3	Very low	35	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	76%	0.759	S	S	*	*			cis	-169.3	173.2	-32.8	-164.7	4.5	0	0	0	108.6
769	L	34.6	Very low	35.4	Very low	153 Å²	153	134.9 Å²	134.9	80%	0.801	75%	0.752	S	S	*	*			trans	66.4	120.7	157.7	-55.7	177.7	0	0	0	122.7
770	G	33.4	Very low	35.6	Very low	78 Å²	78	133.6 Å²	133.6	80%	0.804	75%	0.748	S	S	*	*				99.2	157.4	129.4	0	0	0	0	0	119.2
771	A	37.8	Very low	35.9	Very low	78 Å²	78	135.3 Å²	135.3	65%	0.645	75%	0.748	S	S	*	*			cis	-167.5	170.3	-12.4	0	0	0	0	0	111.3
772	N	37.6	Very low	36.5	Very low	148 Å²	148	134.7 Å²	134.7	79%	0.791	74%	0.74	S	S	*	*			trans	76.7	142.7	162.9	-47.1	-42.1	0	0	0	116.2
773	N	36.7	Very low	36.8	Very low	144 Å²	144	132.1 Å²	132.1	77%	0.77	74%	0.736	S	S	*	*			cis	-162.1	176.7	-3	-141.2	-13.4	0	0	0	114.5
774	V	41.4	Very low	37	Very low	106 Å²	106	135.4 Å²	135.4	64%	0.642	74%	0.739	S	S	*	*			trans	81.7	104.8	153.4	168.6	0	0	0	0	119.2
775	N	37.1	Very low	37.2	Very low	124 Å²	124	131.9 Å²	131.9	66%	0.663	74%	0.741	S	S	*	*			trans	61.8	134.2	137.5	-64.4	55.1	0	0	0	120.6
776	D	39.3	Very low	37.4	Very low	137 Å²	137	129 Å²	129	73%	0.733	74%	0.739	S	S	*	*			cis	-151.1	-167.9	-5.8	-86.1	-37	0	0	0	107
777	D	41.7	Very low	37.7	Very low	129 Å²	129	131.7 Å²	131.7	69%	0.69	75%	0.745	S	S	*	*			cis	-155.2	-167.4	14.6	-167.5	17.8	0	0	0	111.7
778	Q	41.1	Very low	37.8	Very low	148 Å²	148	135 Å²	135	69%	0.692	75%	0.748	S	S	*	*			trans	-63.6	155.2	179.4	-53.3	148.5	77.5	0	0	113.6
779	T	38.4	Very low	37.7	Very low	119 Å²	119	139.7 Å²	139.7	73%	0.73	76%	0.755	S	S	*	*			cis	-159.8	119.5	43.4	28.5	0	0	0	0	114.6
780	S	39.6	Very low	37.9	Very low	95 Å²	95	138 Å²	138	66%	0.664	76%	0.756	S	S	*	*			trans	41.7	141.1	137	85.8	0	0	0	0	125.3
781	K	40.2	Very low	38.1	Very low	184 Å²	184	142.1 Å²	142.1	80%	0.8	75%	0.754	S	S	*	*			trans	79.7	148.6	149.1	-68.6	168.5	-178.9	170.4	0	120
782	Q	40.9	Very low	38.3	Very low	155 Å²	155	146.3 Å²	146.3	72%	0.724	77%	0.766	S	S	*	*			cis	-175.7	127.4	-33.3	-132.3	176.2	-15.4	0	0	109.6
783	N	39.5	Very low	38.2	Very low	150 Å²	150	150.2 Å²	150.2	80%	0.802	77%	0.77	S	S	*	*				151.8	141.5	128.2	-78.6	-24.4	0	0	0	114.8
784	N	33.3	Very low	38.6	Very low	173 Å²	173	151.5 Å²	151.5	93%	0.925	78%	0.776	S	S	*	*			trans	-99.7	158.4	175.2	-81.8	-36.6	0	0	0	111.6
785	G	38.4	Very low	38.6	Very low	81 Å²	81	156.4 Å²	156.4	84%	0.835	79%	0.789	S	S	*	*			trans	-162	83	174.7	0	0	0	0	0	113.7
786	T	35.9	Very low	39.1	Very low	119 Å²	119	155.6 Å²	155.6	73%	0.73	80%	0.8	S	S	*	*			trans	-82.5	149	174.1	43.9	0	0	0	0	112.1
787	F	36.6	Very low	39	Very low	168 Å²	168	160.7 Å²	160.7	74%	0.737	81%	0.809	S	S	*	*				169.2	143	116.7	-98.8	-67.6	0	0	0	116.5
788	R	37.8	Very low	39.2	Very low	211 Å²	211	159.3 Å²	159.3	80%	0.796	82%	0.815	S	S	*	*			trans	50.8	101.4	147.4	-80.5	157	-170.4	-176.5	4.3	121.5
789	R	31.1	Very low	39.4	Very low	234 Å²	234	161.9 Å²	161.9	88%	0.883	85%	0.849	S	S	*	*				28.3	113.9	103.1	-171.9	-173.2	-166.2	179.6	6.3	117.2
790	S	38.3	Very low	39.4	Very low	118 Å²	118	164 Å²	164	83%	0.825	86%	0.855	S	S	*	*			trans	-141.4	152.6	148.5	-168.7	0	0	0	0	110.6
791	Q	38.1	Very low	39.4	Very low	163 Å²	163	167.6 Å²	167.6	76%	0.762	87%	0.865	S	S	*	*			trans	-94.4	150.8	172.4	-68	178.3	-27.2	0	0	109.8
792	N	40.7	Very low	39.4	Very low	167 Å²	167	166.7 Å²	166.7	89%	0.893	87%	0.869	S	S	*	*				-156.7	149.4	126.3	-115.6	-33.9	0	0	0	113.4
793	R	36.3	Very low	39.3	Very low	229 Å²	229	167.4 Å²	167.4	86%	0.864	88%	0.877	S	S	*	*			trans	-83.3	152.5	167	-68.5	168.7	166.8	161.1	-6	108.8
794	N	45.9	Very low	39.3	Very low	171 Å²	171	168.5 Å²	168.5	91%	0.914	88%	0.882	S	S	*	*			trans	-152.6	150.5	133	-108.9	-29.3	0	0	0	112.2
795	K	39.9	Very low	39.7	Very low	209 Å²	209	168.2 Å²	168.2	91%	0.909	88%	0.879	S	S	*	*			trans	-94.1	144	175.9	-68.7	174.9	174.5	177.5	0	109.7
796	A	48.3	Very low	39.8	Very low	107 Å²	107	174.4 Å²	174.4	88%	0.884	88%	0.882	S	S	*	*			trans	-139.4	143.9	151.5	0	0	0	0	0	108.6
797	R	36.9	Very low	40.1	Very low	245 Å²	245	178.7 Å²	178.7	93%	0.925	89%	0.894	S	S	*	*			trans	-153.9	105	-176.1	176.6	-161.8	-175.1	-162.9	3.8	108.5
798	A	46.5	Very low	40.4	Very low	99 Å²	99	179.6 Å²	179.6	82%	0.818	91%	0.907	S	S	*	*			trans	-167.4	80	171.1	0	0	0	0	0	113.5
799	S	45	Very low	40.6	Very low	202 Å²	202	176.7 Å²	176.7	100%	1.413	92%	0.917	S	S	*	*			trans	-172.9	0	133	-75.7	0	0	0	0	108

Retrieved 799 of 799 residues in 216.5 ms (Link to these results)

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