A0A3Q0KV40_SCHMA Loading...

Putative nucleotide binding protein 2 (Nbp 2) AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KV40, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 271 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	D	37.6	Very low	48.4	Very low	214 Å²	214	116.1 Å²	116.1	100%	1.144	61%	0.606	S	S	*	*				0	87	0	-59.8	-16	0	0	0	110.6	S3	D1-S3 PolarHBondContact O-N 2.71Å
2	I	37.3	Very low	51.9	Low	159 Å²	159	106.7 Å²	106.7	82%	0.815	56%	0.556	S	S	*	*			trans	-77.8	106.3	163.1	-61.2	169.4	0	0	0	103.7	D4	I2-D4 PolarHBondContact O-N 3.42Å
3	S	35.2	Very low	54.6	Low	68 Å²	68	108.6 Å²	108.6	48%	0.476	56%	0.558	S	S	.	*			trans	-58	133	177	50.1	0	0	0	0	109.7	D1 K5 D6	D1-S3 PolarHBondContact O-N 2.71Å; S3-K5 PolarHBondContact O-N 3.34Å; S3-D6 PolarHBondContact O-N 3.29Å
4	D	40.3	Very low	57.1	Low	134 Å²	134	106.1 Å²	106.1	72%	0.717	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-51	0.7	173.2	-83.7	-38	0	0	0	115.5	I2	I2-D4 PolarHBondContact O-N 3.42Å
5	K	39.1	Very low	59.5	Low	186 Å²	186	99.3 Å²	99.3	81%	0.809	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-80.1	-11.2	176.9	-69	-173.4	175.6	-178	0	114.4	S3	S3-K5 PolarHBondContact O-N 3.34Å
6	D	35.8	Very low	61.5	Low	125 Å²	125	100.8 Å²	100.8	67%	0.668	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-99.5	5	177.1	-69.8	-29.5	0	0	0	113.9	S3 I8	S3-D6 PolarHBondContact O-N 3.29Å; D6-I8 PolarHBondContact O-N 3.28Å
7	L	42.6	Very low	63.5	Low	111 Å²	111	97.1 Å²	97.1	58%	0.581	49%	0.493	S	S	*	.	S	Bend	trans	-67.7	108.2	164.3	-76.4	160.9	0	0	0	107.3	H9	L7-H9 VanDerWaalsContact C-N 3.28Å; L7-H9 PolarHBondContact O-N 3.32Å
8	I	50.2	Low	65.3	Low	138 Å²	138	91.7 Å²	91.7	71%	0.708	47%	0.465	S	S	*	.			trans	-53.7	96.8	173.5	-60	169.3	0	0	0	106.8	D6 P10	D6-I8 PolarHBondContact O-N 3.28Å; I8-P10 VanDerWaalsContact O-CD 3.28Å; I8-P10 WeakPolarHBondContact O-CD 3.38Å; I8-P10 VanDerWaalsContact O-N 3.08Å
9	H	53.6	Low	66.9	Low	108 Å²	108	86.8 Å²	86.8	50%	0.5	44%	0.441	S	S	.	.			trans	-59.8	118.8	176.5	-79.2	-70	0	0	0	107.4	L7	L7-H9 VanDerWaalsContact C-N 3.28Å; L7-H9 PolarHBondContact O-N 3.32Å
10	P	73.7	Confident	68.3	Low	28 Å²	28	82.5 Å²	82.5	18%	0.182	42%	0.419	C	S	.	.	S	Bend	trans	-62.5	142.7	171.8	14	-8.9	0	0	0	107.7	I8 E76 N122 S123 V124	I8-P10 VanDerWaalsContact O-CD 3.28Å; I8-P10 WeakPolarHBondContact O-CD 3.38Å; I8-P10 VanDerWaalsContact O-N 3.08Å; P10-E76 WeakPolarHBondContact CG-O 3.25Å; P10-N122 CarbonylContact O-C 3.55Å; P10-S123 PolarHBondContact O-N 3.15Å; P10-V124 CarbonylContact C-O 3.41Å; P10-V124 WeakPolarHBondContact CB-O 3.43Å
11	G	87.1	Confident	69.7	Low	6 Å²	6	78.6 Å²	78.6	6%	0.062	40%	0.399	C	S	.	.	S	Bend	trans	142.9	-165.3	-174.2	0	0	0	0	0	110.8	K13 L121 V124	G11-K13 VanDerWaalsContact C-N 3.27Å; G11-K13 PolarHBondContact O-N 3.21Å; G11-L121 CarbonylContact C-O 3.56Å; G11-L121 WeakPolarHBondContact CA-O 3.31Å; G11-V124 PolarHBondContact N-O 3.3Å
12	I	90.2	Very high	72.4	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.015	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-78.8	-1.3	-169.1	64.5	175.9	0	0	0	115.4	N14 I15 L121 L132 L151 V158	I12-N14 PolarHBondContact O-N 2.96Å; I12-N14 VanDerWaalsContact O-N 3.15Å; I12-I15 HydrophobicContact CB-CD1 3.89Å; I12-I15 HydrophobicContact CB-CG1 4.41Å; I12-I15 HydrophobicContact CG2-CD1 3.83Å; I12-I15 VanDerWaalsContact O-CB 3.3Å; I12-I15 WeakPolarHBondContact O-CB 3.37Å; I12-I15 WeakPolarHBondContact O-CG1 3.46Å; I12-I15 PolarHBondContact O-N 3.1Å; I12-L121 HydrophobicContact CG2-CD2 4.07Å; I12-L121 PolarHBondContact N-O 3.26Å; I12-L121 VanDerWaalsContact N-O 3.11Å; I12-L132 HydrophobicContact CG2-CD2 3.86Å; I12-L151 HydrophobicContact CD1-CD2 3.48Å; I12-L151 VanDerWaalsContact CD1-CD2 3.48Å; I12-V158 WeakPolarHBondContact O-CG2 3.26Å
13	K	87.2	Confident	75.1	Confident	132 Å²	132	60.8 Å²	60.8	57%	0.574	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-60	-28.3	-174.5	-66.7	-176.1	178.6	-178.8	0	114.5	G11	G11-K13 VanDerWaalsContact C-N 3.27Å; G11-K13 PolarHBondContact O-N 3.21Å
14	N	88.8	Confident	77.7	Confident	74 Å²	74	58.1 Å²	58.1	40%	0.396	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-98.3	18.5	-179.7	-69.6	-42.3	0	0	0	113	I12 G127 K128 L129	I12-N14 PolarHBondContact O-N 2.96Å; I12-N14 VanDerWaalsContact O-N 3.15Å; N14-G127 VanDerWaalsContact CB-O 3.3Å; N14-G127 WeakPolarHBondContact CB-O 2.9Å; N14-K128 HydrophobicContact CB-CG 4.48Å; N14-L129 PolarHBondContact O-N 3.12Å
15	I	93	Very high	79.9	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124.9	-180	-52.9	-175.8	0	0	0	108.1	I12 H17 V18 W126 L129 L132	I12-I15 HydrophobicContact CB-CD1 3.89Å; I12-I15 HydrophobicContact CB-CG1 4.41Å; I12-I15 HydrophobicContact CG2-CD1 3.83Å; I12-I15 VanDerWaalsContact O-CB 3.3Å; I12-I15 WeakPolarHBondContact O-CB 3.37Å; I12-I15 WeakPolarHBondContact O-CG1 3.46Å; I12-I15 PolarHBondContact O-N 3.1Å; I15-H17 WeakPolarHBondContact CG2-O 3.41Å; I15-V18 HydrophobicContact CG2-CG2 4.04Å; I15-W126 HydrophobicContact CD1-CB 4.1Å; I15-W126 HydrophobicContact CD1-CD2 4.4Å; I15-W126 HydrophobicContact CD1-CG 3.92Å; I15-L129 WeakPolarHBondContact CA-O 3.39Å; I15-L129 HydrophobicContact CD1-CD1 4.2Å; I15-L129 HydrophobicContact CG1-CB 4.16Å; I15-L129 HydrophobicContact CG1-CD1 4.44Å; I15-L129 HydrophobicContact CG2-CB 4.19Å; I15-L132 HydrophobicContact CD1-CB 3.83Å; I15-L132 HydrophobicContact CD1-CD2 3.57Å; I15-L132 HydrophobicContact CD1-CG 4.23Å; I15-L132 HydrophobicContact CG2-CB 3.76Å
16	K	93	Very high	82.2	Confident	123 Å²	123	47.7 Å²	47.7	54%	0.535	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	-49	-177.5	-61.1	178	-175.9	162.3	0	112	L129 D130 D159	K16-L129 PolarHBondContact N-O 3.38Å; K16-D130 WeakPolarHBondContact CE-OD1 3.39Å; K16-D130 IonicContact NZ-OD1 2.88Å; K16-D130 PolarHBondContact NZ-OD1 3.17Å; K16-D159 PolarHBondContact O-N 2.88Å
17	H	94.8	Very high	84.8	Confident	38 Å²	38	45.2 Å²	45.2	18%	0.176	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133.4	-178.9	-56.5	-84.1	0	0	0	111.7	I15 D130 Y131 L132 D159	I15-H17 WeakPolarHBondContact CG2-O 3.41Å; H17-D130 PolarHBondContact N-O 3.06Å; H17-Y131 HydrophobicContact CB-CD1 3.66Å; H17-Y131 HydrophobicContact CB-CE1 3.81Å; H17-Y131 AromaticContact CD2-CE1 3.68Å; H17-Y131 AromaticContact CG-CE1 3.89Å; H17-Y131 CarbonylContact O-C 3.58Å; H17-Y131 VanDerWaalsContact O-CA 3.3Å; H17-Y131 WeakPolarHBondContact O-CA 3.23Å; H17-L132 PolarHBondContact O-N 3.38Å; H17-D159 CarbonylContact C-O 3.6Å; H17-D159 WeakPolarHBondContact CA-O 3.15Å; H17-D159 IonicContact CE1-OD2 3.17Å; H17-D159 PolarHBondContact CE1-OD2 3.03Å; H17-D159 IonicContact ND1-OD2 3.93Å; H17-D159 PolarHBondContact ND1-OD2 3.28Å
18	V	95.3	Very high	87.2	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.3	172.5	175	0	0	0	0	109.1	I15 V20 L132 I134 L151 V158 D159 V160 G161	I15-V18 HydrophobicContact CG2-CG2 4.04Å; V18-V20 HydrophobicContact CG1-CG2 4.24Å; V18-L132 CarbonylContact C-O 3.57Å; V18-L132 WeakPolarHBondContact CA-O 3.38Å; V18-L132 HydrophobicContact CG2-CB 4.31Å; V18-I134 HydrophobicContact CG1-CD1 3.41Å; V18-I134 VanDerWaalsContact CG1-CD1 3.41Å; V18-I134 HydrophobicContact CG1-CG1 3.94Å; V18-L151 HydrophobicContact CG1-CD1 4.26Å; V18-L151 HydrophobicContact CG1-CD2 4.03Å; V18-V158 HydrophobicContact CB-CG1 4.21Å; V18-V158 HydrophobicContact CG2-CG1 3.46Å; V18-V158 VanDerWaalsContact CG2-CG1 3.46Å; V18-D159 PolarHBondContact N-O 3.49Å; V18-V160 HydrophobicContact CB-CG2 4.18Å; V18-V160 WeakPolarHBondContact O-CA 3.47Å; V18-G161 PolarHBondContact O-N 3.4Å
19	L	96.5	Very high	89.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	103.4	-179.6	-58.5	179.3	0	0	0	109.6	L37 L41 Y131 L132 V133 I134 G161 I163 I265 L269	L19-L37 HydrophobicContact CD1-CD2 4.06Å; L19-L41 HydrophobicContact CD1-CD1 4.15Å; L19-Y131 HydrophobicContact CD1-CD1 4.17Å; L19-L132 PolarHBondContact N-O 3.19Å; L19-V133 CarbonylContact O-C 3.42Å; L19-V133 WeakPolarHBondContact O-CA 3.46Å; L19-I134 PolarHBondContact O-N 3.3Å; L19-G161 CarbonylContact C-O 3.45Å; L19-G161 WeakPolarHBondContact CA-O 3.42Å; L19-I163 HydrophobicContact CB-CD1 4.28Å; L19-I163 HydrophobicContact CD1-CD1 4.45Å; L19-I265 HydrophobicContact CD1-CG2 4.15Å; L19-L269 HydrophobicContact CD1-CD1 4.14Å; L19-L269 HydrophobicContact CD2-CD1 3.76Å; L19-L269 HydrophobicContact CD2-CD2 4.05Å; L19-L269 HydrophobicContact CG-CD1 4.46Å
20	V	95.6	Very high	91.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	116.6	178.6	-174.8	0	0	0	0	109.2	V18 T136 L148 L151 V160 G161 I162 I163	V18-V20 HydrophobicContact CG1-CG2 4.24Å; V20-T136 HydrophobicContact CG1-CG2 3.45Å; V20-T136 VanDerWaalsContact CG1-CG2 3.45Å; V20-L148 HydrophobicContact CG1-CD2 4.18Å; V20-L148 HydrophobicContact CG2-CD2 4.41Å; V20-L151 HydrophobicContact CG2-CD1 3.39Å; V20-V160 HydrophobicContact CG2-CG1 4.08Å; V20-G161 PolarHBondContact N-O 3.43Å; V20-I162 HydrophobicContact CB-CG1 4.36Å; V20-I162 CarbonylContact O-C 3.42Å; V20-I162 WeakPolarHBondContact O-CA 3.35Å; V20-I163 PolarHBondContact O-N 2.97Å
21	V	96.5	Very high	92.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	118.1	176.8	-170.4	0	0	0	0	108.6	K30 A34 L37 V133 I134 T136 I163 V165	V21-K30 HydrophobicContact CG1-CG 3.95Å; V21-A34 HydrophobicContact CB-CB 4.02Å; V21-A34 HydrophobicContact CG1-CB 4.16Å; V21-A34 HydrophobicContact CG2-CB 3.97Å; V21-L37 HydrophobicContact CG2-CD2 4.49Å; V21-V133 HydrophobicContact CG2-CG1 3.63Å; V21-I134 PolarHBondContact N-O 3.36Å; V21-T136 PolarHBondContact O-N 2.55Å; V21-T136 VanDerWaalsContact O-N 3.16Å; V21-T136 PolarHBondContact O-OG1 3.36Å; V21-I163 WeakPolarHBondContact CA-O 3.48Å; V21-I163 HydrophobicContact CG2-CB 4.49Å; V21-V165 HydrophobicContact CG1-CG2 3.68Å
22	T	94.6	Very high	92.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	167.4	-177.9	-174.1	0	0	0	0	111	T136 H144 I162 I163 I164 V165 E179	T22-T136 WeakPolarHBondContact CA-OG1 3.41Å; T22-T136 WeakPolarHBondContact CB-OG1 3.36Å; T22-H144 PolarHBondContact OG1-CE1 2.65Å; T22-I162 HydrophobicContact CG2-CG2 3.68Å; T22-I163 PolarHBondContact N-O 3.48Å; T22-I164 HydrophobicContact CG2-CB 4.33Å; T22-I164 HydrophobicContact CG2-CG1 3.8Å; T22-I164 HydrophobicContact CG2-CG2 4.41Å; T22-I164 CarbonylContact O-C 3.44Å; T22-V165 PolarHBondContact O-N 2.87Å; T22-E179 WeakPolarHBondContact CB-OE1 3.23Å; T22-E179 HydrophobicContact CG2-CG 3.98Å; T22-E179 WeakPolarHBondContact CG2-OE1 3.35Å; T22-E179 PolarHBondContact OG1-OE1 3.3Å
23	S	93.5	Very high	93	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	151.4	173.6	60.2	0	0	0	0	110.6	K25 P138 G139 V165	S23-K25 PolarHBondContact O-N 2.96Å; S23-K25 PolarHBondContact OG-O 2.74Å; S23-P138 CarbonylContact O-C 3.53Å; S23-P138 WeakPolarHBondContact O-CA 3.27Å; S23-G139 PolarHBondContact O-N 3.07Å; S23-V165 VanDerWaalsContact CB-O 3.27Å; S23-V165 WeakPolarHBondContact CB-O 3.49Å
24	G	89.4	Confident	93.5	Very high	12 Å²	12	24.5 Å²	24.5	12%	0.124	16%	0.16	C	C	.	.	S	Bend	trans	-67.2	-23	178	0	0	0	0	0	114.4	D175	G24-D175 WeakPolarHBondContact O-CB 3.26Å
25	K	87.3	Confident	93.9	Very high	50 Å²	50	21 Å²	21	22%	0.217	14%	0.141	C	C	.	.	S	Bend	trans	-148.7	165.5	-179.2	67.5	177.6	-172.1	176.4	0	111.8	S23 V28 S172	S23-K25 PolarHBondContact O-N 2.96Å; S23-K25 PolarHBondContact OG-O 2.74Å; K25-V28 HydrophobicContact CD-CG1 4.43Å; K25-V28 HydrophobicContact CG-CG1 3.71Å; K25-S172 WeakPolarHBondContact CE-OG 3.42Å
26	G	88.4	Confident	94.1	Very high	50 Å²	50	21 Å²	21	52%	0.515	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	161.8	171.8	0	0	0	0	0	113	V28	G26-V28 VanDerWaalsContact C-N 3.33Å; G26-V28 PolarHBondContact O-N 3.06Å
27	G	88.8	Confident	94.3	Very high	74 Å²	74	15.3 Å²	15.3	76%	0.763	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.3	7.7	173	0	0	0	0	0	116.1	G29	G27-G29 VanDerWaalsContact C-N 3.29Å; G27-G29 PolarHBondContact O-N 2.71Å
28	V	92.7	Very high	94.5	Very high	2 Å²	2	13.5 Å²	13.5	1%	0.012	11%	0.108	C	C	.	.	S	Bend	trans	-84.1	-0.2	177.2	-55.1	0	0	0	0	113.9	K25 G26 K30 V165 T167 N196	K25-V28 HydrophobicContact CD-CG1 4.43Å; K25-V28 HydrophobicContact CG-CG1 3.71Å; G26-V28 VanDerWaalsContact C-N 3.33Å; G26-V28 PolarHBondContact O-N 3.06Å; V28-K30 HydrophobicContact CG2-CB 4.14Å; V28-V165 HydrophobicContact CG2-CB 4.33Å; V28-V165 HydrophobicContact CG2-CG1 4.03Å; V28-T167 HydrophobicContact CB-CG2 3.9Å; V28-T167 HydrophobicContact CG1-CG2 4.03Å; V28-N196 PolarHBondContact O-ND2 3.35Å
29	G	93.7	Very high	94.5	Very high	16 Å²	16	13.5 Å²	13.5	17%	0.165	11%	0.108	C	C	.	.	S	Bend	trans	79.5	22.3	-174.9	0	0	0	0	0	114.8	G27 S31 T32 V33	G27-G29 VanDerWaalsContact C-N 3.29Å; G27-G29 PolarHBondContact O-N 2.71Å; G29-S31 PolarHBondContact O-N 3.26Å; G29-T32 WeakPolarHBondContact O-CB 3.5Å; G29-T32 PolarHBondContact O-N 3.05Å; G29-V33 WeakPolarHBondContact O-CG2 3.36Å; G29-V33 PolarHBondContact O-N 2.79Å
30	K	95.5	Very high	94.6	Very high	8 Å²	8	13.8 Å²	13.8	4%	0.035	11%	0.11	C	C	.	.	H	α-helix	trans	-47.7	-54.2	177.1	177.6	-172.4	44.5	71.3	0	112.5	V21 V28 T32 V33 A34 D54 D135 T136	V21-K30 HydrophobicContact CG1-CG 3.95Å; V28-K30 HydrophobicContact CG2-CB 4.14Å; K30-T32 VanDerWaalsContact C-N 3.35Å; K30-T32 PolarHBondContact O-N 3.44Å; K30-V33 WeakPolarHBondContact O-CB 3.12Å; K30-V33 PolarHBondContact O-N 3.22Å; K30-V33 VanDerWaalsContact O-N 3.13Å; K30-A34 PolarHBondContact O-N 2.81Å; K30-D54 IonicContact NZ-OD2 2.72Å; K30-D54 PolarHBondContact NZ-OD2 2.93Å; K30-D135 WeakPolarHBondContact CG-OD1 3.15Å; K30-D135 IonicContact NZ-OD1 3.06Å; K30-D135 PolarHBondContact NZ-OD1 2.78Å; K30-D135 IonicContact NZ-OD2 3.05Å; K30-T136 VanDerWaalsContact CD-O 3.31Å; K30-T136 WeakPolarHBondContact CD-O 3.47Å; K30-T136 WeakPolarHBondContact CE-O 2.92Å; K30-T136 PolarHBondContact NZ-O 3Å
31	S	95.8	Very high	94.6	Very high	13 Å²	13	13.8 Å²	13.8	9%	0.091	11%	0.11	C	C	.	.	H	α-helix	trans	-65.2	-36.6	-177.6	-50.9	0	0	0	0	113.1	G29 A34 A35 S59 I60 D135	G29-S31 PolarHBondContact O-N 3.26Å; S31-A34 PolarHBondContact O-N 2.79Å; S31-A35 WeakPolarHBondContact O-CB 3.48Å; S31-A35 PolarHBondContact O-N 3.07Å; S31-S59 WeakPolarHBondContact CB-OG 3.25Å; S31-S59 PolarHBondContact OG-OG 3.36Å; S31-I60 WeakPolarHBondContact O-CD1 3.44Å; S31-D135 WeakPolarHBondContact CA-OD2 3.41Å; S31-D135 WeakPolarHBondContact CB-OD2 2.85Å; S31-D135 PolarHBondContact OG-OD2 2.8Å
32	T	95.8	Very high	94.7	Very high	43 Å²	43	15 Å²	15	26%	0.264	11%	0.114	S	C	.	.	H	α-helix	trans	-62.3	-45	172.5	-51.4	0	0	0	0	110.8	G29 K30 A35 Q36 L238	G29-T32 WeakPolarHBondContact O-CB 3.5Å; G29-T32 PolarHBondContact O-N 3.05Å; K30-T32 VanDerWaalsContact C-N 3.35Å; K30-T32 PolarHBondContact O-N 3.44Å; T32-A35 PolarHBondContact O-N 2.89Å; T32-Q36 HydrophobicContact CG2-CG 4.35Å; T32-Q36 WeakPolarHBondContact O-CB 3.26Å; T32-Q36 WeakPolarHBondContact O-CG 3.36Å; T32-Q36 PolarHBondContact O-N 3.38Å; T32-L238 HydrophobicContact CG2-CD2 3.91Å; T32-L238 HydrophobicContact CG2-CG 4.27Å
33	V	96.8	Very high	94.7	Very high	8 Å²	8	18.6 Å²	18.6	5%	0.048	13%	0.134	C	C	.	.	H	α-helix	trans	-62.5	-43.4	175.9	172.8	0	0	0	0	111.1	G29 K30 Q36 L37 V165 I194 N196 L232	G29-V33 WeakPolarHBondContact O-CG2 3.36Å; G29-V33 PolarHBondContact O-N 2.79Å; K30-V33 WeakPolarHBondContact O-CB 3.12Å; K30-V33 PolarHBondContact O-N 3.22Å; K30-V33 VanDerWaalsContact O-N 3.13Å; V33-Q36 PolarHBondContact O-N 3.29Å; V33-L37 VanDerWaalsContact O-CB 3.29Å; V33-L37 WeakPolarHBondContact O-CB 3.28Å; V33-L37 PolarHBondContact O-N 3.49Å; V33-V165 HydrophobicContact CB-CG2 4.2Å; V33-V165 HydrophobicContact CG1-CG2 3.95Å; V33-V165 HydrophobicContact CG2-CG1 4.16Å; V33-I194 HydrophobicContact CG1-CD1 3.69Å; V33-N196 HydrophobicContact CG2-CB 4.42Å; V33-L232 HydrophobicContact CG2-CD1 3.74Å
34	A	97.5	Very high	94.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.3	-49.7	177.4	0	0	0	0	0	112	V21 K30 S31 Q36 L37 A38 I50 V133 D135	V21-A34 HydrophobicContact CB-CB 4.02Å; V21-A34 HydrophobicContact CG1-CB 4.16Å; V21-A34 HydrophobicContact CG2-CB 3.97Å; K30-A34 PolarHBondContact O-N 2.81Å; S31-A34 PolarHBondContact O-N 2.79Å; A34-Q36 PolarHBondContact O-N 3.29Å; A34-L37 PolarHBondContact O-N 3.43Å; A34-A38 PolarHBondContact O-N 2.79Å; A34-I50 HydrophobicContact CB-CD1 4.17Å; A34-V133 HydrophobicContact CB-CG1 3.92Å; A34-D135 HydrophobicContact CB-CB 4.05Å
35	A	97.3	Very high	95	Very high	0 Å²	0	24 Å²	24	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.9	-46.4	177.2	0	0	0	0	0	111.9	S31 T32 A38 I39 I50 I60 I63 L64	S31-A35 WeakPolarHBondContact O-CB 3.48Å; S31-A35 PolarHBondContact O-N 3.07Å; T32-A35 PolarHBondContact O-N 2.89Å; A35-A38 PolarHBondContact O-N 3.36Å; A35-I39 WeakPolarHBondContact O-CB 3.31Å; A35-I39 VanDerWaalsContact O-CG1 3.28Å; A35-I39 WeakPolarHBondContact O-CG1 3.49Å; A35-I39 PolarHBondContact O-N 3.41Å; A35-I50 HydrophobicContact CB-CD1 4.44Å; A35-I60 HydrophobicContact CB-CD1 3.91Å; A35-I63 HydrophobicContact CB-CB 4.47Å; A35-I63 HydrophobicContact CB-CG2 3.5Å; A35-I63 VanDerWaalsContact CB-CG2 3.5Å; A35-L64 HydrophobicContact CB-CD2 4.29Å
36	Q	97.1	Very high	95.4	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.019	18%	0.182	C	C	.	.	H	α-helix	trans	-64.4	-40.8	179.4	-78.3	-68.1	-64.5	0	0	112.2	T32 V33 A34 I39 N40 L238 Y253 T258	T32-Q36 HydrophobicContact CG2-CG 4.35Å; T32-Q36 WeakPolarHBondContact O-CB 3.26Å; T32-Q36 WeakPolarHBondContact O-CG 3.36Å; T32-Q36 PolarHBondContact O-N 3.38Å; V33-Q36 PolarHBondContact O-N 3.29Å; A34-Q36 PolarHBondContact O-N 3.29Å; Q36-I39 PolarHBondContact O-N 2.69Å; Q36-N40 WeakPolarHBondContact O-CB 3.48Å; Q36-N40 PolarHBondContact O-N 3.01Å; Q36-N40 PolarHBondContact O-ND2 3.07Å; Q36-L238 HydrophobicContact CG-CD1 3.89Å; Q36-L238 HydrophobicContact CG-CD2 4.13Å; Q36-L238 VanDerWaalsContact NE2-CD1 3.3Å; Q36-Y253 PolarHBondContact NE2-O 3.11Å; Q36-Y253 PolarHBondContact OE1-O 3.26Å; Q36-T258 HydrophobicContact CB-CG2 3.66Å; Q36-T258 HydrophobicContact CG-CG2 4.44Å
37	L	97.7	Very high	95.8	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-59.6	-48.5	173.4	176.9	59.1	0	0	0	110.9	L19 V21 V33 A34 I39 N40 L41 V133 I163 T262 I265	L19-L37 HydrophobicContact CD1-CD2 4.06Å; V21-L37 HydrophobicContact CG2-CD2 4.49Å; V33-L37 VanDerWaalsContact O-CB 3.29Å; V33-L37 WeakPolarHBondContact O-CB 3.28Å; V33-L37 PolarHBondContact O-N 3.49Å; A34-L37 PolarHBondContact O-N 3.43Å; L37-I39 PolarHBondContact O-N 2.86Å; L37-N40 PolarHBondContact O-N 3.1Å; L37-L41 HydrophobicContact CD1-CD1 4.12Å; L37-L41 HydrophobicContact CD1-CG 4.27Å; L37-L41 HydrophobicContact CG-CD1 4.05Å; L37-L41 VanDerWaalsContact O-CG 3.3Å; L37-L41 WeakPolarHBondContact O-CG 3.42Å; L37-L41 PolarHBondContact O-N 3.41Å; L37-V133 HydrophobicContact CD2-CG1 4.46Å; L37-V133 HydrophobicContact CD2-CG2 4.25Å; L37-V133 HydrophobicContact CG-CG2 4.19Å; L37-I163 HydrophobicContact CD2-CD1 3.59Å; L37-T262 HydrophobicContact CD1-CG2 4Å; L37-I265 HydrophobicContact CD1-CD1 3.68Å; L37-I265 HydrophobicContact CD2-CD1 4.14Å
38	A	98	Very high	96.3	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.6	-46.6	178.6	0	0	0	0	0	111.9	A34 A35 N40 L41 W42 I50 F90 V133	A34-A38 PolarHBondContact O-N 2.79Å; A35-A38 PolarHBondContact O-N 3.36Å; A38-N40 VanDerWaalsContact C-N 3.34Å; A38-N40 PolarHBondContact O-N 2.97Å; A38-L41 PolarHBondContact O-N 3.41Å; A38-W42 PolarHBondContact O-N 3.11Å; A38-I50 HydrophobicContact CB-CB 4.12Å; A38-I50 HydrophobicContact CB-CD1 4.29Å; A38-F90 VanDerWaalsContact C-CE2 3.46Å; A38-F90 HydrophobicContact CB-CE2 3.71Å; A38-F90 HydrophobicContact CB-CZ 3.6Å; A38-F90 VanDerWaalsContact O-CE2 3.3Å; A38-F90 WeakPolarHBondContact O-CE2 3.26Å; A38-V133 HydrophobicContact CB-CB 4.18Å; A38-V133 HydrophobicContact CB-CG2 3.86Å
39	I	97.1	Very high	96.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.5	-44.9	176.5	-71.2	165.2	0	0	0	111	A35 Q36 L37 W42 N43 L64 F90 F248	A35-I39 WeakPolarHBondContact O-CB 3.31Å; A35-I39 VanDerWaalsContact O-CG1 3.28Å; A35-I39 WeakPolarHBondContact O-CG1 3.49Å; A35-I39 PolarHBondContact O-N 3.41Å; Q36-I39 PolarHBondContact O-N 2.69Å; L37-I39 PolarHBondContact O-N 2.86Å; I39-W42 PolarHBondContact O-N 3.29Å; I39-N43 WeakPolarHBondContact CG2-ND2 3.12Å; I39-N43 WeakPolarHBondContact O-CB 3.36Å; I39-N43 PolarHBondContact O-N 3.44Å; I39-N43 PolarHBondContact O-ND2 2.88Å; I39-L64 HydrophobicContact CD1-CD2 3.75Å; I39-L64 HydrophobicContact CG1-CD2 4.13Å; I39-F90 HydrophobicContact CG1-CE1 4.43Å; I39-F90 HydrophobicContact CG1-CZ 4.14Å; I39-F248 HydrophobicContact CG1-CE2 4.25Å
40	N	97	Very high	96.7	Very high	6 Å²	6	19 Å²	19	3%	0.032	12%	0.12	C	C	.	.	H	α-helix	trans	-66.8	-41	179.9	-76.7	-68.2	0	0	0	112.1	Q36 L37 A38 W42 N43 S44 T254 T258 K259 T262	Q36-N40 WeakPolarHBondContact O-CB 3.48Å; Q36-N40 PolarHBondContact O-N 3.01Å; Q36-N40 PolarHBondContact O-ND2 3.07Å; L37-N40 PolarHBondContact O-N 3.1Å; A38-N40 VanDerWaalsContact C-N 3.34Å; A38-N40 PolarHBondContact O-N 2.97Å; N40-W42 VanDerWaalsContact C-N 3.31Å; N40-W42 PolarHBondContact O-N 3.15Å; N40-N43 PolarHBondContact O-N 3.43Å; N40-S44 WeakPolarHBondContact O-CB 3.46Å; N40-S44 PolarHBondContact O-N 3.33Å; N40-S44 PolarHBondContact O-OG 3.31Å; N40-S44 VanDerWaalsContact O-OG 3.07Å; N40-T254 VanDerWaalsContact CG-OG1 3.22Å; N40-T254 PolarHBondContact ND2-OG1 3.45Å; N40-T254 WeakPolarHBondContact OD1-CB 3.33Å; N40-T254 WeakPolarHBondContact OD1-CG2 3.39Å; N40-T254 PolarHBondContact OD1-OG1 3.19Å; N40-T258 WeakPolarHBondContact ND2-CG2 3.08Å; N40-K259 WeakPolarHBondContact OD1-CG 3.2Å; N40-T262 HydrophobicContact CB-CG2 3.81Å; N40-T262 VanDerWaalsContact CB-OG1 3.28Å; N40-T262 WeakPolarHBondContact CB-OG1 3.47Å
41	L	97.2	Very high	96.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-58.7	-44.4	174.1	-69	166.3	0	0	0	111.2	L19 L37 A38 S44 F46 A48 Y131 V133 T262 L266	L19-L41 HydrophobicContact CD1-CD1 4.15Å; L37-L41 HydrophobicContact CD1-CD1 4.12Å; L37-L41 HydrophobicContact CD1-CG 4.27Å; L37-L41 HydrophobicContact CG-CD1 4.05Å; L37-L41 VanDerWaalsContact O-CG 3.3Å; L37-L41 WeakPolarHBondContact O-CG 3.42Å; L37-L41 PolarHBondContact O-N 3.41Å; A38-L41 PolarHBondContact O-N 3.41Å; L41-S44 PolarHBondContact O-N 2.99Å; L41-F46 HydrophobicContact CD2-CD2 4.44Å; L41-F46 WeakPolarHBondContact O-CB 3.36Å; L41-F46 WeakPolarHBondContact O-CD2 3.47Å; L41-F46 PolarHBondContact O-N 3.07Å; L41-A48 HydrophobicContact CB-CB 3.77Å; L41-Y131 HydrophobicContact CD1-CD1 4.37Å; L41-Y131 HydrophobicContact CD1-CD2 4.4Å; L41-Y131 HydrophobicContact CD1-CG 3.94Å; L41-Y131 HydrophobicContact CD2-CD1 4.45Å; L41-Y131 HydrophobicContact CD2-CD2 3.98Å; L41-Y131 HydrophobicContact CD2-CE2 4.13Å; L41-Y131 HydrophobicContact CD2-CG 4.17Å; L41-V133 HydrophobicContact CD1-CG2 4.09Å; L41-T262 HydrophobicContact CD2-CG2 3.92Å; L41-T262 HydrophobicContact CG-CG2 4.11Å; L41-L266 HydrophobicContact CD2-CD1 4.4Å; L41-L266 HydrophobicContact CD2-CD2 3.67Å; L41-L266 HydrophobicContact CD2-CG 4.12Å
42	W	97	Very high	96.8	Very high	24 Å²	24	18 Å²	18	9%	0.091	11%	0.114	C	C	.	.	H	α-helix	trans	-64	-41.9	175.7	171.7	81.9	0	0	0	113.2	A38 I39 N40 S44 G45 A48 D84 R89 F90 F248 I252	A38-W42 PolarHBondContact O-N 3.11Å; I39-W42 PolarHBondContact O-N 3.29Å; N40-W42 VanDerWaalsContact C-N 3.31Å; N40-W42 PolarHBondContact O-N 3.15Å; W42-S44 VanDerWaalsContact C-N 3.29Å; W42-S44 PolarHBondContact O-N 3.21Å; W42-G45 PolarHBondContact O-N 2.83Å; W42-G45 VanDerWaalsContact O-N 3.09Å; W42-A48 HydrophobicContact CB-CB 4.27Å; W42-D84 HydrophobicContact CZ2-CB 3.68Å; W42-D84 PolarHBondContact NE1-OD2 3.42Å; W42-R89 VanDerWaalsContact CD1-NH1 3.34Å; W42-R89 VanDerWaalsContact NE1-NH2 3.17Å; W42-R89 PolarHBondContact O-NH1 2.98Å; W42-F90 HydrophobicContact CB-CD2 3.55Å; W42-F90 HydrophobicContact CB-CE2 3.9Å; W42-F90 HydrophobicContact CB-CG 4.42Å; W42-F90 AromaticContact CD1-CD2 3.95Å; W42-F90 HydrophobicContact CG-CB 4.25Å; W42-F90 AromaticContact CG-CD2 3.79Å; W42-F90 HydrophobicContact CG-CD2 3.79Å; W42-F90 HydrophobicContact CG-CG 4.21Å; W42-F248 HydrophobicContact CE3-CE1 4.44Å; W42-F248 HydrophobicContact CE3-CZ 4.24Å; W42-F248 AromaticContact CH2-CE1 3.9Å; W42-F248 HydrophobicContact CH2-CE1 3.9Å; W42-F248 HydrophobicContact CH2-CZ 4.48Å; W42-F248 HydrophobicContact CZ2-CE1 4.16Å; W42-F248 HydrophobicContact CZ3-CE1 4.03Å; W42-F248 HydrophobicContact CZ3-CZ 4.17Å; W42-I252 HydrophobicContact CZ3-CG2 4.26Å
43	N	94.4	Very high	96.5	Very high	76 Å²	76	16 Å²	16	41%	0.406	10%	0.102	S	C	.	.	H	α-helix	trans	-65	-31.8	175.4	-82.4	-29	0	0	0	112.4	I39 N40 G45	I39-N43 WeakPolarHBondContact CG2-ND2 3.12Å; I39-N43 WeakPolarHBondContact O-CB 3.36Å; I39-N43 PolarHBondContact O-N 3.44Å; I39-N43 PolarHBondContact O-ND2 2.88Å; N40-N43 PolarHBondContact O-N 3.43Å; N43-G45 PolarHBondContact O-N 3.43Å
44	S	94.5	Very high	96	Very high	70 Å²	70	16.5 Å²	16.5	49%	0.49	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	4.3	172.9	-64.1	0	0	0	0	113.6	N40 L41 W42	N40-S44 WeakPolarHBondContact O-CB 3.46Å; N40-S44 PolarHBondContact O-N 3.33Å; N40-S44 PolarHBondContact O-OG 3.31Å; N40-S44 VanDerWaalsContact O-OG 3.07Å; L41-S44 PolarHBondContact O-N 2.99Å; W42-S44 VanDerWaalsContact C-N 3.29Å; W42-S44 PolarHBondContact O-N 3.21Å
45	G	94.9	Very high	95.1	Very high	57 Å²	57	16.7 Å²	16.7	59%	0.588	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.1	-1.7	174.2	0	0	0	0	0	114.9	W42 N43	W42-G45 PolarHBondContact O-N 2.83Å; W42-G45 VanDerWaalsContact O-N 3.09Å; N43-G45 PolarHBondContact O-N 3.43Å
46	F	96.8	Very high	94	Very high	63 Å²	63	21.8 Å²	21.8	28%	0.276	14%	0.14	S	C	.	.			trans	-75.4	159.8	177.1	-60.1	-71.8	0	0	0	112	L41 R89 D130 Y131 L266	L41-F46 HydrophobicContact CD2-CD2 4.44Å; L41-F46 WeakPolarHBondContact O-CB 3.36Å; L41-F46 WeakPolarHBondContact O-CD2 3.47Å; L41-F46 PolarHBondContact O-N 3.07Å; F46-R89 PolarHBondContact O-NH1 3.1Å; F46-D130 HydrophobicContact CB-CB 4.12Å; F46-D130 HydrophobicContact CD1-CB 4.13Å; F46-Y131 HydrophobicContact CB-CD2 3.9Å; F46-Y131 HydrophobicContact CB-CE2 4.04Å; F46-Y131 HydrophobicContact CD1-CD2 4.39Å; F46-Y131 AromaticContact CD1-CE2 3.7Å; F46-Y131 HydrophobicContact CD1-CE2 3.7Å; F46-Y131 HydrophobicContact CD2-CD2 4.41Å; F46-Y131 AromaticContact CD2-CE2 3.91Å; F46-Y131 HydrophobicContact CD2-CE2 3.91Å; F46-Y131 HydrophobicContact CE1-CE2 4.08Å; F46-Y131 HydrophobicContact CE2-CE2 4.28Å; F46-Y131 AromaticContact CG-CD2 4Å; F46-Y131 HydrophobicContact CG-CD2 4Å; F46-Y131 AromaticContact CG-CE2 3.6Å; F46-Y131 HydrophobicContact CG-CE2 3.6Å; F46-Y131 HydrophobicContact CZ-CE2 4.35Å; F46-L266 HydrophobicContact CE2-CD1 3.89Å; F46-L266 HydrophobicContact CE2-CD2 3.9Å; F46-L266 HydrophobicContact CZ-CD2 4.23Å
47	S	97	Very high	93.2	Very high	24 Å²	24	23.4 Å²	23.4	17%	0.168	16%	0.158	C	C	.	.			trans	-83.4	112.6	161.4	55.6	0	0	0	0	108.6	L129 D130 Y131	S47-L129 WeakPolarHBondContact OG-CA 3.06Å; S47-D130 PolarHBondContact N-OD2 3.19Å; S47-D130 WeakPolarHBondContact O-CB 3.2Å; S47-D130 PolarHBondContact O-N 2.84Å; S47-D130 PolarHBondContact OG-N 3.29Å; S47-D130 PolarHBondContact OG-OD2 3.15Å; S47-Y131 PolarHBondContact O-N 3.32Å
48	A	97.8	Very high	92.5	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.9	-170.7	0	0	0	0	0	110.1	L41 W42 R89 F90 Y131	L41-A48 HydrophobicContact CB-CB 3.77Å; W42-A48 HydrophobicContact CB-CB 4.27Å; A48-R89 PolarHBondContact N-O 2.92Å; A48-R89 VanDerWaalsContact O-O 3.08Å; A48-F90 HydrophobicContact CB-CD2 4.33Å; A48-F90 HydrophobicContact CB-CE2 4.28Å; A48-F90 WeakPolarHBondContact O-CA 3.41Å; A48-F90 WeakPolarHBondContact O-CD2 3.18Å; A48-F90 WeakPolarHBondContact O-CE2 3.34Å; A48-Y131 CarbonylContact C-O 3.58Å; A48-Y131 VanDerWaalsContact CA-O 3.27Å; A48-Y131 WeakPolarHBondContact CA-O 3.16Å
49	G	98	Very high	92.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	166.2	174.7	0	0	0	0	0	112.3	P91 Y131 V133	G49-P91 CarbonylContact C-O 3.59Å; G49-P91 WeakPolarHBondContact CA-O 3.43Å; G49-Y131 PolarHBondContact N-O 3.4Å; G49-V133 PolarHBondContact O-N 3.45Å
50	I	98.4	Very high	92.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	133.8	166.9	-171.3	165.9	0	0	0	111.5	A34 A35 A38 I60 L64 P91 V92 V93 V133	A34-I50 HydrophobicContact CB-CD1 4.17Å; A35-I50 HydrophobicContact CB-CD1 4.44Å; A38-I50 HydrophobicContact CB-CB 4.12Å; A38-I50 HydrophobicContact CB-CD1 4.29Å; I50-I60 HydrophobicContact CD1-CD1 3.61Å; I50-I60 HydrophobicContact CD1-CG1 4.05Å; I50-I60 HydrophobicContact CD1-CG2 4.09Å; I50-I60 HydrophobicContact CG1-CG2 4.37Å; I50-I60 HydrophobicContact CG2-CG2 3.93Å; I50-L64 HydrophobicContact CG2-CD1 3.92Å; I50-P91 PolarHBondContact N-O 2.75Å; I50-V92 HydrophobicContact CG2-CB 4.25Å; I50-V92 HydrophobicContact CG2-CG1 3.89Å; I50-V92 HydrophobicContact CG2-CG2 3.93Å; I50-V92 WeakPolarHBondContact O-CA 3.37Å; I50-V93 PolarHBondContact O-N 3.28Å; I50-V133 CarbonylContact C-O 3.6Å; I50-V133 VanDerWaalsContact CA-O 3.23Å; I50-V133 WeakPolarHBondContact CA-O 3.36Å; I50-V133 HydrophobicContact CG1-CB 4.31Å
51	L	97.1	Very high	92.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	115.5	174.4	173.5	58.7	0	0	0	109.2	I53 V93 F120 L121 W126 L132 V133 I134 D135	L51-I53 HydrophobicContact CD1-CG2 3.86Å; L51-I53 HydrophobicContact CD2-CG2 4.21Å; L51-I53 HydrophobicContact CG-CG2 3.85Å; L51-V93 CarbonylContact C-O 2.98Å; L51-V93 WeakPolarHBondContact CA-O 3.4Å; L51-V93 HydrophobicContact CD1-CB 3.79Å; L51-V93 HydrophobicContact CD1-CG1 3.56Å; L51-F120 HydrophobicContact CD1-CB 3.87Å; L51-F120 HydrophobicContact CD1-CD2 3.85Å; L51-F120 HydrophobicContact CD1-CG 4.15Å; L51-F120 HydrophobicContact CD2-CB 4.37Å; L51-L121 HydrophobicContact CD2-CD2 3.64Å; L51-L121 HydrophobicContact CD2-CG 4.31Å; L51-W126 HydrophobicContact CB-CH2 3.83Å; L51-W126 HydrophobicContact CB-CZ2 4Å; L51-W126 HydrophobicContact CD1-CH2 4.39Å; L51-W126 HydrophobicContact CD1-CZ2 4.22Å; L51-W126 HydrophobicContact CD2-CZ2 4.3Å; L51-W126 HydrophobicContact CG-CZ2 4.4Å; L51-L132 HydrophobicContact CB-CD1 4.19Å; L51-V133 PolarHBondContact N-O 2.88Å; L51-I134 HydrophobicContact CB-CG1 4.24Å; L51-I134 HydrophobicContact CD2-CD1 4.36Å; L51-I134 HydrophobicContact CD2-CG1 4.38Å; L51-I134 HydrophobicContact CD2-CG2 4.34Å; L51-I134 HydrophobicContact CG-CG2 4.41Å; L51-I134 CarbonylContact O-C 3.58Å; L51-I134 WeakPolarHBondContact O-CA 3.34Å; L51-D135 PolarHBondContact O-N 3.14Å
52	D	95.4	Very high	91.9	Very high	0 Å²	0	32 Å²	32	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.3	174.9	176.7	15.4	0	0	0	110.7	D54 P58 I60 V93 S94 I95	D52-D54 PolarHBondContact OD1-N 2.79Å; D52-D54 VanDerWaalsContact OD1-N 3.09Å; D52-P58 VanDerWaalsContact OD2-CA 3.29Å; D52-P58 WeakPolarHBondContact OD2-CA 3.09Å; D52-P58 VanDerWaalsContact OD2-CB 3.26Å; D52-P58 WeakPolarHBondContact OD2-CB 3.46Å; D52-I60 HydrophobicContact CB-CB 3.7Å; D52-I60 HydrophobicContact CB-CG1 3.59Å; D52-I60 HydrophobicContact CB-CG2 4.35Å; D52-V93 PolarHBondContact N-O 2.79Å; D52-S94 WeakPolarHBondContact O-CA 3.44Å; D52-S94 PolarHBondContact OD2-OG 3.09Å; D52-I95 PolarHBondContact O-N 3.43Å
53	I	89.9	Confident	91.8	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	20%	0.199	C	C	.	.			trans	-124.3	18.9	178.5	51.3	172.2	0	0	0	110.5	L51 L55 V117 F120 I134 D135 T136 P137 V147	L51-I53 HydrophobicContact CD1-CG2 3.86Å; L51-I53 HydrophobicContact CD2-CG2 4.21Å; L51-I53 HydrophobicContact CG-CG2 3.85Å; I53-L55 HydrophobicContact CB-CD2 4.45Å; I53-L55 WeakPolarHBondContact O-CD2 3.41Å; I53-L55 WeakPolarHBondContact O-CG 3.42Å; I53-L55 PolarHBondContact O-N 3.42Å; I53-V117 HydrophobicContact CB-CG2 4.42Å; I53-V117 HydrophobicContact CG2-CG2 4.32Å; I53-F120 HydrophobicContact CG2-CD2 4.16Å; I53-I134 HydrophobicContact CD1-CG2 3.48Å; I53-I134 VanDerWaalsContact CD1-CG2 3.48Å; I53-I134 HydrophobicContact CG1-CG2 3.87Å; I53-D135 WeakPolarHBondContact CG1-O 3.38Å; I53-D135 PolarHBondContact N-O 2.89Å; I53-D135 VanDerWaalsContact N-O 3.09Å; I53-T136 HydrophobicContact CD1-CG2 4.23Å; I53-P137 WeakPolarHBondContact O-CD 3.19Å; I53-P137 VanDerWaalsContact O-CG 3.29Å; I53-P137 WeakPolarHBondContact O-CG 3.29Å; I53-V147 HydrophobicContact CD1-CB 4.16Å; I53-V147 HydrophobicContact CD1-CG1 3.97Å; I53-V147 HydrophobicContact CD1-CG2 3.07Å; I53-V147 HydrophobicContact CG1-CG2 4.43Å
54	D	87	Confident	91.9	Very high	18 Å²	18	28 Å²	28	10%	0.096	18%	0.18	C	C	.	.			trans	-75.6	77.2	168.5	-163.7	-16	0	0	0	109.4	K30 D52 C56 G57 D135	K30-D54 IonicContact NZ-OD2 2.72Å; K30-D54 PolarHBondContact NZ-OD2 2.93Å; D52-D54 PolarHBondContact OD1-N 2.79Å; D52-D54 VanDerWaalsContact OD1-N 3.09Å; D54-C56 PolarHBondContact O-N 2.97Å; D54-G57 CarbonylContact O-C 3.6Å; D54-G57 PolarHBondContact O-N 2.61Å; D54-G57 VanDerWaalsContact O-N 3.1Å; D54-D135 PolarHBondContact N-O 3.09Å
55	L	77.7	Confident	91.9	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.016	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.2	-169.9	-41.5	178.8	0	0	0	113.5	I53 G57 I95 V106 K113 E143	I53-L55 HydrophobicContact CB-CD2 4.45Å; I53-L55 WeakPolarHBondContact O-CD2 3.41Å; I53-L55 WeakPolarHBondContact O-CG 3.42Å; I53-L55 PolarHBondContact O-N 3.42Å; L55-G57 VanDerWaalsContact C-N 3.35Å; L55-I95 HydrophobicContact CB-CD1 4.26Å; L55-I95 HydrophobicContact CD2-CB 3.99Å; L55-I95 HydrophobicContact CD2-CD1 3.42Å; L55-I95 VanDerWaalsContact CD2-CD1 3.42Å; L55-I95 HydrophobicContact CD2-CG1 4.28Å; L55-I95 HydrophobicContact CD2-CG2 3.88Å; L55-I95 HydrophobicContact CG-CD1 4.26Å; L55-V106 WeakPolarHBondContact O-CB 3.47Å; L55-V106 WeakPolarHBondContact O-CG2 3.42Å; L55-K113 HydrophobicContact CD1-CB 3.44Å; L55-K113 VanDerWaalsContact CD1-CB 3.44Å; L55-K113 HydrophobicContact CD1-CD 3.7Å; L55-K113 HydrophobicContact CD1-CG 3.49Å; L55-K113 VanDerWaalsContact CD1-CG 3.49Å; L55-E143 HydrophobicContact CD1-CG 4.05Å
56	C	74.2	Confident	91.9	Very high	107 Å²	107	23.1 Å²	23.1	72%	0.723	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-19.7	-178.2	-66.5	0	0	0	0	112.8	D54	D54-C56 PolarHBondContact O-N 2.97Å
57	G	79.3	Confident	91.7	Very high	39 Å²	39	23.1 Å²	23.1	40%	0.402	14%	0.139	S	C	.	.	S	Bend	trans	-169.9	69	-176	0	0	0	0	0	111.7	D54 L55 S59	D54-G57 CarbonylContact O-C 3.6Å; D54-G57 PolarHBondContact O-N 2.61Å; D54-G57 VanDerWaalsContact O-N 3.1Å; L55-G57 VanDerWaalsContact C-N 3.35Å; G57-S59 PolarHBondContact O-N 3.09Å
58	P	84.4	Confident	91.4	Very high	31 Å²	31	28.5 Å²	28.5	20%	0.201	17%	0.166	C	C	.	.			trans	-62	108.1	-177.1	26.1	-34.2	0	0	0	109.7	D52 I95 L99	D52-P58 VanDerWaalsContact OD2-CA 3.29Å; D52-P58 WeakPolarHBondContact OD2-CA 3.09Å; D52-P58 VanDerWaalsContact OD2-CB 3.26Å; D52-P58 WeakPolarHBondContact OD2-CB 3.46Å; P58-I95 HydrophobicContact CB-CG2 3.87Å; P58-I95 HydrophobicContact CG-CG2 4.13Å; P58-L99 HydrophobicContact CG-CD1 4.18Å
59	S	92.1	Very high	91.2	Very high	34 Å²	34	31.6 Å²	31.6	24%	0.238	18%	0.183	C	C	.	.			trans	-105.5	-18.1	-173.5	63.1	0	0	0	0	112.8	S31 G57 R62 I63	S31-S59 WeakPolarHBondContact CB-OG 3.25Å; S31-S59 PolarHBondContact OG-OG 3.36Å; G57-S59 PolarHBondContact O-N 3.09Å; S59-R62 PolarHBondContact O-N 2.94Å; S59-R62 VanDerWaalsContact O-N 3.15Å; S59-I63 VanDerWaalsContact O-CG1 3.31Å; S59-I63 WeakPolarHBondContact O-CG1 3.49Å; S59-I63 PolarHBondContact O-N 3.27Å
60	I	95.9	Very high	90.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-43.7	-177.7	-63.4	-55.8	0	0	0	112.2	S31 A35 I50 D52 R62 I63 L64 V92 D135	S31-I60 WeakPolarHBondContact O-CD1 3.44Å; A35-I60 HydrophobicContact CB-CD1 3.91Å; I50-I60 HydrophobicContact CD1-CD1 3.61Å; I50-I60 HydrophobicContact CD1-CG1 4.05Å; I50-I60 HydrophobicContact CD1-CG2 4.09Å; I50-I60 HydrophobicContact CG1-CG2 4.37Å; I50-I60 HydrophobicContact CG2-CG2 3.93Å; D52-I60 HydrophobicContact CB-CB 3.7Å; D52-I60 HydrophobicContact CB-CG1 3.59Å; D52-I60 HydrophobicContact CB-CG2 4.35Å; I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 3.21Å; I60-I63 HydrophobicContact CD1-CD1 4.39Å; I60-I63 PolarHBondContact O-N 2.95Å; I60-L64 HydrophobicContact CG2-CD1 3.59Å; I60-L64 HydrophobicContact CG2-CG 4.13Å; I60-L64 WeakPolarHBondContact O-CB 3.4Å; I60-L64 WeakPolarHBondContact O-CG 3.47Å; I60-L64 PolarHBondContact O-N 3.12Å; I60-V92 HydrophobicContact CG2-CG1 4.02Å; I60-D135 HydrophobicContact CG1-CB 4.32Å
61	P	94.8	Very high	90.6	Very high	8 Å²	8	36.3 Å²	36.3	5%	0.052	20%	0.203	C	C	.	.	H	α-helix	trans	-54.9	-43.9	175.2	-29.8	37.9	0	0	0	113.3	G65 L66 E67 S94 F97	P61-G65 PolarHBondContact O-N 3.15Å; P61-G65 VanDerWaalsContact O-N 3.15Å; P61-L66 WeakPolarHBondContact O-CA 3.44Å; P61-L66 PolarHBondContact O-N 2.91Å; P61-E67 PolarHBondContact O-N 3.26Å; P61-S94 WeakPolarHBondContact CD-OG 3.45Å; P61-S94 WeakPolarHBondContact CG-OG 3.37Å; P61-F97 HydrophobicContact CB-CD1 4.32Å; P61-F97 HydrophobicContact CB-CE1 3.72Å; P61-F97 HydrophobicContact CB-CZ 4.4Å; P61-F97 HydrophobicContact CG-CD1 4.11Å; P61-F97 HydrophobicContact CG-CE1 3.72Å; P61-F97 HydrophobicContact CG-CZ 4.18Å
62	R	93.4	Very high	90.3	Very high	117 Å²	117	42.2 Å²	42.2	44%	0.442	23%	0.231	S	C	.	.	H	α-helix	trans	-70.6	-45.3	179.6	-176	173.7	-69.8	161	2	111.9	S59 I60 L64 G65 E67 D103	S59-R62 PolarHBondContact O-N 2.94Å; S59-R62 VanDerWaalsContact O-N 3.15Å; I60-R62 VanDerWaalsContact C-N 3.31Å; I60-R62 PolarHBondContact O-N 3.21Å; R62-L64 PolarHBondContact O-N 3.23Å; R62-G65 PolarHBondContact O-N 3.05Å; R62-G65 VanDerWaalsContact O-N 3.12Å; R62-E67 IonicContact NE-OE2 2.62Å; R62-D103 IonicContact NH2-OD1 3.4Å; R62-D103 PolarHBondContact NH2-OD1 3.06Å
63	I	95	Very high	90	Very high	15 Å²	15	46.3 Å²	46.3	8%	0.077	26%	0.259	C	S	.	.	H	α-helix	trans	-57.7	-36.9	178.6	-69.5	165.7	0	0	0	111	A35 S59 I60 K251	A35-I63 HydrophobicContact CB-CB 4.47Å; A35-I63 HydrophobicContact CB-CG2 3.5Å; A35-I63 VanDerWaalsContact CB-CG2 3.5Å; S59-I63 VanDerWaalsContact O-CG1 3.31Å; S59-I63 WeakPolarHBondContact O-CG1 3.49Å; S59-I63 PolarHBondContact O-N 3.27Å; I60-I63 HydrophobicContact CD1-CD1 4.39Å; I60-I63 PolarHBondContact O-N 2.95Å; I63-K251 WeakPolarHBondContact O-CD 3.26Å; I63-K251 WeakPolarHBondContact O-CG 3.31Å
64	L	96.6	Very high	89.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	1	-178.8	-60.5	-177.4	0	0	0	114.6	A35 I39 I50 I60 R62 L66 F90 V92 F248	A35-L64 HydrophobicContact CB-CD2 4.29Å; I39-L64 HydrophobicContact CD1-CD2 3.75Å; I39-L64 HydrophobicContact CG1-CD2 4.13Å; I50-L64 HydrophobicContact CG2-CD1 3.92Å; I60-L64 HydrophobicContact CG2-CD1 3.59Å; I60-L64 HydrophobicContact CG2-CG 4.13Å; I60-L64 WeakPolarHBondContact O-CB 3.4Å; I60-L64 WeakPolarHBondContact O-CG 3.47Å; I60-L64 PolarHBondContact O-N 3.12Å; R62-L64 PolarHBondContact O-N 3.23Å; L64-L66 VanDerWaalsContact C-N 3.34Å; L64-L66 HydrophobicContact CB-CD1 3.89Å; L64-L66 HydrophobicContact CB-CG 3.97Å; L64-L66 HydrophobicContact CD1-CD1 4.29Å; L64-F90 HydrophobicContact CD1-CE1 4.04Å; L64-F90 HydrophobicContact CD2-CE1 4.32Å; L64-V92 HydrophobicContact CD1-CG1 3.99Å; L64-V92 HydrophobicContact CD1-CG2 3.72Å; L64-F248 HydrophobicContact CB-CD2 4.42Å; L64-F248 HydrophobicContact CD2-CD2 4.39Å; L64-F248 HydrophobicContact CD2-CE2 4.15Å; L64-F248 VanDerWaalsContact O-CA 3.32Å; L64-F248 WeakPolarHBondContact O-CA 3.28Å
65	G	95	Very high	89.9	Confident	14 Å²	14	52.6 Å²	52.6	14%	0.144	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	32.7	-179.3	0	0	0	0	0	113.2	P61 R62 G246	P61-G65 PolarHBondContact O-N 3.15Å; P61-G65 VanDerWaalsContact O-N 3.15Å; R62-G65 PolarHBondContact O-N 3.05Å; R62-G65 VanDerWaalsContact O-N 3.12Å; G65-G246 VanDerWaalsContact CA-O 3.29Å; G65-G246 WeakPolarHBondContact CA-O 3.27Å
66	L	95.2	Very high	90.2	Very high	12 Å²	12	58.7 Å²	58.7	6%	0.063	34%	0.339	C	S	.	.			trans	-116.7	10	-175	-60.2	177.6	0	0	0	113.5	P61 L64 N68 N69 V81 A83 V92 F97	P61-L66 WeakPolarHBondContact O-CA 3.44Å; P61-L66 PolarHBondContact O-N 2.91Å; L64-L66 VanDerWaalsContact C-N 3.34Å; L64-L66 HydrophobicContact CB-CD1 3.89Å; L64-L66 HydrophobicContact CB-CG 3.97Å; L64-L66 HydrophobicContact CD1-CD1 4.29Å; L66-N68 PolarHBondContact O-N 2.83Å; L66-N69 VanDerWaalsContact CA-ND2 3.34Å; L66-N69 WeakPolarHBondContact CA-ND2 3.3Å; L66-N69 WeakPolarHBondContact O-CB 3.44Å; L66-N69 PolarHBondContact O-N 2.86Å; L66-N69 PolarHBondContact O-ND2 2.84Å; L66-V81 HydrophobicContact CD1-CG1 4.19Å; L66-V81 HydrophobicContact CD2-CG1 4.25Å; L66-A83 HydrophobicContact CD1-CB 3.79Å; L66-A83 HydrophobicContact CD2-CB 4.21Å; L66-A83 HydrophobicContact CG-CB 4.43Å; L66-V92 HydrophobicContact CD1-CB 3.97Å; L66-V92 HydrophobicContact CD1-CG1 4.03Å; L66-V92 HydrophobicContact CD1-CG2 3.74Å; L66-F97 HydrophobicContact CB-CE1 3.99Å; L66-F97 HydrophobicContact CB-CZ 4.06Å; L66-F97 HydrophobicContact CD1-CZ 4.22Å; L66-F97 WeakPolarHBondContact O-CE1 3.39Å
67	E	90.9	Very high	91	Very high	62 Å²	62	54.1 Å²	54.1	29%	0.29	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.6	-173.1	67	-162.5	162	0	0	115.4	P61 R62 P102	P61-E67 PolarHBondContact O-N 3.26Å; R62-E67 IonicContact NE-OE2 2.62Å; E67-P102 HydrophobicContact CB-CG 4.47Å
68	N	90.5	Very high	91.7	Very high	138 Å²	138	54 Å²	54	74%	0.738	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	1.7	178.9	-63.2	-49.1	0	0	0	114	L66	L66-N68 PolarHBondContact O-N 2.83Å
69	N	93.6	Very high	92.2	Very high	65 Å²	65	56.1 Å²	56.1	35%	0.348	31%	0.307	S	S	.	.			trans	-82.7	154.8	177.4	-68.4	-88.7	0	0	0	111.3	L66 V81 F97	L66-N69 VanDerWaalsContact CA-ND2 3.34Å; L66-N69 WeakPolarHBondContact CA-ND2 3.3Å; L66-N69 WeakPolarHBondContact O-CB 3.44Å; L66-N69 PolarHBondContact O-N 2.86Å; L66-N69 PolarHBondContact O-ND2 2.84Å; N69-V81 HydrophobicContact CB-CG1 3.87Å; N69-V81 HydrophobicContact CB-CG2 3.87Å; N69-F97 HydrophobicContact CB-CD1 4.25Å; N69-F97 HydrophobicContact CB-CE1 4.08Å; N69-F97 WeakPolarHBondContact O-CD1 3.31Å
70	K	92.2	Very high	92.4	Very high	86 Å²	86	54.9 Å²	54.9	37%	0.374	30%	0.298	S	S	.	.			trans	-120.7	150.7	170.2	-60.3	-67	178	167.1	0	108.6	F97 L99 D100	K70-F97 WeakPolarHBondContact CD-O 3.31Å; K70-L99 PolarHBondContact NZ-O 2.81Å; K70-D100 PolarHBondContact NZ-O 2.84Å
71	I	92.2	Very high	92.4	Very high	12 Å²	12	55.7 Å²	55.7	6%	0.062	30%	0.303	C	S	.	.			trans	-91.2	141.2	171.9	-162	176.2	0	0	0	108.4	W78 L79 V93 F97 L98 F120	I71-W78 HydrophobicContact CB-CE3 4.49Å; I71-W78 HydrophobicContact CD1-CB 4.06Å; I71-W78 HydrophobicContact CD1-CE3 4.11Å; I71-W78 HydrophobicContact CG1-CE3 4.04Å; I71-W78 HydrophobicContact CG2-CE3 3.88Å; I71-W78 HydrophobicContact CG2-CZ3 3.86Å; I71-L79 WeakPolarHBondContact CG1-O 3.5Å; I71-V93 HydrophobicContact CD1-CB 4.46Å; I71-V93 HydrophobicContact CD1-CG1 3.85Å; I71-V93 HydrophobicContact CD1-CG2 4.09Å; I71-F97 HydrophobicContact CB-CB 3.88Å; I71-F97 HydrophobicContact CB-CD2 4.44Å; I71-F97 HydrophobicContact CG2-CB 4.04Å; I71-L98 HydrophobicContact CG2-CD2 3.35Å; I71-L98 HydrophobicContact CG2-CG 3.84Å; I71-F120 HydrophobicContact CD1-CE1 4.25Å
72	H	91.2	Very high	92.5	Very high	125 Å²	125	58.5 Å²	58.5	58%	0.579	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	147.5	-179	-62.8	-72	0	0	0	110	L79	H72-L79 PolarHBondContact O-N 3.27Å
73	S	89.4	Confident	92.7	Very high	85 Å²	85	53.5 Å²	53.5	59%	0.594	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	140.9	171	58.7	0	0	0	0	110.5	G77	S73-G77 CarbonylContact C-O 3.59Å; S73-G77 WeakPolarHBondContact CA-O 3.26Å
74	C	87.4	Confident	92.7	Very high	47 Å²	47	53.5 Å²	53.5	32%	0.318	30%	0.297	S	S	.	.			trans	-119.5	-176.8	167.2	63.8	0	0	0	0	110.2	E76 G77 L79	C74-E76 PolarHBondContact O-N 3.41Å; C74-E76 PolarHBondContact SG-OE2 3.01Å; C74-G77 PolarHBondContact N-O 2.94Å; C74-G77 PolarHBondContact O-N 3.26Å; C74-G77 PolarHBondContact SG-O 3.1Å; C74-L79 HydrophobicContact CB-CD1 4.3Å; C74-L79 HydrophobicContact CB-CG 4.42Å
75	A	87	Confident	92.5	Very high	105 Å²	105	55.2 Å²	55.2	87%	0.868	31%	0.314	S	S	*	.	S	Bend	trans	-62.3	-31.2	179.9	0	0	0	0	0	112.2
76	E	84	Confident	92.2	Very high	131 Å²	131	63.6 Å²	63.6	61%	0.612	35%	0.349	S	S	*	.	S	Bend	trans	-75.9	-41	177.5	-60.2	75.5	-167.3	0	0	111.1	P10 C74	P10-E76 WeakPolarHBondContact CG-O 3.25Å; C74-E76 PolarHBondContact O-N 3.41Å; C74-E76 PolarHBondContact SG-OE2 3.01Å
77	G	91.1	Very high	92	Very high	11 Å²	11	67.1 Å²	67.1	11%	0.113	37%	0.371	C	S	.	.			trans	161.2	-155.7	-177.5	0	0	0	0	0	113.8	S73 C74 S123	S73-G77 CarbonylContact C-O 3.59Å; S73-G77 WeakPolarHBondContact CA-O 3.26Å; C74-G77 PolarHBondContact N-O 2.94Å; C74-G77 PolarHBondContact O-N 3.26Å; C74-G77 PolarHBondContact SG-O 3.1Å; G77-S123 CarbonylContact C-O 3.57Å; G77-S123 WeakPolarHBondContact CA-O 3.31Å
78	W	93.8	Very high	92.2	Very high	37 Å²	37	70.4 Å²	70.4	14%	0.14	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	129.7	176.7	-64.9	91.9	0	0	0	111.4	I71 L98 E119 S123 V124 C125	I71-W78 HydrophobicContact CB-CE3 4.49Å; I71-W78 HydrophobicContact CD1-CB 4.06Å; I71-W78 HydrophobicContact CD1-CE3 4.11Å; I71-W78 HydrophobicContact CG1-CE3 4.04Å; I71-W78 HydrophobicContact CG2-CE3 3.88Å; I71-W78 HydrophobicContact CG2-CZ3 3.86Å; W78-L98 HydrophobicContact CH2-CD2 3.9Å; W78-L98 HydrophobicContact CZ3-CD2 3.79Å; W78-E119 WeakPolarHBondContact CZ2-OE1 2.92Å; W78-E119 VanDerWaalsContact NE1-CG 3.3Å; W78-E119 PolarHBondContact NE1-OE1 2.91Å; W78-S123 PolarHBondContact N-O 3.23Å; W78-V124 HydrophobicContact CB-CB 4.45Å; W78-V124 HydrophobicContact CB-CG2 3.74Å; W78-V124 HydrophobicContact CG-CG2 4.48Å; W78-V124 WeakPolarHBondContact O-CA 3.37Å; W78-C125 PolarHBondContact O-N 2.94Å
79	L	94.6	Very high	92.4	Very high	75 Å²	75	67.5 Å²	67.5	39%	0.393	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	119.2	176.3	-62.7	179	0	0	0	109.7	I71 H72 C74 C125	I71-L79 WeakPolarHBondContact CG1-O 3.5Å; H72-L79 PolarHBondContact O-N 3.27Å; C74-L79 HydrophobicContact CB-CD1 4.3Å; C74-L79 HydrophobicContact CB-CG 4.42Å; L79-C125 HydrophobicContact CD2-CB 4.2Å
80	P	96.3	Very high	92.6	Very high	8 Å²	8	64.4 Å²	64.4	5%	0.052	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-68	155.3	177.9	29.8	-35	0	0	0	111.6	Y82 P91 V93 V124	P80-Y82 HydrophobicContact CG-CE1 4.27Å; P80-Y82 HydrophobicContact CG-CE2 3.97Å; P80-P91 HydrophobicContact CB-CB 3.55Å; P80-P91 HydrophobicContact CG-CB 3.63Å; P80-V93 HydrophobicContact CB-CG2 3.84Å; P80-V124 HydrophobicContact CB-CG1 4.43Å
81	V	96.7	Very high	92.9	Very high	16 Å²	16	60.3 Å²	60.3	10%	0.097	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	120.3	169.2	177.5	0	0	0	0	107.9	L66 N69 A83 V92 F97	L66-V81 HydrophobicContact CD1-CG1 4.19Å; L66-V81 HydrophobicContact CD2-CG1 4.25Å; N69-V81 HydrophobicContact CB-CG1 3.87Å; N69-V81 HydrophobicContact CB-CG2 3.87Å; V81-A83 PolarHBondContact O-N 3.43Å; V81-V92 PolarHBondContact N-O 3.46Å; V81-V92 WeakPolarHBondContact O-CB 3.38Å; V81-V92 PolarHBondContact O-N 3.15Å; V81-F97 HydrophobicContact CB-CE2 3.87Å; V81-F97 HydrophobicContact CB-CZ 4.1Å; V81-F97 HydrophobicContact CG1-CZ 4.45Å; V81-F97 HydrophobicContact CG2-CD2 3.82Å; V81-F97 HydrophobicContact CG2-CE2 3.63Å; V81-F97 HydrophobicContact CG2-CG 4.36Å; V81-F97 HydrophobicContact CG2-CZ 4.01Å
82	Y	96.9	Very high	93.2	Very high	67 Å²	67	59.8 Å²	59.8	26%	0.263	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	106	178.8	-68.1	-80.6	0	0	0	110.6	P80 D84 G85 K88 P91	P80-Y82 HydrophobicContact CG-CE1 4.27Å; P80-Y82 HydrophobicContact CG-CE2 3.97Å; Y82-D84 VanDerWaalsContact C-N 3.28Å; Y82-D84 PolarHBondContact O-N 3.06Å; Y82-G85 PolarHBondContact O-N 3.42Å; Y82-G85 VanDerWaalsContact O-N 3.12Å; Y82-K88 HydrophobicContact CD1-CB 3.6Å; Y82-K88 HydrophobicContact CD1-CG 4Å; Y82-K88 HydrophobicContact CD2-CB 4.45Å; Y82-K88 HydrophobicContact CD2-CD 4.24Å; Y82-K88 HydrophobicContact CD2-CG 4Å; Y82-K88 HydrophobicContact CE1-CB 3.63Å; Y82-K88 HydrophobicContact CE1-CG 4.22Å; Y82-K88 WeakPolarHBondContact CE1-O 3.43Å; Y82-K88 HydrophobicContact CE2-CB 4.48Å; Y82-K88 HydrophobicContact CE2-CD 4.08Å; Y82-K88 HydrophobicContact CE2-CG 4.23Å; Y82-K88 HydrophobicContact CG-CB 4.01Å; Y82-K88 HydrophobicContact CG-CG 3.85Å; Y82-P91 HydrophobicContact CD1-CB 4.02Å; Y82-P91 HydrophobicContact CE1-CB 3.74Å; Y82-P91 HydrophobicContact CE1-CG 4.32Å
83	A	96.8	Very high	93.4	Very high	12 Å²	12	53.8 Å²	53.8	10%	0.099	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-31.2	-176.2	0	0	0	0	0	112.5	L66 V81 G85 F90 V92 F248	L66-A83 HydrophobicContact CD1-CB 3.79Å; L66-A83 HydrophobicContact CD2-CB 4.21Å; L66-A83 HydrophobicContact CG-CB 4.43Å; V81-A83 PolarHBondContact O-N 3.43Å; A83-G85 PolarHBondContact O-N 3.26Å; A83-F90 HydrophobicContact CB-CD1 3.68Å; A83-F90 HydrophobicContact CB-CE1 4.43Å; A83-F90 PolarHBondContact N-O 2.92Å; A83-V92 HydrophobicContact CB-CG2 4.05Å; A83-F248 HydrophobicContact CB-CB 4.01Å; A83-F248 HydrophobicContact CB-CD1 3.87Å; A83-F248 HydrophobicContact CB-CD2 3.51Å; A83-F248 HydrophobicContact CB-CE1 4.19Å; A83-F248 HydrophobicContact CB-CE2 3.87Å; A83-F248 HydrophobicContact CB-CG 3.51Å; A83-F248 HydrophobicContact CB-CZ 4.19Å; A83-F248 WeakPolarHBondContact O-CB 3.17Å; A83-F248 WeakPolarHBondContact O-CD1 3.45Å; A83-F248 WeakPolarHBondContact O-CG 3.38Å
84	D	94.9	Very high	93.7	Very high	16 Å²	16	49.8 Å²	49.8	9%	0.086	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	8.5	176.5	69.8	-23.4	0	0	0	113.4	W42 Y82 H86 T87 K88 R89 F90 F248	W42-D84 HydrophobicContact CZ2-CB 3.68Å; W42-D84 PolarHBondContact NE1-OD2 3.42Å; Y82-D84 VanDerWaalsContact C-N 3.28Å; Y82-D84 PolarHBondContact O-N 3.06Å; D84-H86 PolarHBondContact O-N 3.17Å; D84-T87 WeakPolarHBondContact CB-OG1 3.46Å; D84-T87 PolarHBondContact O-OG1 3.34Å; D84-T87 PolarHBondContact OD2-OG1 2.88Å; D84-K88 PolarHBondContact OD1-N 3.15Å; D84-R89 PolarHBondContact OD1-N 3.23Å; D84-R89 VanDerWaalsContact OD1-N 3.17Å; D84-R89 WeakPolarHBondContact OD2-CA 3.33Å; D84-R89 WeakPolarHBondContact OD2-CB 3.38Å; D84-R89 PolarHBondContact OD2-N 3.29Å; D84-F90 HydrophobicContact CB-CB 4.05Å; D84-F90 PolarHBondContact OD1-N 3.01Å; D84-F90 PolarHBondContact OD2-N 2.73Å; D84-F248 HydrophobicContact CB-CE1 4.22Å
85	G	92.1	Very high	93.8	Very high	35 Å²	35	47.5 Å²	47.5	36%	0.361	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	64.8	-118.3	173.9	0	0	0	0	0	112.6	Y82 A83 T87 K88	Y82-G85 PolarHBondContact O-N 3.42Å; Y82-G85 VanDerWaalsContact O-N 3.12Å; A83-G85 PolarHBondContact O-N 3.26Å; G85-T87 VanDerWaalsContact C-N 3.34Å; G85-T87 PolarHBondContact O-N 3.04Å; G85-K88 WeakPolarHBondContact O-CG 3.29Å; G85-K88 PolarHBondContact O-N 3.26Å
86	H	88.5	Confident	94.1	Very high	191 Å²	191	43.1 Å²	43.1	88%	0.884	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-69.8	-24.9	-168.7	-63.1	-60.7	0	0	0	114.5	D84 K88	D84-H86 PolarHBondContact O-N 3.17Å; H86-K88 VanDerWaalsContact C-N 3.26Å; H86-K88 PolarHBondContact O-N 3.07Å
87	T	91.9	Very high	94.5	Very high	85 Å²	85	37 Å²	37	52%	0.521	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-71.5	-23.7	178.2	46.1	0	0	0	0	112.6	D84 G85 R89	D84-T87 WeakPolarHBondContact CB-OG1 3.46Å; D84-T87 PolarHBondContact O-OG1 3.34Å; D84-T87 PolarHBondContact OD2-OG1 2.88Å; G85-T87 VanDerWaalsContact C-N 3.34Å; G85-T87 PolarHBondContact O-N 3.04Å; T87-R89 PolarHBondContact O-N 2.89Å; T87-R89 VanDerWaalsContact O-N 3.14Å
88	K	94.3	Very high	94.4	Very high	131 Å²	131	38.9 Å²	38.9	57%	0.57	20%	0.198	S	C	*	.			trans	51.2	34	176.7	-62.3	-173	177.5	-175.2	0	114.2	Y82 D84 G85 H86	Y82-K88 HydrophobicContact CD1-CB 3.6Å; Y82-K88 HydrophobicContact CD1-CG 4Å; Y82-K88 HydrophobicContact CD2-CB 4.45Å; Y82-K88 HydrophobicContact CD2-CD 4.24Å; Y82-K88 HydrophobicContact CD2-CG 4Å; Y82-K88 HydrophobicContact CE1-CB 3.63Å; Y82-K88 HydrophobicContact CE1-CG 4.22Å; Y82-K88 WeakPolarHBondContact CE1-O 3.43Å; Y82-K88 HydrophobicContact CE2-CB 4.48Å; Y82-K88 HydrophobicContact CE2-CD 4.08Å; Y82-K88 HydrophobicContact CE2-CG 4.23Å; Y82-K88 HydrophobicContact CG-CB 4.01Å; Y82-K88 HydrophobicContact CG-CG 3.85Å; D84-K88 PolarHBondContact OD1-N 3.15Å; G85-K88 WeakPolarHBondContact O-CG 3.29Å; G85-K88 PolarHBondContact O-N 3.26Å; H86-K88 VanDerWaalsContact C-N 3.26Å; H86-K88 PolarHBondContact O-N 3.07Å
89	R	95.9	Very high	94.1	Very high	78 Å²	78	37.8 Å²	37.8	29%	0.294	20%	0.195	S	C	.	.			trans	-97.7	-8.3	176.9	-61.2	-171.5	-62.7	107.4	2.7	112.8	W42 F46 A48 D84 T87 P91	W42-R89 VanDerWaalsContact CD1-NH1 3.34Å; W42-R89 VanDerWaalsContact NE1-NH2 3.17Å; W42-R89 PolarHBondContact O-NH1 2.98Å; F46-R89 PolarHBondContact O-NH1 3.1Å; A48-R89 PolarHBondContact N-O 2.92Å; A48-R89 VanDerWaalsContact O-O 3.08Å; D84-R89 PolarHBondContact OD1-N 3.23Å; D84-R89 VanDerWaalsContact OD1-N 3.17Å; D84-R89 WeakPolarHBondContact OD2-CA 3.33Å; D84-R89 WeakPolarHBondContact OD2-CB 3.38Å; D84-R89 PolarHBondContact OD2-N 3.29Å; T87-R89 PolarHBondContact O-N 2.89Å; T87-R89 VanDerWaalsContact O-N 3.14Å; R89-P91 VanDerWaalsContact C-CD 3.44Å; R89-P91 WeakPolarHBondContact O-CD 3.43Å
90	F	97.8	Very high	93.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.			trans	-123.6	68.8	-178.9	-153.6	-114.1	0	0	0	113.1	A38 I39 W42 A48 L64 A83 D84 V92 F248	A38-F90 VanDerWaalsContact C-CE2 3.46Å; A38-F90 HydrophobicContact CB-CE2 3.71Å; A38-F90 HydrophobicContact CB-CZ 3.6Å; A38-F90 VanDerWaalsContact O-CE2 3.3Å; A38-F90 WeakPolarHBondContact O-CE2 3.26Å; I39-F90 HydrophobicContact CG1-CE1 4.43Å; I39-F90 HydrophobicContact CG1-CZ 4.14Å; W42-F90 HydrophobicContact CB-CD2 3.55Å; W42-F90 HydrophobicContact CB-CE2 3.9Å; W42-F90 HydrophobicContact CB-CG 4.42Å; W42-F90 AromaticContact CD1-CD2 3.95Å; W42-F90 HydrophobicContact CG-CB 4.25Å; W42-F90 AromaticContact CG-CD2 3.79Å; W42-F90 HydrophobicContact CG-CD2 3.79Å; W42-F90 HydrophobicContact CG-CG 4.21Å; A48-F90 HydrophobicContact CB-CD2 4.33Å; A48-F90 HydrophobicContact CB-CE2 4.28Å; A48-F90 WeakPolarHBondContact O-CA 3.41Å; A48-F90 WeakPolarHBondContact O-CD2 3.18Å; A48-F90 WeakPolarHBondContact O-CE2 3.34Å; L64-F90 HydrophobicContact CD1-CE1 4.04Å; L64-F90 HydrophobicContact CD2-CE1 4.32Å; A83-F90 HydrophobicContact CB-CD1 3.68Å; A83-F90 HydrophobicContact CB-CE1 4.43Å; A83-F90 PolarHBondContact N-O 2.92Å; D84-F90 HydrophobicContact CB-CB 4.05Å; D84-F90 PolarHBondContact OD1-N 3.01Å; D84-F90 PolarHBondContact OD2-N 2.73Å; F90-V92 HydrophobicContact CD1-CG2 4.13Å; F90-V92 HydrophobicContact CE1-CG2 4.25Å; F90-F248 HydrophobicContact CD1-CE1 4.46Å; F90-F248 AromaticContact CD1-CE2 3.77Å; F90-F248 HydrophobicContact CD1-CE2 3.77Å; F90-F248 AromaticContact CD1-CZ 3.64Å; F90-F248 HydrophobicContact CD1-CZ 3.64Å; F90-F248 AromaticContact CE1-CE2 3.67Å; F90-F248 HydrophobicContact CE1-CE2 3.67Å; F90-F248 AromaticContact CE1-CZ 3.88Å; F90-F248 HydrophobicContact CE1-CZ 3.88Å; F90-F248 HydrophobicContact CG-CZ 4.29Å
91	P	97.7	Very high	92.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	133.2	175	28.2	-32.7	0	0	0	111.7	G49 I50 P80 Y82 R89 W126 L129	G49-P91 CarbonylContact C-O 3.59Å; G49-P91 WeakPolarHBondContact CA-O 3.43Å; I50-P91 PolarHBondContact N-O 2.75Å; P80-P91 HydrophobicContact CB-CB 3.55Å; P80-P91 HydrophobicContact CG-CB 3.63Å; Y82-P91 HydrophobicContact CD1-CB 4.02Å; Y82-P91 HydrophobicContact CE1-CB 3.74Å; Y82-P91 HydrophobicContact CE1-CG 4.32Å; R89-P91 VanDerWaalsContact C-CD 3.44Å; R89-P91 WeakPolarHBondContact O-CD 3.43Å; P91-W126 HydrophobicContact CB-CE3 4.11Å; P91-W126 HydrophobicContact CB-CZ3 4.21Å; P91-W126 HydrophobicContact CG-CE3 4.04Å; P91-W126 HydrophobicContact CG-CZ3 4.35Å; P91-L129 HydrophobicContact CG-CD1 3.8Å; P91-L129 HydrophobicContact CG-CD2 3.82Å; P91-L129 HydrophobicContact CG-CG 4.42Å
92	V	98	Very high	92	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.6	178.3	-175.6	0	0	0	0	108.3	I50 I60 L64 L66 V81 A83 F90 F97	I50-V92 HydrophobicContact CG2-CB 4.25Å; I50-V92 HydrophobicContact CG2-CG1 3.89Å; I50-V92 HydrophobicContact CG2-CG2 3.93Å; I50-V92 WeakPolarHBondContact O-CA 3.37Å; I60-V92 HydrophobicContact CG2-CG1 4.02Å; L64-V92 HydrophobicContact CD1-CG1 3.99Å; L64-V92 HydrophobicContact CD1-CG2 3.72Å; L66-V92 HydrophobicContact CD1-CB 3.97Å; L66-V92 HydrophobicContact CD1-CG1 4.03Å; L66-V92 HydrophobicContact CD1-CG2 3.74Å; V81-V92 PolarHBondContact N-O 3.46Å; V81-V92 WeakPolarHBondContact O-CB 3.38Å; V81-V92 PolarHBondContact O-N 3.15Å; A83-V92 HydrophobicContact CB-CG2 4.05Å; F90-V92 HydrophobicContact CD1-CG2 4.13Å; F90-V92 HydrophobicContact CE1-CG2 4.25Å; V92-F97 HydrophobicContact CB-CE2 4.27Å; V92-F97 HydrophobicContact CB-CZ 4.42Å; V92-F97 HydrophobicContact CG1-CE2 3.8Å; V92-F97 HydrophobicContact CG1-CZ 3.82Å
93	V	96.9	Very high	91.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.1	167.1	173.9	0	0	0	0	107.7	I50 L51 D52 I71 P80 F120 V124 W126	I50-V93 PolarHBondContact O-N 3.28Å; L51-V93 CarbonylContact C-O 2.98Å; L51-V93 WeakPolarHBondContact CA-O 3.4Å; L51-V93 HydrophobicContact CD1-CB 3.79Å; L51-V93 HydrophobicContact CD1-CG1 3.56Å; D52-V93 PolarHBondContact N-O 2.79Å; I71-V93 HydrophobicContact CD1-CB 4.46Å; I71-V93 HydrophobicContact CD1-CG1 3.85Å; I71-V93 HydrophobicContact CD1-CG2 4.09Å; P80-V93 HydrophobicContact CB-CG2 3.84Å; V93-F120 HydrophobicContact CG1-CB 4.47Å; V93-F120 HydrophobicContact CG1-CD1 3.9Å; V93-F120 HydrophobicContact CG1-CD2 3.88Å; V93-F120 HydrophobicContact CG1-CE1 3.97Å; V93-F120 HydrophobicContact CG1-CE2 3.95Å; V93-F120 HydrophobicContact CG1-CG 3.84Å; V93-F120 HydrophobicContact CG1-CZ 3.99Å; V93-V124 HydrophobicContact CG1-CG2 4.34Å; V93-V124 HydrophobicContact CG2-CG1 3.76Å; V93-V124 HydrophobicContact CG2-CG2 4.01Å; V93-W126 HydrophobicContact CB-CH2 3.68Å; V93-W126 HydrophobicContact CB-CZ2 4.19Å; V93-W126 HydrophobicContact CB-CZ3 4.47Å; V93-W126 HydrophobicContact CG2-CH2 3.53Å; V93-W126 HydrophobicContact CG2-CZ2 3.99Å; V93-W126 HydrophobicContact CG2-CZ3 3.98Å
94	S	95.1	Very high	90.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	143.9	173.6	175.9	0	0	0	0	108.7	D52 P61 G96 F97	D52-S94 WeakPolarHBondContact O-CA 3.44Å; D52-S94 PolarHBondContact OD2-OG 3.09Å; P61-S94 WeakPolarHBondContact CD-OG 3.45Å; P61-S94 WeakPolarHBondContact CG-OG 3.37Å; S94-G96 PolarHBondContact O-N 3.09Å; S94-G96 PolarHBondContact OG-N 2.79Å; S94-F97 WeakPolarHBondContact O-CB 2.89Å; S94-F97 PolarHBondContact O-N 2.94Å; S94-F97 VanDerWaalsContact O-N 3.12Å
95	I	90.4	Very high	89.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-57.7	-26.6	165.5	-172.3	162.5	0	0	0	112	D52 L55 P58 F97 L98 V106 W108 F120	D52-I95 PolarHBondContact O-N 3.43Å; L55-I95 HydrophobicContact CB-CD1 4.26Å; L55-I95 HydrophobicContact CD2-CB 3.99Å; L55-I95 HydrophobicContact CD2-CD1 3.42Å; L55-I95 VanDerWaalsContact CD2-CD1 3.42Å; L55-I95 HydrophobicContact CD2-CG1 4.28Å; L55-I95 HydrophobicContact CD2-CG2 3.88Å; L55-I95 HydrophobicContact CG-CD1 4.26Å; P58-I95 HydrophobicContact CB-CG2 3.87Å; P58-I95 HydrophobicContact CG-CG2 4.13Å; I95-F97 PolarHBondContact O-N 2.69Å; I95-F97 VanDerWaalsContact O-N 3.15Å; I95-L98 WeakPolarHBondContact O-CB 3.38Å; I95-L98 PolarHBondContact O-N 3.16Å; I95-V106 HydrophobicContact CD1-CG1 3.79Å; I95-W108 HydrophobicContact CD1-CD2 4.48Å; I95-W108 HydrophobicContact CD1-CE3 3.87Å; I95-W108 HydrophobicContact CD1-CH2 3.68Å; I95-W108 HydrophobicContact CD1-CZ2 4.32Å; I95-W108 HydrophobicContact CD1-CZ3 3.44Å; I95-W108 VanDerWaalsContact CD1-CZ3 3.44Å; I95-W108 HydrophobicContact CG1-CH2 4.08Å; I95-W108 HydrophobicContact CG1-CZ3 4.28Å; I95-F120 HydrophobicContact CB-CE2 4.42Å
96	G	91.4	Very high	88.8	Confident	13 Å²	13	53.9 Å²	53.9	13%	0.134	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-57.5	-28	176.2	0	0	0	0	0	113.2	S94 L98 L99	S94-G96 PolarHBondContact O-N 3.09Å; S94-G96 PolarHBondContact OG-N 2.79Å; G96-L98 VanDerWaalsContact C-N 3.25Å; G96-L98 PolarHBondContact O-N 2.84Å; G96-L99 PolarHBondContact O-N 2.83Å
97	F	93.5	Very high	88.2	Confident	3 Å²	3	52.1 Å²	52.1	1%	0.013	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-73.7	-13.8	176.5	-59.7	-35.6	0	0	0	114.2	P61 L66 N69 K70 I71 V81 V92 S94 I95	P61-F97 HydrophobicContact CB-CD1 4.32Å; P61-F97 HydrophobicContact CB-CE1 3.72Å; P61-F97 HydrophobicContact CB-CZ 4.4Å; P61-F97 HydrophobicContact CG-CD1 4.11Å; P61-F97 HydrophobicContact CG-CE1 3.72Å; P61-F97 HydrophobicContact CG-CZ 4.18Å; L66-F97 HydrophobicContact CB-CE1 3.99Å; L66-F97 HydrophobicContact CB-CZ 4.06Å; L66-F97 HydrophobicContact CD1-CZ 4.22Å; L66-F97 WeakPolarHBondContact O-CE1 3.39Å; N69-F97 HydrophobicContact CB-CD1 4.25Å; N69-F97 HydrophobicContact CB-CE1 4.08Å; N69-F97 WeakPolarHBondContact O-CD1 3.31Å; K70-F97 WeakPolarHBondContact CD-O 3.31Å; I71-F97 HydrophobicContact CB-CB 3.88Å; I71-F97 HydrophobicContact CB-CD2 4.44Å; I71-F97 HydrophobicContact CG2-CB 4.04Å; V81-F97 HydrophobicContact CB-CE2 3.87Å; V81-F97 HydrophobicContact CB-CZ 4.1Å; V81-F97 HydrophobicContact CG1-CZ 4.45Å; V81-F97 HydrophobicContact CG2-CD2 3.82Å; V81-F97 HydrophobicContact CG2-CE2 3.63Å; V81-F97 HydrophobicContact CG2-CG 4.36Å; V81-F97 HydrophobicContact CG2-CZ 4.01Å; V92-F97 HydrophobicContact CB-CE2 4.27Å; V92-F97 HydrophobicContact CB-CZ 4.42Å; V92-F97 HydrophobicContact CG1-CE2 3.8Å; V92-F97 HydrophobicContact CG1-CZ 3.82Å; S94-F97 WeakPolarHBondContact O-CB 2.89Å; S94-F97 PolarHBondContact O-N 2.94Å; S94-F97 VanDerWaalsContact O-N 3.12Å; I95-F97 PolarHBondContact O-N 2.69Å; I95-F97 VanDerWaalsContact O-N 3.15Å
98	L	89.7	Confident	87.6	Confident	49 Å²	49	50.3 Å²	50.3	26%	0.257	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-89.5	-9.8	174.6	-65.6	174	0	0	0	112.6	I71 W78 I95 G96 W108 M116 F120	I71-L98 HydrophobicContact CG2-CD2 3.35Å; I71-L98 HydrophobicContact CG2-CG 3.84Å; W78-L98 HydrophobicContact CH2-CD2 3.9Å; W78-L98 HydrophobicContact CZ3-CD2 3.79Å; I95-L98 WeakPolarHBondContact O-CB 3.38Å; I95-L98 PolarHBondContact O-N 3.16Å; G96-L98 VanDerWaalsContact C-N 3.25Å; G96-L98 PolarHBondContact O-N 2.84Å; L98-W108 HydrophobicContact CD1-CH2 3.93Å; L98-M116 HydrophobicContact CD1-CE 3.88Å; L98-M116 HydrophobicContact CD1-SD 3.8Å; L98-F120 HydrophobicContact CD1-CE1 4.34Å; L98-F120 HydrophobicContact CD1-CZ 3.73Å; L98-F120 HydrophobicContact CG-CZ 4.46Å
99	L	86.3	Confident	86.8	Confident	14 Å²	14	54.4 Å²	54.4	7%	0.073	29%	0.285	C	S	.	.	S	Bend	trans	-84.3	133.4	-178.9	-54.7	177.6	0	0	0	110.1	P58 K70 G96 N101 V106	P58-L99 HydrophobicContact CG-CD1 4.18Å; K70-L99 PolarHBondContact NZ-O 2.81Å; G96-L99 PolarHBondContact O-N 2.83Å; L99-N101 VanDerWaalsContact C-N 3.31Å; L99-N101 PolarHBondContact O-N 3.2Å; L99-V106 HydrophobicContact CD1-CG2 3.93Å; L99-V106 HydrophobicContact CD2-CG2 3.81Å; L99-V106 HydrophobicContact CG-CG2 4.43Å
100	D	82.2	Confident	85.9	Confident	154 Å²	154	53 Å²	53	82%	0.824	29%	0.294	S	S	*	.	S	Bend	trans	-58.7	-45.2	178.5	-70.6	-35.9	0	0	0	111.7	K70	K70-D100 PolarHBondContact NZ-O 2.84Å
101	N	83.9	Confident	85.2	Confident	80 Å²	80	58.4 Å²	58.4	43%	0.428	33%	0.33	S	S	.	.	S	Bend	trans	-119.9	131.9	173.5	177.1	-22.2	0	0	0	109.5	L99 D103 S104	L99-N101 VanDerWaalsContact C-N 3.31Å; L99-N101 PolarHBondContact O-N 3.2Å; N101-D103 PolarHBondContact O-N 2.73Å; N101-D103 VanDerWaalsContact O-N 3.09Å; N101-D103 PolarHBondContact OD1-N 3.32Å; N101-S104 WeakPolarHBondContact CB-OG 3.45Å; N101-S104 WeakPolarHBondContact O-CB 3.3Å; N101-S104 PolarHBondContact O-N 3.28Å; N101-S104 PolarHBondContact O-OG 2.8Å
102	P	77.9	Confident	84.6	Confident	56 Å²	56	65.6 Å²	65.6	36%	0.364	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-27.4	176.8	-28.4	35.8	0	0	0	115.5	E67 S104	E67-P102 HydrophobicContact CB-CG 4.47Å; P102-S104 VanDerWaalsContact C-N 3.31Å
103	D	79	Confident	83.8	Confident	124 Å²	124	67 Å²	67	66%	0.663	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	4.4	179.5	-60.8	-39.9	0	0	0	113.2	R62 N101	R62-D103 IonicContact NH2-OD1 3.4Å; R62-D103 PolarHBondContact NH2-OD1 3.06Å; N101-D103 PolarHBondContact O-N 2.73Å; N101-D103 VanDerWaalsContact O-N 3.09Å; N101-D103 PolarHBondContact OD1-N 3.32Å
104	S	80.8	Confident	83.2	Confident	50 Å²	50	67.7 Å²	67.7	35%	0.35	37%	0.37	S	S	.	.			trans	-72.8	133.6	178.5	-53.5	0	0	0	0	111.3	N101 P102	N101-S104 WeakPolarHBondContact CB-OG 3.45Å; N101-S104 WeakPolarHBondContact O-CB 3.3Å; N101-S104 PolarHBondContact O-N 3.28Å; N101-S104 PolarHBondContact O-OG 2.8Å; P102-S104 VanDerWaalsContact C-N 3.31Å
105	A	76.6	Confident	82.8	Confident	79 Å²	79	71.3 Å²	71.3	65%	0.653	40%	0.395	S	S	*	.			trans	-69.9	135	170.5	0	0	0	0	0	111.1	I107	A105-I107 HydrophobicContact CB-CG1 4.16Å; A105-I107 PolarHBondContact O-N 2.71Å; A105-I107 VanDerWaalsContact O-N 3.09Å
106	V	76.2	Confident	82.7	Confident	24 Å²	24	72.2 Å²	72.2	15%	0.145	40%	0.4	C	S	.	.			trans	-77.9	94.4	173.5	-172	0	0	0	0	109.9	L55 I95 L99 W108	L55-V106 WeakPolarHBondContact O-CB 3.47Å; L55-V106 WeakPolarHBondContact O-CG2 3.42Å; I95-V106 HydrophobicContact CD1-CG1 3.79Å; L99-V106 HydrophobicContact CD1-CG2 3.93Å; L99-V106 HydrophobicContact CD2-CG2 3.81Å; L99-V106 HydrophobicContact CG-CG2 4.43Å; V106-W108 HydrophobicContact CG1-CB 4.34Å; V106-W108 HydrophobicContact CG1-CD2 3.92Å; V106-W108 HydrophobicContact CG1-CE3 4.43Å; V106-W108 HydrophobicContact CG1-CG 3.89Å; V106-W108 PolarHBondContact O-N 2.82Å
107	I	77.5	Confident	82.5	Confident	155 Å²	155	71.7 Å²	71.7	80%	0.795	39%	0.394	S	S	*	.			trans	-98.2	70.4	179.6	-50	175.2	0	0	0	109.8	A105	A105-I107 HydrophobicContact CB-CG1 4.16Å; A105-I107 PolarHBondContact O-N 2.71Å; A105-I107 VanDerWaalsContact O-N 3.09Å
108	W	77.7	Confident	82.2	Confident	46 Å²	46	72 Å²	72	17%	0.174	40%	0.397	C	S	.	.			trans	-111.5	142.6	178.9	-66.4	4.6	0	0	0	111.7	I95 L98 V106 R112 K113 M116	I95-W108 HydrophobicContact CD1-CD2 4.48Å; I95-W108 HydrophobicContact CD1-CE3 3.87Å; I95-W108 HydrophobicContact CD1-CH2 3.68Å; I95-W108 HydrophobicContact CD1-CZ2 4.32Å; I95-W108 HydrophobicContact CD1-CZ3 3.44Å; I95-W108 VanDerWaalsContact CD1-CZ3 3.44Å; I95-W108 HydrophobicContact CG1-CH2 4.08Å; I95-W108 HydrophobicContact CG1-CZ3 4.28Å; L98-W108 HydrophobicContact CD1-CH2 3.93Å; V106-W108 HydrophobicContact CG1-CB 4.34Å; V106-W108 HydrophobicContact CG1-CD2 3.92Å; V106-W108 HydrophobicContact CG1-CE3 4.43Å; V106-W108 HydrophobicContact CG1-CG 3.89Å; V106-W108 PolarHBondContact O-N 2.82Å; W108-R112 HydrophobicContact CD2-CG 4.36Å; W108-R112 HydrophobicContact CE3-CG 4.1Å; W108-K113 HydrophobicContact CB-CG 3.82Å; W108-K113 WeakPolarHBondContact O-CE 3.47Å; W108-M116 HydrophobicContact CH2-CE 4.04Å; W108-M116 HydrophobicContact CH2-CG 4.47Å; W108-M116 HydrophobicContact CZ3-CB 3.94Å; W108-M116 HydrophobicContact CZ3-CE 4.04Å; W108-M116 HydrophobicContact CZ3-CG 3.88Å
109	R	78.7	Confident	82.2	Confident	218 Å²	218	72.9 Å²	72.9	82%	0.823	40%	0.4	S	S	*	.			trans	-72.7	147.6	173.7	-64.1	-172.5	178.1	-170.1	-0.1	110.6	R112 K113	R109-R112 WeakPolarHBondContact O-CB 3.39Å; R109-R112 PolarHBondContact O-N 3.03Å; R109-K113 PolarHBondContact O-N 3.17Å
110	G	76.9	Confident	82.5	Confident	47 Å²	47	72.2 Å²	72.2	49%	0.485	40%	0.397	S	S	.	.	H	α-helix	trans	-42.4	-50	-176.9	0	0	0	0	0	115.7	R112 K113 G114	G110-R112 VanDerWaalsContact C-N 3.31Å; G110-R112 PolarHBondContact O-N 3.22Å; G110-K113 WeakPolarHBondContact O-CB 3.36Å; G110-K113 PolarHBondContact O-N 2.87Å; G110-K113 VanDerWaalsContact O-N 3.1Å; G110-G114 PolarHBondContact O-N 2.98Å
111	P	83.2	Confident	82.8	Confident	114 Å²	114	64.9 Å²	64.9	74%	0.74	36%	0.358	S	S	*	.	H	α-helix	trans	-60.1	-37.9	179.6	-26.9	35.5	0	0	0	114	K113 S115	P111-K113 VanDerWaalsContact C-N 3.35Å; P111-S115 WeakPolarHBondContact O-CB 3.46Å; P111-S115 PolarHBondContact O-N 3.22Å
112	R	84.6	Confident	83.1	Confident	152 Å²	152	64 Å²	64	57%	0.574	35%	0.353	S	S	*	.	H	α-helix	trans	-68	-38.8	177.5	-173.8	178.8	-179.9	-179.3	1	111	W108 R109 G110 M116	W108-R112 HydrophobicContact CD2-CG 4.36Å; W108-R112 HydrophobicContact CE3-CG 4.1Å; R109-R112 WeakPolarHBondContact O-CB 3.39Å; R109-R112 PolarHBondContact O-N 3.03Å; G110-R112 VanDerWaalsContact C-N 3.31Å; G110-R112 PolarHBondContact O-N 3.22Å; R112-M116 PolarHBondContact O-N 3.17Å
113	K	81.7	Confident	83.7	Confident	29 Å²	29	63.4 Å²	63.4	13%	0.126	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-50.7	175.8	-66.5	178	156.3	-169.7	0	111.3	L55 W108 R109 G110 P111 S115 M116 V117 E143	L55-K113 HydrophobicContact CD1-CB 3.44Å; L55-K113 VanDerWaalsContact CD1-CB 3.44Å; L55-K113 HydrophobicContact CD1-CD 3.7Å; L55-K113 HydrophobicContact CD1-CG 3.49Å; L55-K113 VanDerWaalsContact CD1-CG 3.49Å; W108-K113 HydrophobicContact CB-CG 3.82Å; W108-K113 WeakPolarHBondContact O-CE 3.47Å; R109-K113 PolarHBondContact O-N 3.17Å; G110-K113 WeakPolarHBondContact O-CB 3.36Å; G110-K113 PolarHBondContact O-N 2.87Å; G110-K113 VanDerWaalsContact O-N 3.1Å; P111-K113 VanDerWaalsContact C-N 3.35Å; K113-S115 VanDerWaalsContact C-N 3.34Å; K113-S115 PolarHBondContact O-N 2.84Å; K113-M116 PolarHBondContact O-N 3.1Å; K113-V117 PolarHBondContact O-N 3.25Å; K113-E143 HydrophobicContact CB-CG 4.4Å; K113-E143 HydrophobicContact CD-CG 4.33Å; K113-E143 VanDerWaalsContact CD-OE1 3.23Å; K113-E143 WeakPolarHBondContact CD-OE1 3.42Å; K113-E143 IonicContact NZ-OE1 3.92Å; K113-E143 PolarHBondContact NZ-OE1 2.85Å
114	G	83.5	Confident	84.4	Confident	14 Å²	14	57.5 Å²	57.5	14%	0.144	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-42	177.5	0	0	0	0	0	112.7	G110 M116 V117 G118	G110-G114 PolarHBondContact O-N 2.98Å; G114-M116 VanDerWaalsContact C-N 3.34Å; G114-M116 PolarHBondContact O-N 3.46Å; G114-V117 PolarHBondContact O-N 2.89Å; G114-G118 PolarHBondContact O-N 3.38Å
115	S	86.6	Confident	85	Confident	77 Å²	77	56.4 Å²	56.4	54%	0.538	31%	0.311	S	S	.	.	H	α-helix	trans	-59.5	-42.8	174.4	-171.5	0	0	0	0	112.3	P111 K113 G118 E119	P111-S115 WeakPolarHBondContact O-CB 3.46Å; P111-S115 PolarHBondContact O-N 3.22Å; K113-S115 VanDerWaalsContact C-N 3.34Å; K113-S115 PolarHBondContact O-N 2.84Å; S115-G118 PolarHBondContact O-N 3.23Å; S115-E119 WeakPolarHBondContact O-CB 3.42Å; S115-E119 PolarHBondContact O-N 3.12Å
116	M	87.9	Confident	85.8	Confident	19 Å²	19	52.9 Å²	52.9	9%	0.094	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-40	178.7	-175.7	60.4	56.5	0	0	112	L98 W108 R112 K113 G114 G118 E119 F120	L98-M116 HydrophobicContact CD1-CE 3.88Å; L98-M116 HydrophobicContact CD1-SD 3.8Å; W108-M116 HydrophobicContact CH2-CE 4.04Å; W108-M116 HydrophobicContact CH2-CG 4.47Å; W108-M116 HydrophobicContact CZ3-CB 3.94Å; W108-M116 HydrophobicContact CZ3-CE 4.04Å; W108-M116 HydrophobicContact CZ3-CG 3.88Å; R112-M116 PolarHBondContact O-N 3.17Å; K113-M116 PolarHBondContact O-N 3.1Å; G114-M116 VanDerWaalsContact C-N 3.34Å; G114-M116 PolarHBondContact O-N 3.46Å; M116-G118 VanDerWaalsContact C-N 3.33Å; M116-G118 PolarHBondContact O-N 2.95Å; M116-E119 WeakPolarHBondContact O-CB 3.3Å; M116-E119 PolarHBondContact O-N 3.18Å; M116-F120 HydrophobicContact CG-CD2 4.19Å; M116-F120 HydrophobicContact CG-CE1 4.41Å; M116-F120 HydrophobicContact CG-CE2 3.87Å; M116-F120 HydrophobicContact CG-CZ 4Å; M116-F120 PolarHBondContact O-N 3.35Å; M116-F120 HydrophobicContact SD-CD1 3.99Å; M116-F120 HydrophobicContact SD-CD2 4.47Å; M116-F120 HydrophobicContact SD-CE1 3.53Å; M116-F120 VanDerWaalsContact SD-CE1 3.53Å; M116-F120 HydrophobicContact SD-CE2 4.07Å; M116-F120 HydrophobicContact SD-CG 4.46Å; M116-F120 HydrophobicContact SD-CZ 3.59Å; M116-F120 VanDerWaalsContact SD-CZ 3.59Å
117	V	88	Confident	86.5	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.012	29%	0.294	C	S	.	.	H	α-helix	trans	-58.6	-47.9	173.3	169	0	0	0	0	110.3	I53 K113 G114 E119 F120 L121 T146 V147	I53-V117 HydrophobicContact CB-CG2 4.42Å; I53-V117 HydrophobicContact CG2-CG2 4.32Å; K113-V117 PolarHBondContact O-N 3.25Å; G114-V117 PolarHBondContact O-N 2.89Å; V117-E119 VanDerWaalsContact C-N 3.3Å; V117-E119 PolarHBondContact O-N 3.17Å; V117-F120 PolarHBondContact O-N 3.03Å; V117-L121 HydrophobicContact CG1-CD1 4.01Å; V117-L121 WeakPolarHBondContact O-CG 3.41Å; V117-L121 PolarHBondContact O-N 2.74Å; V117-L121 VanDerWaalsContact O-N 3.1Å; V117-T146 HydrophobicContact CB-CG2 4.47Å; V117-T146 HydrophobicContact CG1-CG2 4.31Å; V117-V147 HydrophobicContact CG1-CB 4.35Å; V117-V147 HydrophobicContact CG1-CG2 3.5Å; V117-V147 HydrophobicContact CG2-CG2 4.46Å
118	G	88.2	Confident	87.2	Confident	8 Å²	8	54.9 Å²	54.9	8%	0.082	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-41.1	175.5	0	0	0	0	0	112.4	G114 S115 M116 L121 N122	G114-G118 PolarHBondContact O-N 3.38Å; S115-G118 PolarHBondContact O-N 3.23Å; M116-G118 VanDerWaalsContact C-N 3.33Å; M116-G118 PolarHBondContact O-N 2.95Å; G118-L121 PolarHBondContact O-N 3.15Å; G118-N122 VanDerWaalsContact O-CB 3.26Å; G118-N122 WeakPolarHBondContact O-CB 3.34Å; G118-N122 PolarHBondContact O-N 3.31Å; G118-N122 PolarHBondContact O-ND2 2.94Å
119	E	89	Confident	88	Confident	68 Å²	68	53 Å²	53	32%	0.318	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-44.4	178.5	-168.9	173	-176.9	0	0	112.2	W78 S115 M116 V117 L121 N122 S123	W78-E119 WeakPolarHBondContact CZ2-OE1 2.92Å; W78-E119 VanDerWaalsContact NE1-CG 3.3Å; W78-E119 PolarHBondContact NE1-OE1 2.91Å; S115-E119 WeakPolarHBondContact O-CB 3.42Å; S115-E119 PolarHBondContact O-N 3.12Å; M116-E119 WeakPolarHBondContact O-CB 3.3Å; M116-E119 PolarHBondContact O-N 3.18Å; V117-E119 VanDerWaalsContact C-N 3.3Å; V117-E119 PolarHBondContact O-N 3.17Å; E119-L121 VanDerWaalsContact C-N 3.33Å; E119-L121 PolarHBondContact O-N 2.92Å; E119-N122 PolarHBondContact O-N 3.18Å; E119-S123 WeakPolarHBondContact O-CA 3.45Å; E119-S123 VanDerWaalsContact O-CB 3.26Å; E119-S123 WeakPolarHBondContact O-CB 3.34Å; E119-S123 PolarHBondContact O-N 3.01Å
120	F	91.8	Very high	88.8	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-34.8	176.3	-72	-18.6	0	0	0	113.4	L51 I53 I71 V93 I95 L98 M116 V117 V124 W126	L51-F120 HydrophobicContact CD1-CB 3.87Å; L51-F120 HydrophobicContact CD1-CD2 3.85Å; L51-F120 HydrophobicContact CD1-CG 4.15Å; L51-F120 HydrophobicContact CD2-CB 4.37Å; I53-F120 HydrophobicContact CG2-CD2 4.16Å; I71-F120 HydrophobicContact CD1-CE1 4.25Å; V93-F120 HydrophobicContact CG1-CB 4.47Å; V93-F120 HydrophobicContact CG1-CD1 3.9Å; V93-F120 HydrophobicContact CG1-CD2 3.88Å; V93-F120 HydrophobicContact CG1-CE1 3.97Å; V93-F120 HydrophobicContact CG1-CE2 3.95Å; V93-F120 HydrophobicContact CG1-CG 3.84Å; V93-F120 HydrophobicContact CG1-CZ 3.99Å; I95-F120 HydrophobicContact CB-CE2 4.42Å; L98-F120 HydrophobicContact CD1-CE1 4.34Å; L98-F120 HydrophobicContact CD1-CZ 3.73Å; L98-F120 HydrophobicContact CG-CZ 4.46Å; M116-F120 HydrophobicContact CG-CD2 4.19Å; M116-F120 HydrophobicContact CG-CE1 4.41Å; M116-F120 HydrophobicContact CG-CE2 3.87Å; M116-F120 HydrophobicContact CG-CZ 4Å; M116-F120 PolarHBondContact O-N 3.35Å; M116-F120 HydrophobicContact SD-CD1 3.99Å; M116-F120 HydrophobicContact SD-CD2 4.47Å; M116-F120 HydrophobicContact SD-CE1 3.53Å; M116-F120 VanDerWaalsContact SD-CE1 3.53Å; M116-F120 HydrophobicContact SD-CE2 4.07Å; M116-F120 HydrophobicContact SD-CG 4.46Å; M116-F120 HydrophobicContact SD-CZ 3.59Å; M116-F120 VanDerWaalsContact SD-CZ 3.59Å; V117-F120 PolarHBondContact O-N 3.03Å; F120-V124 HydrophobicContact CB-CG2 4.23Å; F120-V124 HydrophobicContact CD1-CG2 4.09Å; F120-V124 WeakPolarHBondContact O-CB 3.41Å; F120-V124 WeakPolarHBondContact O-CG2 3.41Å; F120-W126 PolarHBondContact O-NE1 3.04Å
121	L	90.2	Very high	89.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-75.4	-33.2	177.3	-67.5	173.4	0	0	0	112.8	G11 I12 L51 V117 G118 E119 I134 H150 L151	G11-L121 CarbonylContact C-O 3.56Å; G11-L121 WeakPolarHBondContact CA-O 3.31Å; I12-L121 HydrophobicContact CG2-CD2 4.07Å; I12-L121 PolarHBondContact N-O 3.26Å; I12-L121 VanDerWaalsContact N-O 3.11Å; L51-L121 HydrophobicContact CD2-CD2 3.64Å; L51-L121 HydrophobicContact CD2-CG 4.31Å; V117-L121 HydrophobicContact CG1-CD1 4.01Å; V117-L121 WeakPolarHBondContact O-CG 3.41Å; V117-L121 PolarHBondContact O-N 2.74Å; V117-L121 VanDerWaalsContact O-N 3.1Å; G118-L121 PolarHBondContact O-N 3.15Å; E119-L121 VanDerWaalsContact C-N 3.33Å; E119-L121 PolarHBondContact O-N 2.92Å; L121-I134 HydrophobicContact CD2-CD1 3.93Å; L121-H150 HydrophobicContact CD1-CB 3.53Å; L121-L151 HydrophobicContact CD2-CD2 4.14Å
122	N	88.9	Confident	90.5	Very high	62 Å²	62	37.4 Å²	37.4	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-113.2	2.7	-169.9	-60.4	-60.1	0	0	0	114.9	P10 G118 E119	P10-N122 CarbonylContact O-C 3.55Å; G118-N122 VanDerWaalsContact O-CB 3.26Å; G118-N122 WeakPolarHBondContact O-CB 3.34Å; G118-N122 PolarHBondContact O-N 3.31Å; G118-N122 PolarHBondContact O-ND2 2.94Å; E119-N122 PolarHBondContact O-N 3.18Å
123	S	90.5	Very high	91.1	Very high	42 Å²	42	30.1 Å²	30.1	29%	0.294	17%	0.173	S	C	.	.	H	α-helix	trans	-146.6	6.4	-176.3	-53.2	0	0	0	0	113.4	P10 G77 W78 E119	P10-S123 PolarHBondContact O-N 3.15Å; G77-S123 CarbonylContact C-O 3.57Å; G77-S123 WeakPolarHBondContact CA-O 3.31Å; W78-S123 PolarHBondContact N-O 3.23Å; E119-S123 WeakPolarHBondContact O-CA 3.45Å; E119-S123 VanDerWaalsContact O-CB 3.26Å; E119-S123 WeakPolarHBondContact O-CB 3.34Å; E119-S123 PolarHBondContact O-N 3.01Å
124	V	93.9	Very high	91.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-83	133.3	169.6	169.2	0	0	0	0	110	P10 G11 W78 P80 V93 F120 W126	P10-V124 CarbonylContact C-O 3.41Å; P10-V124 WeakPolarHBondContact CB-O 3.43Å; G11-V124 PolarHBondContact N-O 3.3Å; W78-V124 HydrophobicContact CB-CB 4.45Å; W78-V124 HydrophobicContact CB-CG2 3.74Å; W78-V124 HydrophobicContact CG-CG2 4.48Å; W78-V124 WeakPolarHBondContact O-CA 3.37Å; P80-V124 HydrophobicContact CB-CG1 4.43Å; V93-V124 HydrophobicContact CG1-CG2 4.34Å; V93-V124 HydrophobicContact CG2-CG1 3.76Å; V93-V124 HydrophobicContact CG2-CG2 4.01Å; F120-V124 HydrophobicContact CB-CG2 4.23Å; F120-V124 HydrophobicContact CD1-CG2 4.09Å; F120-V124 WeakPolarHBondContact O-CB 3.41Å; F120-V124 WeakPolarHBondContact O-CG2 3.41Å; V124-W126 HydrophobicContact CB-CD2 4.23Å; V124-W126 HydrophobicContact CB-CG 4.29Å; V124-W126 HydrophobicContact CB-CZ2 4.15Å; V124-W126 HydrophobicContact CG1-CD2 3.51Å; V124-W126 HydrophobicContact CG1-CE3 4.03Å; V124-W126 HydrophobicContact CG1-CG 3.79Å; V124-W126 HydrophobicContact CG1-CH2 4.33Å; V124-W126 HydrophobicContact CG1-CZ2 3.84Å; V124-W126 HydrophobicContact CG1-CZ3 4.41Å; V124-W126 HydrophobicContact CG2-CZ2 4.37Å; V124-W126 VanDerWaalsContact O-CD1 3.31Å; V124-W126 PolarHBondContact O-N 3.31Å
125	C	93.7	Very high	92.4	Very high	28 Å²	28	28.1 Å²	28.1	19%	0.189	16%	0.16	C	C	.	.			trans	-74.6	63.6	174	-62.1	0	0	0	0	111.2	W78 L79 G127	W78-C125 PolarHBondContact O-N 2.94Å; L79-C125 HydrophobicContact CD2-CB 4.2Å; C125-G127 PolarHBondContact O-N 2.97Å
126	W	93.1	Very high	92.7	Very high	5 Å²	5	24.4 Å²	24.4	2%	0.019	14%	0.135	C	C	.	.			trans	-60.9	-29.7	-179.1	-68.1	110.2	0	0	0	113.2	I15 L51 P91 V93 F120 V124 L129 L132	I15-W126 HydrophobicContact CD1-CB 4.1Å; I15-W126 HydrophobicContact CD1-CD2 4.4Å; I15-W126 HydrophobicContact CD1-CG 3.92Å; L51-W126 HydrophobicContact CB-CH2 3.83Å; L51-W126 HydrophobicContact CB-CZ2 4Å; L51-W126 HydrophobicContact CD1-CH2 4.39Å; L51-W126 HydrophobicContact CD1-CZ2 4.22Å; L51-W126 HydrophobicContact CD2-CZ2 4.3Å; L51-W126 HydrophobicContact CG-CZ2 4.4Å; P91-W126 HydrophobicContact CB-CE3 4.11Å; P91-W126 HydrophobicContact CB-CZ3 4.21Å; P91-W126 HydrophobicContact CG-CE3 4.04Å; P91-W126 HydrophobicContact CG-CZ3 4.35Å; V93-W126 HydrophobicContact CB-CH2 3.68Å; V93-W126 HydrophobicContact CB-CZ2 4.19Å; V93-W126 HydrophobicContact CB-CZ3 4.47Å; V93-W126 HydrophobicContact CG2-CH2 3.53Å; V93-W126 HydrophobicContact CG2-CZ2 3.99Å; V93-W126 HydrophobicContact CG2-CZ3 3.98Å; F120-W126 PolarHBondContact O-NE1 3.04Å; V124-W126 HydrophobicContact CB-CD2 4.23Å; V124-W126 HydrophobicContact CB-CG 4.29Å; V124-W126 HydrophobicContact CB-CZ2 4.15Å; V124-W126 HydrophobicContact CG1-CD2 3.51Å; V124-W126 HydrophobicContact CG1-CE3 4.03Å; V124-W126 HydrophobicContact CG1-CG 3.79Å; V124-W126 HydrophobicContact CG1-CH2 4.33Å; V124-W126 HydrophobicContact CG1-CZ2 3.84Å; V124-W126 HydrophobicContact CG1-CZ3 4.41Å; V124-W126 HydrophobicContact CG2-CZ2 4.37Å; V124-W126 VanDerWaalsContact O-CD1 3.31Å; V124-W126 PolarHBondContact O-N 3.31Å; W126-L129 HydrophobicContact CB-CD1 4.02Å; W126-L129 HydrophobicContact CD2-CD1 4.4Å; W126-L129 HydrophobicContact CE3-CD1 3.91Å; W126-L132 HydrophobicContact CD2-CD1 4.4Å; W126-L132 HydrophobicContact CE3-CD1 4.04Å; W126-L132 HydrophobicContact CH2-CD1 3.63Å; W126-L132 HydrophobicContact CZ2-CD1 4.02Å; W126-L132 HydrophobicContact CZ2-CD2 4.2Å; W126-L132 HydrophobicContact CZ3-CD1 3.64Å
127	G	90.2	Very high	92.7	Very high	42 Å²	42	23.8 Å²	23.8	43%	0.433	13%	0.132	S	C	.	.			trans	75.3	-151.1	-170.3	0	0	0	0	0	111.6	N14 C125	N14-G127 VanDerWaalsContact CB-O 3.3Å; N14-G127 WeakPolarHBondContact CB-O 2.9Å; C125-G127 PolarHBondContact O-N 2.97Å
128	K	92.7	Very high	92.7	Very high	179 Å²	179	25.6 Å²	25.6	78%	0.778	14%	0.144	S	C	*	.	S	Bend	trans	-91.7	121.5	172.8	-67.3	-178.6	179	-179.4	0	108.6	N14	N14-K128 HydrophobicContact CB-CG 4.48Å
129	L	95	Very high	92.4	Very high	6 Å²	6	26 Å²	26	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	142.2	177.4	-63.5	178	0	0	0	110.9	N14 I15 K16 S47 P91 W126	N14-L129 PolarHBondContact O-N 3.12Å; I15-L129 WeakPolarHBondContact CA-O 3.39Å; I15-L129 HydrophobicContact CD1-CD1 4.2Å; I15-L129 HydrophobicContact CG1-CB 4.16Å; I15-L129 HydrophobicContact CG1-CD1 4.44Å; I15-L129 HydrophobicContact CG2-CB 4.19Å; K16-L129 PolarHBondContact N-O 3.38Å; S47-L129 WeakPolarHBondContact OG-CA 3.06Å; P91-L129 HydrophobicContact CG-CD1 3.8Å; P91-L129 HydrophobicContact CG-CD2 3.82Å; P91-L129 HydrophobicContact CG-CG 4.42Å; W126-L129 HydrophobicContact CB-CD1 4.02Å; W126-L129 HydrophobicContact CD2-CD1 4.4Å; W126-L129 HydrophobicContact CE3-CD1 3.91Å
130	D	96	Very high	91.8	Very high	32 Å²	32	26.1 Å²	26.1	17%	0.171	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-41.3	168.5	-58.2	-63	0	0	0	109.9	K16 H17 F46 S47	K16-D130 WeakPolarHBondContact CE-OD1 3.39Å; K16-D130 IonicContact NZ-OD1 2.88Å; K16-D130 PolarHBondContact NZ-OD1 3.17Å; H17-D130 PolarHBondContact N-O 3.06Å; F46-D130 HydrophobicContact CB-CB 4.12Å; F46-D130 HydrophobicContact CD1-CB 4.13Å; S47-D130 PolarHBondContact N-OD2 3.19Å; S47-D130 WeakPolarHBondContact O-CB 3.2Å; S47-D130 PolarHBondContact O-N 2.84Å; S47-D130 PolarHBondContact OG-N 3.29Å; S47-D130 PolarHBondContact OG-OD2 3.15Å
131	Y	97.5	Very high	90.9	Very high	19 Å²	19	27.6 Å²	27.6	8%	0.075	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.3	-177.5	-59.4	-83	0	0	0	112.5	H17 L19 L41 F46 S47 A48 G49 L266 L269	H17-Y131 HydrophobicContact CB-CD1 3.66Å; H17-Y131 HydrophobicContact CB-CE1 3.81Å; H17-Y131 AromaticContact CD2-CE1 3.68Å; H17-Y131 AromaticContact CG-CE1 3.89Å; H17-Y131 CarbonylContact O-C 3.58Å; H17-Y131 VanDerWaalsContact O-CA 3.3Å; H17-Y131 WeakPolarHBondContact O-CA 3.23Å; L19-Y131 HydrophobicContact CD1-CD1 4.17Å; L41-Y131 HydrophobicContact CD1-CD1 4.37Å; L41-Y131 HydrophobicContact CD1-CD2 4.4Å; L41-Y131 HydrophobicContact CD1-CG 3.94Å; L41-Y131 HydrophobicContact CD2-CD1 4.45Å; L41-Y131 HydrophobicContact CD2-CD2 3.98Å; L41-Y131 HydrophobicContact CD2-CE2 4.13Å; L41-Y131 HydrophobicContact CD2-CG 4.17Å; F46-Y131 HydrophobicContact CB-CD2 3.9Å; F46-Y131 HydrophobicContact CB-CE2 4.04Å; F46-Y131 HydrophobicContact CD1-CD2 4.39Å; F46-Y131 AromaticContact CD1-CE2 3.7Å; F46-Y131 HydrophobicContact CD1-CE2 3.7Å; F46-Y131 HydrophobicContact CD2-CD2 4.41Å; F46-Y131 AromaticContact CD2-CE2 3.91Å; F46-Y131 HydrophobicContact CD2-CE2 3.91Å; F46-Y131 HydrophobicContact CE1-CE2 4.08Å; F46-Y131 HydrophobicContact CE2-CE2 4.28Å; F46-Y131 AromaticContact CG-CD2 4Å; F46-Y131 HydrophobicContact CG-CD2 4Å; F46-Y131 AromaticContact CG-CE2 3.6Å; F46-Y131 HydrophobicContact CG-CE2 3.6Å; F46-Y131 HydrophobicContact CZ-CE2 4.35Å; S47-Y131 PolarHBondContact O-N 3.32Å; A48-Y131 CarbonylContact C-O 3.58Å; A48-Y131 VanDerWaalsContact CA-O 3.27Å; A48-Y131 WeakPolarHBondContact CA-O 3.16Å; G49-Y131 PolarHBondContact N-O 3.4Å; Y131-L266 HydrophobicContact CE1-CD2 4.22Å; Y131-L266 HydrophobicContact CE2-CD2 4.06Å; Y131-L266 WeakPolarHBondContact OH-CD2 3.29Å; Y131-L269 HydrophobicContact CD1-CD1 4.28Å; Y131-L269 HydrophobicContact CE1-CD1 3.64Å
132	L	97.6	Very high	90.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.2	163	176.2	64.9	0	0	0	109.2	I12 I15 H17 V18 L19 L51 W126 I134	I12-L132 HydrophobicContact CG2-CD2 3.86Å; I15-L132 HydrophobicContact CD1-CB 3.83Å; I15-L132 HydrophobicContact CD1-CD2 3.57Å; I15-L132 HydrophobicContact CD1-CG 4.23Å; I15-L132 HydrophobicContact CG2-CB 3.76Å; H17-L132 PolarHBondContact O-N 3.38Å; V18-L132 CarbonylContact C-O 3.57Å; V18-L132 WeakPolarHBondContact CA-O 3.38Å; V18-L132 HydrophobicContact CG2-CB 4.31Å; L19-L132 PolarHBondContact N-O 3.19Å; L51-L132 HydrophobicContact CB-CD1 4.19Å; W126-L132 HydrophobicContact CD2-CD1 4.4Å; W126-L132 HydrophobicContact CE3-CD1 4.04Å; W126-L132 HydrophobicContact CH2-CD1 3.63Å; W126-L132 HydrophobicContact CZ2-CD1 4.02Å; W126-L132 HydrophobicContact CZ2-CD2 4.2Å; W126-L132 HydrophobicContact CZ3-CD1 3.64Å; L132-I134 HydrophobicContact CD2-CD1 4.26Å; L132-I134 HydrophobicContact CD2-CG1 4.18Å; L132-I134 HydrophobicContact CG-CG1 4.08Å
133	V	98.1	Very high	89.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.2	172.3	-175.3	0	0	0	0	108.8	L19 V21 A34 L37 A38 L41 G49 I50 L51	L19-V133 CarbonylContact O-C 3.42Å; L19-V133 WeakPolarHBondContact O-CA 3.46Å; V21-V133 HydrophobicContact CG2-CG1 3.63Å; A34-V133 HydrophobicContact CB-CG1 3.92Å; L37-V133 HydrophobicContact CD2-CG1 4.46Å; L37-V133 HydrophobicContact CD2-CG2 4.25Å; L37-V133 HydrophobicContact CG-CG2 4.19Å; A38-V133 HydrophobicContact CB-CB 4.18Å; A38-V133 HydrophobicContact CB-CG2 3.86Å; L41-V133 HydrophobicContact CD1-CG2 4.09Å; G49-V133 PolarHBondContact O-N 3.45Å; I50-V133 CarbonylContact C-O 3.6Å; I50-V133 VanDerWaalsContact CA-O 3.23Å; I50-V133 WeakPolarHBondContact CA-O 3.36Å; I50-V133 HydrophobicContact CG1-CB 4.31Å; L51-V133 PolarHBondContact N-O 2.88Å
134	I	96.5	Very high	89	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.2	178.2	-55.2	-177.6	0	0	0	108.9	V18 L19 V21 L51 I53 L121 L132 T136 V147 L151	V18-I134 HydrophobicContact CG1-CD1 3.41Å; V18-I134 VanDerWaalsContact CG1-CD1 3.41Å; V18-I134 HydrophobicContact CG1-CG1 3.94Å; L19-I134 PolarHBondContact O-N 3.3Å; V21-I134 PolarHBondContact N-O 3.36Å; L51-I134 HydrophobicContact CB-CG1 4.24Å; L51-I134 HydrophobicContact CD2-CD1 4.36Å; L51-I134 HydrophobicContact CD2-CG1 4.38Å; L51-I134 HydrophobicContact CD2-CG2 4.34Å; L51-I134 HydrophobicContact CG-CG2 4.41Å; L51-I134 CarbonylContact O-C 3.58Å; L51-I134 WeakPolarHBondContact O-CA 3.34Å; I53-I134 HydrophobicContact CD1-CG2 3.48Å; I53-I134 VanDerWaalsContact CD1-CG2 3.48Å; I53-I134 HydrophobicContact CG1-CG2 3.87Å; L121-I134 HydrophobicContact CD2-CD1 3.93Å; L132-I134 HydrophobicContact CD2-CD1 4.26Å; L132-I134 HydrophobicContact CD2-CG1 4.18Å; L132-I134 HydrophobicContact CG-CG1 4.08Å; I134-T136 HydrophobicContact CG2-CG2 4.05Å; I134-V147 HydrophobicContact CG2-CG1 4.36Å; I134-L151 HydrophobicContact CD1-CD1 4.13Å; I134-L151 HydrophobicContact CD1-CD2 4.11Å
135	D	95.7	Very high	88.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	105.6	173	-173.1	29	0	0	0	109.7	K30 S31 A34 L51 I53 D54 I60	K30-D135 WeakPolarHBondContact CG-OD1 3.15Å; K30-D135 IonicContact NZ-OD1 3.06Å; K30-D135 PolarHBondContact NZ-OD1 2.78Å; K30-D135 IonicContact NZ-OD2 3.05Å; S31-D135 WeakPolarHBondContact CA-OD2 3.41Å; S31-D135 WeakPolarHBondContact CB-OD2 2.85Å; S31-D135 PolarHBondContact OG-OD2 2.8Å; A34-D135 HydrophobicContact CB-CB 4.05Å; L51-D135 PolarHBondContact O-N 3.14Å; I53-D135 WeakPolarHBondContact CG1-O 3.38Å; I53-D135 PolarHBondContact N-O 2.89Å; I53-D135 VanDerWaalsContact N-O 3.09Å; D54-D135 PolarHBondContact N-O 3.09Å; I60-D135 HydrophobicContact CG1-CB 4.32Å
136	T	92.5	Very high	88.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-91	158.4	-175.5	58.6	0	0	0	0	112.4	V20 V21 T22 K30 I53 I134 V147	V20-T136 HydrophobicContact CG1-CG2 3.45Å; V20-T136 VanDerWaalsContact CG1-CG2 3.45Å; V21-T136 PolarHBondContact O-N 2.55Å; V21-T136 VanDerWaalsContact O-N 3.16Å; V21-T136 PolarHBondContact O-OG1 3.36Å; T22-T136 WeakPolarHBondContact CA-OG1 3.41Å; T22-T136 WeakPolarHBondContact CB-OG1 3.36Å; K30-T136 VanDerWaalsContact CD-O 3.31Å; K30-T136 WeakPolarHBondContact CD-O 3.47Å; K30-T136 WeakPolarHBondContact CE-O 2.92Å; K30-T136 PolarHBondContact NZ-O 3Å; I53-T136 HydrophobicContact CD1-CG2 4.23Å; I134-T136 HydrophobicContact CG2-CG2 4.05Å; T136-V147 HydrophobicContact CG2-CG1 4.28Å
137	P	88.9	Confident	87.7	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.032	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-57.2	152.9	165.4	-23	34.7	0	0	0	111.6	I53 E143	I53-P137 WeakPolarHBondContact O-CD 3.19Å; I53-P137 VanDerWaalsContact O-CG 3.29Å; I53-P137 WeakPolarHBondContact O-CG 3.29Å; P137-E143 HydrophobicContact CG-CB 3.82Å
138	P	87.3	Confident	87.5	Confident	41 Å²	41	30.7 Å²	30.7	27%	0.266	17%	0.165	S	C	.	.	S	Bend	trans	-70.2	152.6	177.2	30	-35.1	0	0	0	112.7	S23	S23-P138 CarbonylContact O-C 3.53Å; S23-P138 WeakPolarHBondContact O-CA 3.27Å
139	G	81.7	Confident	87.1	Confident	15 Å²	15	26.4 Å²	26.4	16%	0.155	15%	0.148	C	C	.	.	S	Bend	trans	72	-174.1	175.7	0	0	0	0	0	113.4	S23 S141 H144	S23-G139 PolarHBondContact O-N 3.07Å; G139-S141 PolarHBondContact O-N 3.14Å; G139-H144 WeakPolarHBondContact O-CB 3.3Å
140	T	75.3	Confident	86.6	Confident	72 Å²	72	28.4 Å²	28.4	44%	0.442	16%	0.157	S	C	.	.	S	Bend	trans	-85.6	51.4	178.2	60.3	0	0	0	0	111.2	E179 F182	T140-E179 VanDerWaalsContact CG2-OE2 3.31Å; T140-E179 WeakPolarHBondContact CG2-OE2 3.49Å; T140-F182 HydrophobicContact CG2-CB 3.89Å; T140-F182 HydrophobicContact CG2-CD1 4.19Å; T140-F182 HydrophobicContact CG2-CD2 4.37Å; T140-F182 HydrophobicContact CG2-CG 3.9Å
141	S	74.2	Confident	86.1	Confident	31 Å²	31	26.9 Å²	26.9	22%	0.217	15%	0.148	C	C	.	.			trans	-69.5	159.6	178.7	57.2	0	0	0	0	112	G139 E143 H144 I145	G139-S141 PolarHBondContact O-N 3.14Å; S141-E143 WeakPolarHBondContact CB-OE2 3.43Å; S141-E143 PolarHBondContact O-N 2.79Å; S141-H144 WeakPolarHBondContact O-CB 3.44Å; S141-H144 PolarHBondContact O-N 3.4Å; S141-H144 VanDerWaalsContact O-N 3.1Å; S141-H144 WeakPolarHBondContact OG-CB 3.19Å; S141-H144 PolarHBondContact OG-N 2.91Å; S141-I145 WeakPolarHBondContact O-CG1 3.27Å; S141-I145 PolarHBondContact O-N 2.83Å
142	D	74.6	Confident	85.3	Confident	126 Å²	126	29.8 Å²	29.8	67%	0.674	16%	0.163	S	C	*	.	H	α-helix	trans	-57.5	-37.4	175.3	-71.5	-17.1	0	0	0	111.2	I145 T146	D142-I145 PolarHBondContact O-N 3.38Å; D142-T146 VanDerWaalsContact O-CB 3.31Å; D142-T146 WeakPolarHBondContact O-CB 3.41Å; D142-T146 PolarHBondContact O-N 2.73Å; D142-T146 PolarHBondContact O-OG1 2.94Å
143	E	75.9	Confident	84.4	Confident	35 Å²	35	37 Å²	37	16%	0.164	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-46.2	175	-63.6	93.9	157.2	0	0	111.6	L55 K113 P137 S141 T146 V147	L55-E143 HydrophobicContact CD1-CG 4.05Å; K113-E143 HydrophobicContact CB-CG 4.4Å; K113-E143 HydrophobicContact CD-CG 4.33Å; K113-E143 VanDerWaalsContact CD-OE1 3.23Å; K113-E143 WeakPolarHBondContact CD-OE1 3.42Å; K113-E143 IonicContact NZ-OE1 3.92Å; K113-E143 PolarHBondContact NZ-OE1 2.85Å; P137-E143 HydrophobicContact CG-CB 3.82Å; S141-E143 WeakPolarHBondContact CB-OE2 3.43Å; S141-E143 PolarHBondContact O-N 2.79Å; E143-T146 WeakPolarHBondContact O-CB 3.5Å; E143-T146 PolarHBondContact O-N 2.92Å; E143-V147 VanDerWaalsContact O-CG2 3.25Å; E143-V147 WeakPolarHBondContact O-CG2 3.46Å; E143-V147 PolarHBondContact O-N 2.79Å
144	H	79.8	Confident	83.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-45.9	175.4	175.3	89.2	0	0	0	111.7	T22 G139 S141 T146 V147 L148 E179 F182	T22-H144 PolarHBondContact OG1-CE1 2.65Å; G139-H144 WeakPolarHBondContact O-CB 3.3Å; S141-H144 WeakPolarHBondContact O-CB 3.44Å; S141-H144 PolarHBondContact O-N 3.4Å; S141-H144 VanDerWaalsContact O-N 3.1Å; S141-H144 WeakPolarHBondContact OG-CB 3.19Å; S141-H144 PolarHBondContact OG-N 2.91Å; H144-T146 VanDerWaalsContact C-N 3.33Å; H144-T146 PolarHBondContact O-N 2.75Å; H144-V147 WeakPolarHBondContact O-CB 3.28Å; H144-V147 PolarHBondContact O-N 2.8Å; H144-L148 WeakPolarHBondContact NE2-CD1 3.47Å; H144-L148 WeakPolarHBondContact O-CG 3.5Å; H144-L148 PolarHBondContact O-N 3.5Å; H144-E179 IonicContact CE1-OE1 2.8Å; H144-E179 PolarHBondContact CE1-OE1 2.89Å; H144-E179 IonicContact ND1-OE1 2.79Å; H144-E179 IonicContact NE2-OE1 2.88Å; H144-E179 PolarHBondContact NE2-OE1 3.45Å; H144-F182 AromaticContact CD2-CE1 3.73Å; H144-F182 AromaticContact NE2-CE1 3.51Å
145	I	83	Confident	81.5	Confident	49 Å²	49	40.9 Å²	40.9	25%	0.251	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-45.5	176.4	-64.8	167.5	0	0	0	110.5	S141 D142 V147 L148 E149 F182	S141-I145 WeakPolarHBondContact O-CG1 3.27Å; S141-I145 PolarHBondContact O-N 2.83Å; D142-I145 PolarHBondContact O-N 3.38Å; I145-V147 VanDerWaalsContact C-N 3.3Å; I145-V147 PolarHBondContact O-N 2.9Å; I145-L148 PolarHBondContact O-N 3.06Å; I145-L148 VanDerWaalsContact O-N 3.15Å; I145-E149 HydrophobicContact CG2-CG 4.18Å; I145-E149 WeakPolarHBondContact O-CG 3.34Å; I145-E149 PolarHBondContact O-N 2.94Å; I145-F182 HydrophobicContact CD1-CE2 4.47Å; I145-F182 HydrophobicContact CG1-CE2 4.02Å; I145-F182 HydrophobicContact CG1-CZ 3.79Å
146	T	84.3	Confident	80	Confident	30 Å²	30	45.9 Å²	45.9	18%	0.184	25%	0.254	C	S	.	.	H	α-helix	trans	-57.7	-42.5	179.8	-60.6	0	0	0	0	111.7	V117 D142 E143 H144 E149 H150	V117-T146 HydrophobicContact CB-CG2 4.47Å; V117-T146 HydrophobicContact CG1-CG2 4.31Å; D142-T146 VanDerWaalsContact O-CB 3.31Å; D142-T146 WeakPolarHBondContact O-CB 3.41Å; D142-T146 PolarHBondContact O-N 2.73Å; D142-T146 PolarHBondContact O-OG1 2.94Å; E143-T146 WeakPolarHBondContact O-CB 3.5Å; E143-T146 PolarHBondContact O-N 2.92Å; H144-T146 VanDerWaalsContact C-N 3.33Å; H144-T146 PolarHBondContact O-N 2.75Å; T146-E149 PolarHBondContact O-N 3.41Å; T146-H150 PolarHBondContact O-CD2 2.82Å; T146-H150 PolarHBondContact O-N 3.39Å
147	V	85.7	Confident	79.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.4	-52.4	175.9	175.7	0	0	0	0	110.6	I53 V117 I134 T136 E143 H144 I145 E149 H150 L151	I53-V147 HydrophobicContact CD1-CB 4.16Å; I53-V147 HydrophobicContact CD1-CG1 3.97Å; I53-V147 HydrophobicContact CD1-CG2 3.07Å; I53-V147 HydrophobicContact CG1-CG2 4.43Å; V117-V147 HydrophobicContact CG1-CB 4.35Å; V117-V147 HydrophobicContact CG1-CG2 3.5Å; V117-V147 HydrophobicContact CG2-CG2 4.46Å; I134-V147 HydrophobicContact CG2-CG1 4.36Å; T136-V147 HydrophobicContact CG2-CG1 4.28Å; E143-V147 VanDerWaalsContact O-CG2 3.25Å; E143-V147 WeakPolarHBondContact O-CG2 3.46Å; E143-V147 PolarHBondContact O-N 2.79Å; H144-V147 WeakPolarHBondContact O-CB 3.28Å; H144-V147 PolarHBondContact O-N 2.8Å; I145-V147 VanDerWaalsContact C-N 3.3Å; I145-V147 PolarHBondContact O-N 2.9Å; V147-E149 VanDerWaalsContact C-N 3.32Å; V147-E149 PolarHBondContact O-N 3.03Å; V147-H150 PolarHBondContact O-N 3.35Å; V147-L151 HydrophobicContact CG1-CD1 3.87Å; V147-L151 HydrophobicContact CG1-CG 4.34Å; V147-L151 VanDerWaalsContact O-CG 3.28Å; V147-L151 WeakPolarHBondContact O-CG 3.24Å; V147-L151 PolarHBondContact O-N 2.72Å
148	L	85.8	Confident	79	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-65.5	-38.2	-176.5	-60	177.3	0	0	0	111.6	V20 H144 I145 L151 Q152 I162 F182 M188	V20-L148 HydrophobicContact CG1-CD2 4.18Å; V20-L148 HydrophobicContact CG2-CD2 4.41Å; H144-L148 WeakPolarHBondContact NE2-CD1 3.47Å; H144-L148 WeakPolarHBondContact O-CG 3.5Å; H144-L148 PolarHBondContact O-N 3.5Å; I145-L148 PolarHBondContact O-N 3.06Å; I145-L148 VanDerWaalsContact O-N 3.15Å; L148-L151 PolarHBondContact O-N 3.42Å; L148-Q152 WeakPolarHBondContact O-CB 3.39Å; L148-Q152 VanDerWaalsContact O-CG 3.26Å; L148-Q152 WeakPolarHBondContact O-CG 3.34Å; L148-Q152 PolarHBondContact O-N 3.2Å; L148-I162 HydrophobicContact CD1-CD1 4.43Å; L148-I162 HydrophobicContact CD2-CD1 3.97Å; L148-F182 HydrophobicContact CD1-CD1 4.5Å; L148-F182 HydrophobicContact CD1-CE1 3.42Å; L148-F182 VanDerWaalsContact CD1-CE1 3.42Å; L148-F182 HydrophobicContact CD1-CZ 3.98Å; L148-M188 HydrophobicContact CB-CE 4.21Å; L148-M188 HydrophobicContact CD2-CE 3.56Å; L148-M188 HydrophobicContact CG-CE 4.35Å
149	E	84.5	Confident	79.2	Confident	89 Å²	89	52.8 Å²	52.8	42%	0.416	29%	0.289	S	S	.	.	H	α-helix	trans	-61.9	-42.2	173.7	-74.3	-174.6	-176.8	0	0	112.4	I145 T146 V147 K153	I145-E149 HydrophobicContact CG2-CG 4.18Å; I145-E149 WeakPolarHBondContact O-CG 3.34Å; I145-E149 PolarHBondContact O-N 2.94Å; T146-E149 PolarHBondContact O-N 3.41Å; V147-E149 VanDerWaalsContact C-N 3.32Å; V147-E149 PolarHBondContact O-N 3.03Å; E149-K153 WeakPolarHBondContact O-CD 3.32Å; E149-K153 VanDerWaalsContact O-CG 3.26Å; E149-K153 WeakPolarHBondContact O-CG 3.29Å; E149-K153 PolarHBondContact O-N 3.45Å; E149-K153 IonicContact OE2-NZ 2.75Å
150	H	84.4	Confident	79.7	Confident	48 Å²	48	52.9 Å²	52.9	22%	0.222	29%	0.286	C	S	.	.	H	α-helix	trans	-66.5	-39.5	176.2	-85.7	-69.9	0	0	0	112.2	L121 T146 V147 K153 S154	L121-H150 HydrophobicContact CD1-CB 3.53Å; T146-H150 PolarHBondContact O-CD2 2.82Å; T146-H150 PolarHBondContact O-N 3.39Å; V147-H150 PolarHBondContact O-N 3.35Å; H150-K153 PolarHBondContact O-N 3.07Å; H150-S154 WeakPolarHBondContact O-CB 3.14Å; H150-S154 PolarHBondContact O-N 3.34Å; H150-S154 PolarHBondContact O-OG 3.16Å
151	L	85.5	Confident	80.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-51.4	174.8	-68.5	176	0	0	0	110.1	I12 V18 V20 L121 I134 V147 L148 K153 S154 T155 V160	I12-L151 HydrophobicContact CD1-CD2 3.48Å; I12-L151 VanDerWaalsContact CD1-CD2 3.48Å; V18-L151 HydrophobicContact CG1-CD1 4.26Å; V18-L151 HydrophobicContact CG1-CD2 4.03Å; V20-L151 HydrophobicContact CG2-CD1 3.39Å; L121-L151 HydrophobicContact CD2-CD2 4.14Å; I134-L151 HydrophobicContact CD1-CD1 4.13Å; I134-L151 HydrophobicContact CD1-CD2 4.11Å; V147-L151 HydrophobicContact CG1-CD1 3.87Å; V147-L151 HydrophobicContact CG1-CG 4.34Å; V147-L151 VanDerWaalsContact O-CG 3.28Å; V147-L151 WeakPolarHBondContact O-CG 3.24Å; V147-L151 PolarHBondContact O-N 2.72Å; L148-L151 PolarHBondContact O-N 3.42Å; L151-K153 PolarHBondContact O-N 3.42Å; L151-S154 CarbonylContact O-C 3.5Å; L151-S154 WeakPolarHBondContact O-CA 3.4Å; L151-S154 PolarHBondContact O-N 2.9Å; L151-T155 WeakPolarHBondContact O-CG2 3.19Å; L151-T155 PolarHBondContact O-N 3.05Å; L151-T155 VanDerWaalsContact O-N 3.15Å; L151-V160 HydrophobicContact CB-CG1 4.43Å; L151-V160 HydrophobicContact CB-CG2 4.32Å; L151-V160 HydrophobicContact CD1-CG1 3.96Å
152	Q	80.6	Confident	81.6	Confident	80 Å²	80	48 Å²	48	37%	0.374	26%	0.255	S	S	.	.	H	α-helix	trans	-57.9	-30.6	177.9	-75.4	-178.5	-20.6	0	0	114.1	L148 S154 T155 T186 M188	L148-Q152 WeakPolarHBondContact O-CB 3.39Å; L148-Q152 VanDerWaalsContact O-CG 3.26Å; L148-Q152 WeakPolarHBondContact O-CG 3.34Å; L148-Q152 PolarHBondContact O-N 3.2Å; Q152-S154 VanDerWaalsContact C-N 3.32Å; Q152-T155 PolarHBondContact O-OG1 2.88Å; Q152-T186 PolarHBondContact NE2-O 2.83Å; Q152-M188 HydrophobicContact CG-CE 4.41Å; Q152-M188 HydrophobicContact CG-SD 3.69Å; Q152-M188 PolarHBondContact NE2-SD 3.22Å
153	K	78.7	Confident	82.7	Confident	152 Å²	152	42 Å²	42	66%	0.661	22%	0.223	S	C	*	.	H	α-helix	trans	-75.4	-22.4	174.6	-72.2	166.3	-171.5	163.5	0	113	E149 H150 L151	E149-K153 WeakPolarHBondContact O-CD 3.32Å; E149-K153 VanDerWaalsContact O-CG 3.26Å; E149-K153 WeakPolarHBondContact O-CG 3.29Å; E149-K153 PolarHBondContact O-N 3.45Å; E149-K153 IonicContact OE2-NZ 2.75Å; H150-K153 PolarHBondContact O-N 3.07Å; L151-K153 PolarHBondContact O-N 3.42Å
154	S	71.2	Confident	83.6	Confident	26 Å²	26	40.3 Å²	40.3	18%	0.182	22%	0.215	C	C	.	.	H	α-helix	trans	-102	-3.3	-174.2	-53.1	0	0	0	0	113.4	H150 L151 Q152 S156	H150-S154 WeakPolarHBondContact O-CB 3.14Å; H150-S154 PolarHBondContact O-N 3.34Å; H150-S154 PolarHBondContact O-OG 3.16Å; L151-S154 CarbonylContact O-C 3.5Å; L151-S154 WeakPolarHBondContact O-CA 3.4Å; L151-S154 PolarHBondContact O-N 2.9Å; Q152-S154 VanDerWaalsContact C-N 3.32Å; S154-S156 PolarHBondContact O-N 3.43Å
155	T	62.6	Low	84.5	Confident	55 Å²	55	40.3 Å²	40.3	34%	0.337	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	12.8	-164.7	47.3	0	0	0	0	116.7	L151 Q152 D157 V160	L151-T155 WeakPolarHBondContact O-CG2 3.19Å; L151-T155 PolarHBondContact O-N 3.05Å; L151-T155 VanDerWaalsContact O-N 3.15Å; Q152-T155 PolarHBondContact O-OG1 2.88Å; T155-D157 PolarHBondContact O-N 2.77Å; T155-V160 HydrophobicContact CG2-CB 4.3Å; T155-V160 HydrophobicContact CG2-CG2 3.46Å; T155-V160 VanDerWaalsContact CG2-CG2 3.46Å
156	S	63.6	Low	85.1	Confident	105 Å²	105	38 Å²	38	73%	0.734	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.1	176.8	51.9	0	0	0	0	112.1	S154	S154-S156 PolarHBondContact O-N 3.43Å
157	D	76.6	Confident	85.5	Confident	137 Å²	137	36.8 Å²	36.8	73%	0.733	20%	0.196	S	C	*	.	S	Bend	trans	-130.9	0.3	-173.5	-52.5	-70.9	0	0	0	114.5	T155	T155-D157 PolarHBondContact O-N 2.77Å
158	V	84.3	Confident	85.7	Confident	9 Å²	9	36.9 Å²	36.9	6%	0.055	20%	0.196	C	C	.	.			trans	-113.9	120.4	-174.5	-177	0	0	0	0	110.3	I12 V18 V160	I12-V158 WeakPolarHBondContact O-CG2 3.26Å; V18-V158 HydrophobicContact CB-CG1 4.21Å; V18-V158 HydrophobicContact CG2-CG1 3.46Å; V18-V158 VanDerWaalsContact CG2-CG1 3.46Å; V158-V160 HydrophobicContact CG1-CG2 4.21Å; V158-V160 PolarHBondContact O-N 2.81Å
159	D	90.6	Very high	85.8	Confident	46 Å²	46	39.6 Å²	39.6	25%	0.246	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	112.5	174.8	177.7	38.7	0	0	0	109.9	K16 H17 V18 K189	K16-D159 PolarHBondContact O-N 2.88Å; H17-D159 CarbonylContact C-O 3.6Å; H17-D159 WeakPolarHBondContact CA-O 3.15Å; H17-D159 IonicContact CE1-OD2 3.17Å; H17-D159 PolarHBondContact CE1-OD2 3.03Å; H17-D159 IonicContact ND1-OD2 3.93Å; H17-D159 PolarHBondContact ND1-OD2 3.28Å; V18-D159 PolarHBondContact N-O 3.49Å; D159-K189 IonicContact OD1-NZ 3.49Å; D159-K189 PolarHBondContact OD1-NZ 3.43Å; D159-K189 IonicContact OD2-NZ 2.92Å; D159-K189 PolarHBondContact OD2-NZ 3.37Å
160	V	92.4	Very high	85.8	Confident	16 Å²	16	45.1 Å²	45.1	10%	0.097	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126	-178.5	-178.1	0	0	0	0	109.8	V18 V20 L151 T155 V158 M188	V18-V160 HydrophobicContact CB-CG2 4.18Å; V18-V160 WeakPolarHBondContact O-CA 3.47Å; V20-V160 HydrophobicContact CG2-CG1 4.08Å; L151-V160 HydrophobicContact CB-CG1 4.43Å; L151-V160 HydrophobicContact CB-CG2 4.32Å; L151-V160 HydrophobicContact CD1-CG1 3.96Å; T155-V160 HydrophobicContact CG2-CB 4.3Å; T155-V160 HydrophobicContact CG2-CG2 3.46Å; T155-V160 VanDerWaalsContact CG2-CG2 3.46Å; V158-V160 HydrophobicContact CG1-CG2 4.21Å; V158-V160 PolarHBondContact O-N 2.81Å; V160-M188 HydrophobicContact CG1-CE 3.92Å
161	G	93.8	Very high	85.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	137.8	178.4	0	0	0	0	0	112.6	V18 L19 V20 K189 I191	V18-G161 PolarHBondContact O-N 3.4Å; L19-G161 CarbonylContact C-O 3.45Å; L19-G161 WeakPolarHBondContact CA-O 3.42Å; V20-G161 PolarHBondContact N-O 3.43Å; G161-K189 CarbonylContact C-O 3.5Å; G161-K189 WeakPolarHBondContact CA-O 3.49Å; G161-I191 VanDerWaalsContact CA-CG1 3.49Å
162	I	95.1	Very high	85.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129	177	-58.1	-173.8	0	0	0	110.7	V20 T22 L148 I164 C183 M188 K189 I190 I191	V20-I162 HydrophobicContact CB-CG1 4.36Å; V20-I162 CarbonylContact O-C 3.42Å; V20-I162 WeakPolarHBondContact O-CA 3.35Å; T22-I162 HydrophobicContact CG2-CG2 3.68Å; L148-I162 HydrophobicContact CD1-CD1 4.43Å; L148-I162 HydrophobicContact CD2-CD1 3.97Å; I162-I164 HydrophobicContact CG2-CG1 3.9Å; I162-C183 HydrophobicContact CD1-CB 4.34Å; I162-C183 VanDerWaalsContact CD1-SG 3.53Å; I162-M188 HydrophobicContact CD1-CB 3.37Å; I162-M188 HydrophobicContact CD1-CE 4.13Å; I162-M188 HydrophobicContact CD1-CG 3.89Å; I162-M188 HydrophobicContact CG1-CB 4.19Å; I162-M188 HydrophobicContact CG1-CE 4.42Å; I162-K189 PolarHBondContact N-O 3.32Å; I162-I190 CarbonylContact O-C 3.56Å; I162-I191 PolarHBondContact O-N 3.42Å
163	I	97.4	Very high	86.4	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.3	171.3	-64.3	171.3	0	0	0	107.7	L19 V20 V21 T22 L37 I191 I194 L229 I265	L19-I163 HydrophobicContact CB-CD1 4.28Å; L19-I163 HydrophobicContact CD1-CD1 4.45Å; V20-I163 PolarHBondContact O-N 2.97Å; V21-I163 WeakPolarHBondContact CA-O 3.48Å; V21-I163 HydrophobicContact CG2-CB 4.49Å; T22-I163 PolarHBondContact N-O 3.48Å; L37-I163 HydrophobicContact CD2-CD1 3.59Å; I163-I191 HydrophobicContact CG1-CB 4.01Å; I163-I191 HydrophobicContact CG1-CG2 4.2Å; I163-I194 HydrophobicContact CG2-CD1 3.28Å; I163-I194 HydrophobicContact CG2-CG1 4Å; I163-L229 HydrophobicContact CG1-CD1 4.4Å; I163-L229 HydrophobicContact CG2-CD1 4.18Å; I163-I265 HydrophobicContact CD1-CD1 3.84Å; I163-I265 HydrophobicContact CD1-CG1 4.37Å; I163-I265 HydrophobicContact CD1-CG2 4.38Å
164	I	96.6	Very high	86.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	133	-179.1	-52	173.8	0	0	0	108.7	T22 I162 V176 E179 I180 I190 G192 L193 I194	T22-I164 HydrophobicContact CG2-CB 4.33Å; T22-I164 HydrophobicContact CG2-CG1 3.8Å; T22-I164 HydrophobicContact CG2-CG2 4.41Å; T22-I164 CarbonylContact O-C 3.44Å; I162-I164 HydrophobicContact CG2-CG1 3.9Å; I164-V176 HydrophobicContact CG2-CG1 3.92Å; I164-V176 HydrophobicContact CG2-CG2 4.2Å; I164-E179 HydrophobicContact CD1-CG 4.13Å; I164-E179 HydrophobicContact CG1-CG 4.41Å; I164-E179 HydrophobicContact CG2-CG 4.28Å; I164-I180 HydrophobicContact CD1-CG1 3.56Å; I164-I190 HydrophobicContact CD1-CD1 4.4Å; I164-I190 HydrophobicContact CD1-CG2 4.23Å; I164-G192 PolarHBondContact N-O 2.76Å; I164-L193 HydrophobicContact CB-CD1 3.71Å; I164-L193 HydrophobicContact CG2-CD1 3.7Å; I164-L193 CarbonylContact O-C 3.41Å; I164-L193 WeakPolarHBondContact O-CA 3.43Å; I164-L193 WeakPolarHBondContact O-CD1 3.36Å; I164-I194 PolarHBondContact O-N 3.49Å
165	V	96.8	Very high	87.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.2	178.4	-174.3	0	0	0	0	109.7	V21 T22 S23 V28 V33 I194 N196	V21-V165 HydrophobicContact CG1-CG2 3.68Å; T22-V165 PolarHBondContact O-N 2.87Å; S23-V165 VanDerWaalsContact CB-O 3.27Å; S23-V165 WeakPolarHBondContact CB-O 3.49Å; V28-V165 HydrophobicContact CG2-CB 4.33Å; V28-V165 HydrophobicContact CG2-CG1 4.03Å; V33-V165 HydrophobicContact CB-CG2 4.2Å; V33-V165 HydrophobicContact CG1-CG2 3.95Å; V33-V165 HydrophobicContact CG2-CG1 4.16Å; V165-I194 HydrophobicContact CG2-CD1 4.4Å; V165-N196 HydrophobicContact CG1-CB 3.9Å
166	S	95.6	Very high	89.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	165.1	175	-165.1	0	0	0	0	111.6	S172 I194 N196	S166-S172 PolarHBondContact OG-OG 2.88Å; S166-I194 PolarHBondContact N-O 2.6Å; S166-N196 PolarHBondContact O-N 2.77Å
167	T	93.6	Very high	90.8	Very high	5 Å²	5	35 Å²	35	3%	0.031	18%	0.181	C	C	.	.			trans	-100.7	163.4	157.9	58.4	0	0	0	0	110.2	V28 Q169 S172 M197	V28-T167 HydrophobicContact CB-CG2 3.9Å; V28-T167 HydrophobicContact CG1-CG2 4.03Å; T167-Q169 PolarHBondContact O-N 3.25Å; T167-S172 PolarHBondContact N-OG 3.47Å; T167-S172 WeakPolarHBondContact OG1-CB 3.49Å; T167-S172 PolarHBondContact OG1-OG 3.45Å; T167-M197 HydrophobicContact CG2-CB 4.19Å; T167-M197 HydrophobicContact CG2-CG 4.28Å; T167-M197 HydrophobicContact CG2-SD 3.77Å
168	P	90	Very high	91.5	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.013	18%	0.176	C	C	.	.	S	Bend	trans	-66.3	-14.5	178.6	-20.5	30.1	0	0	0	114.5	E195 N196 F212 S213	P168-E195 HydrophobicContact CB-CG 4.4Å; P168-E195 HydrophobicContact CG-CG 3.79Å; P168-N196 WeakPolarHBondContact CD-O 3.44Å; P168-F212 HydrophobicContact CB-CB 4.32Å; P168-F212 HydrophobicContact CG-CB 4.35Å; P168-S213 VanDerWaalsContact CB-C 3.43Å; P168-S213 WeakPolarHBondContact CB-O 3.15Å; P168-S213 VanDerWaalsContact CG-O 3.27Å; P168-S213 WeakPolarHBondContact CG-O 3.18Å
169	Q	87.7	Confident	91.8	Very high	61 Å²	61	36 Å²	36	29%	0.285	17%	0.173	S	C	.	.	S	Bend	trans	-64.8	135.5	-176.3	-63	177.6	-2	0	0	111.4	T167 V171 S172 L173 F212	T167-Q169 PolarHBondContact O-N 3.25Å; Q169-V171 VanDerWaalsContact C-N 3.26Å; Q169-V171 PolarHBondContact O-N 2.6Å; Q169-V171 VanDerWaalsContact O-N 3.12Å; Q169-S172 WeakPolarHBondContact O-CA 3.28Å; Q169-S172 WeakPolarHBondContact O-CB 3.3Å; Q169-S172 PolarHBondContact O-N 3.42Å; Q169-L173 PolarHBondContact O-N 3.12Å; Q169-F212 HydrophobicContact CG-CB 4.18Å; Q169-F212 HydrophobicContact CG-CD1 3.93Å; Q169-F212 HydrophobicContact CG-CD2 4.45Å; Q169-F212 HydrophobicContact CG-CE1 4.47Å; Q169-F212 HydrophobicContact CG-CG 3.93Å; Q169-F212 VanDerWaalsContact NE2-CZ 3.3Å
170	R	85	Confident	92	Very high	206 Å²	206	33.8 Å²	33.8	78%	0.777	16%	0.162	S	C	*	.	H	α-helix	trans	-53.4	-38.3	-177.8	-169.5	171.9	-177.5	150.3	1	114.4	S172 L173 C174	R170-S172 VanDerWaalsContact C-N 3.31Å; R170-S172 PolarHBondContact O-N 3.23Å; R170-L173 WeakPolarHBondContact O-CB 3.36Å; R170-L173 PolarHBondContact O-N 3.22Å; R170-L173 VanDerWaalsContact O-N 3.16Å; R170-C174 PolarHBondContact O-N 3.04Å
171	V	84.9	Confident	92	Very high	99 Å²	99	34.3 Å²	34.3	60%	0.6	17%	0.171	S	C	*	.	H	α-helix	trans	-60	-43.1	177.6	-177.9	0	0	0	0	110.9	Q169 L173 C174	Q169-V171 VanDerWaalsContact C-N 3.26Å; Q169-V171 PolarHBondContact O-N 2.6Å; Q169-V171 VanDerWaalsContact O-N 3.12Å; V171-L173 VanDerWaalsContact C-N 3.3Å; V171-L173 PolarHBondContact O-N 3.49Å; V171-C174 PolarHBondContact O-N 2.93Å
172	S	86.9	Confident	91.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.7	-38.7	176.6	-162	0	0	0	0	112.3	K25 S166 T167 Q169 R170 D175 V176	K25-S172 WeakPolarHBondContact CE-OG 3.42Å; S166-S172 PolarHBondContact OG-OG 2.88Å; T167-S172 PolarHBondContact N-OG 3.47Å; T167-S172 WeakPolarHBondContact OG1-CB 3.49Å; T167-S172 PolarHBondContact OG1-OG 3.45Å; Q169-S172 WeakPolarHBondContact O-CA 3.28Å; Q169-S172 WeakPolarHBondContact O-CB 3.3Å; Q169-S172 PolarHBondContact O-N 3.42Å; R170-S172 VanDerWaalsContact C-N 3.31Å; R170-S172 PolarHBondContact O-N 3.23Å; S172-D175 PolarHBondContact O-N 3.49Å; S172-V176 VanDerWaalsContact O-CG2 3.28Å; S172-V176 WeakPolarHBondContact O-CG2 3.32Å; S172-V176 PolarHBondContact O-N 3.35Å; S172-V176 VanDerWaalsContact O-N 3.07Å
173	L	90.5	Very high	91.7	Very high	27 Å²	27	36.1 Å²	36.1	14%	0.141	18%	0.179	C	C	.	.	H	α-helix	trans	-68.5	-34.8	-177.5	-58.6	174.2	0	0	0	112.3	Q169 R170 V171 D175 V176 S177 A217 L220	Q169-L173 PolarHBondContact O-N 3.12Å; R170-L173 WeakPolarHBondContact O-CB 3.36Å; R170-L173 PolarHBondContact O-N 3.22Å; R170-L173 VanDerWaalsContact O-N 3.16Å; V171-L173 VanDerWaalsContact C-N 3.3Å; V171-L173 PolarHBondContact O-N 3.49Å; L173-D175 VanDerWaalsContact C-N 3.33Å; L173-D175 PolarHBondContact O-N 2.84Å; L173-V176 PolarHBondContact O-N 3.29Å; L173-S177 WeakPolarHBondContact O-CB 3.29Å; L173-S177 PolarHBondContact O-N 2.89Å; L173-A217 HydrophobicContact CD2-CB 4.03Å; L173-L220 HydrophobicContact CB-CD2 4.31Å; L173-L220 HydrophobicContact CD2-CD2 4.36Å; L173-L220 WeakPolarHBondContact O-CD2 3.44Å
174	C	90.6	Very high	91.4	Very high	63 Å²	63	40.6 Å²	40.6	43%	0.426	20%	0.201	S	C	.	.	H	α-helix	trans	-61.7	-43.1	175	-69.5	0	0	0	0	111.6	R170 V171 S177 R178	R170-C174 PolarHBondContact O-N 3.04Å; V171-C174 PolarHBondContact O-N 2.93Å; C174-S177 WeakPolarHBondContact O-CB 3.3Å; C174-S177 PolarHBondContact O-N 3.19Å; C174-R178 PolarHBondContact O-N 3.03Å
175	D	91.7	Very high	91	Very high	32 Å²	32	49.4 Å²	49.4	17%	0.171	24%	0.239	C	C	.	.	H	α-helix	trans	-69.5	-40.8	179.5	-57.5	-39.1	0	0	0	111.4	G24 S172 L173 S177 R178 E179	G24-D175 WeakPolarHBondContact O-CB 3.26Å; S172-D175 PolarHBondContact O-N 3.49Å; L173-D175 VanDerWaalsContact C-N 3.33Å; L173-D175 PolarHBondContact O-N 2.84Å; D175-S177 VanDerWaalsContact C-N 3.32Å; D175-S177 PolarHBondContact O-N 3Å; D175-R178 WeakPolarHBondContact O-CB 3.49Å; D175-R178 PolarHBondContact O-N 2.99Å; D175-R178 VanDerWaalsContact O-N 3.16Å; D175-R178 IonicContact OD1-CZ 3.95Å; D175-R178 IonicContact OD1-NH1 3.19Å; D175-R178 PolarHBondContact OD1-NH1 2.85Å; D175-E179 PolarHBondContact O-N 3.35Å
176	V	93.1	Very high	90.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.8	-35.6	175	167.2	0	0	0	0	112.3	I164 S172 L173 R178 E179 I180 L193 L220	I164-V176 HydrophobicContact CG2-CG1 3.92Å; I164-V176 HydrophobicContact CG2-CG2 4.2Å; S172-V176 VanDerWaalsContact O-CG2 3.28Å; S172-V176 WeakPolarHBondContact O-CG2 3.32Å; S172-V176 PolarHBondContact O-N 3.35Å; S172-V176 VanDerWaalsContact O-N 3.07Å; L173-V176 PolarHBondContact O-N 3.29Å; V176-R178 VanDerWaalsContact C-N 3.29Å; V176-R178 PolarHBondContact O-N 2.87Å; V176-E179 WeakPolarHBondContact O-CB 3.22Å; V176-E179 PolarHBondContact O-N 3.49Å; V176-I180 HydrophobicContact CG1-CD1 4Å; V176-I180 HydrophobicContact CG1-CG1 4.45Å; V176-I180 WeakPolarHBondContact O-CG1 3.4Å; V176-I180 PolarHBondContact O-N 3.13Å; V176-L193 HydrophobicContact CG1-CD1 3.55Å; V176-L193 HydrophobicContact CG1-CD2 4.21Å; V176-L220 HydrophobicContact CB-CD2 4.13Å; V176-L220 HydrophobicContact CG1-CD2 3.65Å
177	S	93.5	Very high	90.2	Very high	33 Å²	33	58.4 Å²	58.4	23%	0.231	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-37.9	174.7	-171.3	0	0	0	0	111.8	L173 C174 D175 G181 K224	L173-S177 WeakPolarHBondContact O-CB 3.29Å; L173-S177 PolarHBondContact O-N 2.89Å; C174-S177 WeakPolarHBondContact O-CB 3.3Å; C174-S177 PolarHBondContact O-N 3.19Å; D175-S177 VanDerWaalsContact C-N 3.32Å; D175-S177 PolarHBondContact O-N 3Å; S177-G181 PolarHBondContact O-N 3.31Å; S177-G181 VanDerWaalsContact O-N 3.1Å; S177-K224 WeakPolarHBondContact OG-CE 3.4Å
178	R	91.5	Very high	89.9	Confident	164 Å²	164	59.2 Å²	59.2	62%	0.619	29%	0.292	S	S	*	.	H	α-helix	trans	-68.1	-42.1	173.3	-61.1	-175.9	-159.2	117.8	6	111.5	C174 D175 V176 G181 F182	C174-R178 PolarHBondContact O-N 3.03Å; D175-R178 WeakPolarHBondContact O-CB 3.49Å; D175-R178 PolarHBondContact O-N 2.99Å; D175-R178 VanDerWaalsContact O-N 3.16Å; D175-R178 IonicContact OD1-CZ 3.95Å; D175-R178 IonicContact OD1-NH1 3.19Å; D175-R178 PolarHBondContact OD1-NH1 2.85Å; V176-R178 VanDerWaalsContact C-N 3.29Å; V176-R178 PolarHBondContact O-N 2.87Å; R178-G181 CarbonylContact O-C 3.6Å; R178-G181 PolarHBondContact O-N 3.43Å; R178-F182 PolarHBondContact O-N 3.28Å
179	E	91.8	Very high	90	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-59.2	-46.1	177	-172.2	68.7	179.9	0	0	112.1	T22 T140 H144 I164 D175 V176 G181 F182 C183	T22-E179 WeakPolarHBondContact CB-OE1 3.23Å; T22-E179 HydrophobicContact CG2-CG 3.98Å; T22-E179 WeakPolarHBondContact CG2-OE1 3.35Å; T22-E179 PolarHBondContact OG1-OE1 3.3Å; T140-E179 VanDerWaalsContact CG2-OE2 3.31Å; T140-E179 WeakPolarHBondContact CG2-OE2 3.49Å; H144-E179 IonicContact CE1-OE1 2.8Å; H144-E179 PolarHBondContact CE1-OE1 2.89Å; H144-E179 IonicContact ND1-OE1 2.79Å; H144-E179 IonicContact NE2-OE1 2.88Å; H144-E179 PolarHBondContact NE2-OE1 3.45Å; I164-E179 HydrophobicContact CD1-CG 4.13Å; I164-E179 HydrophobicContact CG1-CG 4.41Å; I164-E179 HydrophobicContact CG2-CG 4.28Å; D175-E179 PolarHBondContact O-N 3.35Å; V176-E179 WeakPolarHBondContact O-CB 3.22Å; V176-E179 PolarHBondContact O-N 3.49Å; E179-G181 VanDerWaalsContact C-N 3.33Å; E179-G181 PolarHBondContact O-N 3.01Å; E179-F182 WeakPolarHBondContact O-CB 3.49Å; E179-F182 PolarHBondContact O-N 2.89Å; E179-C183 PolarHBondContact O-N 3.12Å; E179-C183 PolarHBondContact O-SG 2.92Å
180	I	93.5	Very high	90.4	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-46.9	174.1	-68.7	166.2	0	0	0	110.2	I164 V176 F182 C183 M184 I190 L220 K224 V226	I164-I180 HydrophobicContact CD1-CG1 3.56Å; V176-I180 HydrophobicContact CG1-CD1 4Å; V176-I180 HydrophobicContact CG1-CG1 4.45Å; V176-I180 WeakPolarHBondContact O-CG1 3.4Å; V176-I180 PolarHBondContact O-N 3.13Å; I180-F182 VanDerWaalsContact C-N 3.29Å; I180-F182 PolarHBondContact O-N 3.23Å; I180-C183 PolarHBondContact O-N 3.2Å; I180-M184 HydrophobicContact CG2-CE 3.73Å; I180-M184 HydrophobicContact CG2-CG 4.42Å; I180-M184 HydrophobicContact CG2-SD 4.09Å; I180-M184 VanDerWaalsContact O-CG 3.31Å; I180-M184 WeakPolarHBondContact O-CG 3.18Å; I180-M184 PolarHBondContact O-N 3.42Å; I180-I190 HydrophobicContact CG2-CD1 4.07Å; I180-L220 HydrophobicContact CD1-CD2 4.3Å; I180-L220 HydrophobicContact CD1-CG 4.32Å; I180-K224 HydrophobicContact CD1-CB 4.3Å; I180-K224 HydrophobicContact CD1-CG 4.12Å; I180-K224 HydrophobicContact CG2-CB 3.94Å; I180-K224 HydrophobicContact CG2-CG 4.13Å; I180-V226 HydrophobicContact CG2-CG2 3.84Å
181	G	92.8	Very high	90.9	Very high	28 Å²	28	52 Å²	52	29%	0.289	27%	0.267	S	S	.	.	H	α-helix	trans	-61.4	-36	178	0	0	0	0	0	113.3	S177 R178 E179 K185	S177-G181 PolarHBondContact O-N 3.31Å; S177-G181 VanDerWaalsContact O-N 3.1Å; R178-G181 CarbonylContact O-C 3.6Å; R178-G181 PolarHBondContact O-N 3.43Å; E179-G181 VanDerWaalsContact C-N 3.33Å; E179-G181 PolarHBondContact O-N 3.01Å; G181-K185 VanDerWaalsContact O-CG 3.3Å; G181-K185 WeakPolarHBondContact O-CG 3.48Å; G181-K185 PolarHBondContact O-N 2.97Å; G181-K185 VanDerWaalsContact O-N 3.12Å
182	F	90.6	Very high	91.5	Very high	38 Å²	38	47.3 Å²	47.3	17%	0.167	24%	0.238	C	C	.	.	H	α-helix	trans	-66.2	-51.6	174.1	168.4	-99.9	0	0	0	111.2	T140 H144 I145 L148 R178 E179 I180 M184 K185 T186	T140-F182 HydrophobicContact CG2-CB 3.89Å; T140-F182 HydrophobicContact CG2-CD1 4.19Å; T140-F182 HydrophobicContact CG2-CD2 4.37Å; T140-F182 HydrophobicContact CG2-CG 3.9Å; H144-F182 AromaticContact CD2-CE1 3.73Å; H144-F182 AromaticContact NE2-CE1 3.51Å; I145-F182 HydrophobicContact CD1-CE2 4.47Å; I145-F182 HydrophobicContact CG1-CE2 4.02Å; I145-F182 HydrophobicContact CG1-CZ 3.79Å; L148-F182 HydrophobicContact CD1-CD1 4.5Å; L148-F182 HydrophobicContact CD1-CE1 3.42Å; L148-F182 VanDerWaalsContact CD1-CE1 3.42Å; L148-F182 HydrophobicContact CD1-CZ 3.98Å; R178-F182 PolarHBondContact O-N 3.28Å; E179-F182 WeakPolarHBondContact O-CB 3.49Å; E179-F182 PolarHBondContact O-N 2.89Å; I180-F182 VanDerWaalsContact C-N 3.29Å; I180-F182 PolarHBondContact O-N 3.23Å; F182-M184 VanDerWaalsContact C-N 3.27Å; F182-M184 PolarHBondContact O-N 3.42Å; F182-K185 PolarHBondContact O-N 3.3Å; F182-T186 HydrophobicContact CD2-CG2 4.18Å; F182-T186 HydrophobicContact CE2-CG2 3.73Å; F182-T186 HydrophobicContact CZ-CG2 3.91Å; F182-T186 PolarHBondContact O-N 2.77Å; F182-T186 PolarHBondContact O-OG1 3.01Å
183	C	91.2	Very high	92	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-55.7	-41	177.3	-65.9	0	0	0	0	112.4	I162 E179 I180 T186 N187 M188 I190	I162-C183 HydrophobicContact CD1-CB 4.34Å; I162-C183 VanDerWaalsContact CD1-SG 3.53Å; E179-C183 PolarHBondContact O-N 3.12Å; E179-C183 PolarHBondContact O-SG 2.92Å; I180-C183 PolarHBondContact O-N 3.2Å; C183-T186 PolarHBondContact O-N 2.9Å; C183-T186 PolarHBondContact O-OG1 3.11Å; C183-N187 PolarHBondContact O-N 3.2Å; C183-M188 HydrophobicContact CB-CB 4.35Å; C183-M188 PolarHBondContact O-N 3.02Å; C183-I190 HydrophobicContact CB-CD1 3.74Å; C183-I190 HydrophobicContact CB-CG1 3.78Å
184	M	90.8	Very high	92.3	Very high	94 Å²	94	46 Å²	46	46%	0.463	23%	0.231	S	C	.	.	H	α-helix	trans	-64.7	-42.6	176	-72.4	-179.5	171.9	0	0	112.3	I180 F182 T186 N187 K224 V226	I180-M184 HydrophobicContact CG2-CE 3.73Å; I180-M184 HydrophobicContact CG2-CG 4.42Å; I180-M184 HydrophobicContact CG2-SD 4.09Å; I180-M184 VanDerWaalsContact O-CG 3.31Å; I180-M184 WeakPolarHBondContact O-CG 3.18Å; I180-M184 PolarHBondContact O-N 3.42Å; F182-M184 VanDerWaalsContact C-N 3.27Å; F182-M184 PolarHBondContact O-N 3.42Å; M184-T186 VanDerWaalsContact C-N 3.28Å; M184-T186 PolarHBondContact O-N 3.16Å; M184-N187 PolarHBondContact O-N 3.27Å; M184-K224 WeakPolarHBondContact CE-O 3.48Å; M184-V226 HydrophobicContact CE-CG2 3.97Å
185	K	90.1	Very high	92.6	Very high	185 Å²	185	43 Å²	43	80%	0.804	21%	0.211	S	C	*	.	H	α-helix	trans	-66.3	-30.4	177.9	-76.4	176.2	-179.5	-176.9	0	112.9	G181 F182	G181-K185 VanDerWaalsContact O-CG 3.3Å; G181-K185 WeakPolarHBondContact O-CG 3.48Å; G181-K185 PolarHBondContact O-N 2.97Å; G181-K185 VanDerWaalsContact O-N 3.12Å; F182-K185 PolarHBondContact O-N 3.3Å
186	T	86.6	Confident	92.8	Very high	39 Å²	39	42.4 Å²	42.4	24%	0.239	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	9	179.1	60.2	0	0	0	0	113.1	Q152 F182 C183 M184 M188	Q152-T186 PolarHBondContact NE2-O 2.83Å; F182-T186 HydrophobicContact CD2-CG2 4.18Å; F182-T186 HydrophobicContact CE2-CG2 3.73Å; F182-T186 HydrophobicContact CZ-CG2 3.91Å; F182-T186 PolarHBondContact O-N 2.77Å; F182-T186 PolarHBondContact O-OG1 3.01Å; C183-T186 PolarHBondContact O-N 2.9Å; C183-T186 PolarHBondContact O-OG1 3.11Å; M184-T186 VanDerWaalsContact C-N 3.28Å; M184-T186 PolarHBondContact O-N 3.16Å; T186-M188 PolarHBondContact O-N 2.85Å; T186-M188 WeakPolarHBondContact OG1-CG 3.23Å
187	N	87.6	Confident	92.7	Very high	150 Å²	150	44.1 Å²	44.1	80%	0.802	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	33.3	-178.3	-63.8	-43.3	0	0	0	114.3	C183 M184	C183-N187 PolarHBondContact O-N 3.2Å; M184-N187 PolarHBondContact O-N 3.27Å
188	M	88.3	Confident	92.6	Very high	21 Å²	21	42.8 Å²	42.8	10%	0.103	21%	0.207	C	C	.	.			trans	-84	134.7	176.5	-66.1	-61.7	-85	0	0	111.2	L148 Q152 V160 I162 C183 T186 I190	L148-M188 HydrophobicContact CB-CE 4.21Å; L148-M188 HydrophobicContact CD2-CE 3.56Å; L148-M188 HydrophobicContact CG-CE 4.35Å; Q152-M188 HydrophobicContact CG-CE 4.41Å; Q152-M188 HydrophobicContact CG-SD 3.69Å; Q152-M188 PolarHBondContact NE2-SD 3.22Å; V160-M188 HydrophobicContact CG1-CE 3.92Å; I162-M188 HydrophobicContact CD1-CB 3.37Å; I162-M188 HydrophobicContact CD1-CE 4.13Å; I162-M188 HydrophobicContact CD1-CG 3.89Å; I162-M188 HydrophobicContact CG1-CB 4.19Å; I162-M188 HydrophobicContact CG1-CE 4.42Å; C183-M188 HydrophobicContact CB-CB 4.35Å; C183-M188 PolarHBondContact O-N 3.02Å; T186-M188 PolarHBondContact O-N 2.85Å; T186-M188 WeakPolarHBondContact OG1-CG 3.23Å; M188-I190 PolarHBondContact O-N 3.2Å
189	K	92.2	Very high	92.4	Very high	88 Å²	88	35 Å²	35	38%	0.383	18%	0.178	S	C	.	.			trans	-70.9	107.3	178.3	178.9	-177.4	173	-174.1	0	110	D159 G161 I162 I191	D159-K189 IonicContact OD1-NZ 3.49Å; D159-K189 PolarHBondContact OD1-NZ 3.43Å; D159-K189 IonicContact OD2-NZ 2.92Å; D159-K189 PolarHBondContact OD2-NZ 3.37Å; G161-K189 CarbonylContact C-O 3.5Å; G161-K189 WeakPolarHBondContact CA-O 3.49Å; I162-K189 PolarHBondContact N-O 3.32Å; K189-I191 HydrophobicContact CD-CD1 4.3Å; K189-I191 HydrophobicContact CG-CD1 4.3Å; K189-I191 PolarHBondContact O-N 3.14Å
190	I	95.1	Very high	92.1	Very high	30 Å²	30	38.7 Å²	38.7	15%	0.154	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	114.5	172.3	-54.8	168.9	0	0	0	108.8	I162 I164 I180 C183 M188 V226	I162-I190 CarbonylContact O-C 3.56Å; I164-I190 HydrophobicContact CD1-CD1 4.4Å; I164-I190 HydrophobicContact CD1-CG2 4.23Å; I180-I190 HydrophobicContact CG2-CD1 4.07Å; C183-I190 HydrophobicContact CB-CD1 3.74Å; C183-I190 HydrophobicContact CB-CG1 3.78Å; M188-I190 PolarHBondContact O-N 3.2Å; I190-V226 HydrophobicContact CB-CG1 4.32Å; I190-V226 HydrophobicContact CD1-CG2 4.08Å; I190-V226 HydrophobicContact CG2-CG1 3.51Å
191	I	96	Very high	91.3	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	-43.3	173.7	-61	-57.1	0	0	0	110	G161 I162 I163 K189 R227 L229 I265 V268 L269	G161-I191 VanDerWaalsContact CA-CG1 3.49Å; I162-I191 PolarHBondContact O-N 3.42Å; I163-I191 HydrophobicContact CG1-CB 4.01Å; I163-I191 HydrophobicContact CG1-CG2 4.2Å; K189-I191 HydrophobicContact CD-CD1 4.3Å; K189-I191 HydrophobicContact CG-CD1 4.3Å; K189-I191 PolarHBondContact O-N 3.14Å; I191-R227 PolarHBondContact O-NH1 3.04Å; I191-R227 VanDerWaalsContact O-NH1 3.14Å; I191-L229 HydrophobicContact CG2-CD1 4.36Å; I191-L229 HydrophobicContact CG2-CD2 4.38Å; I191-I265 HydrophobicContact CG2-CG2 4.39Å; I191-V268 HydrophobicContact CD1-CG1 4.2Å; I191-V268 HydrophobicContact CG2-CB 4.45Å; I191-V268 HydrophobicContact CG2-CG1 3.95Å; I191-L269 HydrophobicContact CD1-CD2 3.61Å; I191-L269 HydrophobicContact CG1-CD2 4.39Å
192	G	97.1	Very high	90.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.1	-175.1	168.1	0	0	0	0	0	115	I164 R227	I164-G192 PolarHBondContact N-O 2.76Å; G192-R227 CarbonylContact C-O 3.39Å; G192-R227 WeakPolarHBondContact CA-O 3.28Å
193	L	97.3	Very high	89.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.2	-176.1	-175.1	65.3	0	0	0	111.4	I164 V176 A217 A221 R227 F228 L229	I164-L193 HydrophobicContact CB-CD1 3.71Å; I164-L193 HydrophobicContact CG2-CD1 3.7Å; I164-L193 CarbonylContact O-C 3.41Å; I164-L193 WeakPolarHBondContact O-CA 3.43Å; I164-L193 WeakPolarHBondContact O-CD1 3.36Å; V176-L193 HydrophobicContact CG1-CD1 3.55Å; V176-L193 HydrophobicContact CG1-CD2 4.21Å; L193-A217 HydrophobicContact CD2-CB 3.75Å; L193-A217 VanDerWaalsContact CD2-O 3.23Å; L193-A217 WeakPolarHBondContact CD2-O 3.43Å; L193-A217 HydrophobicContact CG-CB 4.14Å; L193-A221 HydrophobicContact CB-CB 4.45Å; L193-A221 HydrophobicContact CD2-CB 4.15Å; L193-R227 PolarHBondContact N-O 3.24Å; L193-F228 WeakPolarHBondContact O-CD2 3.45Å; L193-L229 PolarHBondContact O-N 2.84Å
194	I	97.5	Very high	89.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.8	176	-58.3	167.5	0	0	0	109.1	V33 I163 I164 V165 S166 L229 L232 L261	V33-I194 HydrophobicContact CG1-CD1 3.69Å; I163-I194 HydrophobicContact CG2-CD1 3.28Å; I163-I194 HydrophobicContact CG2-CG1 4Å; I164-I194 PolarHBondContact O-N 3.49Å; V165-I194 HydrophobicContact CG2-CD1 4.4Å; S166-I194 PolarHBondContact N-O 2.6Å; I194-L229 HydrophobicContact CD1-CD1 4.35Å; I194-L229 HydrophobicContact CG1-CB 4.06Å; I194-L229 HydrophobicContact CG1-CD1 3.95Å; I194-L232 HydrophobicContact CG2-CD1 3.98Å; I194-L232 HydrophobicContact CG2-CG 4.26Å; I194-L261 HydrophobicContact CD1-CD1 4.49Å; I194-L261 HydrophobicContact CD1-CD2 3.78Å; I194-L261 HydrophobicContact CD1-CG 4.49Å; I194-L261 HydrophobicContact CG1-CD1 4.14Å; I194-L261 HydrophobicContact CG1-CD2 4.18Å; I194-L261 HydrophobicContact CG2-CD2 4.18Å
195	E	96.3	Very high	88.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	95	169.1	-163.6	172.9	64.8	0	0	109.6	P168 S198 G215 G216 A217 F228 G230 R231 L232	P168-E195 HydrophobicContact CB-CG 4.4Å; P168-E195 HydrophobicContact CG-CG 3.79Å; E195-S198 PolarHBondContact OE1-OG 3.44Å; E195-G215 WeakPolarHBondContact OE1-CA 3.15Å; E195-G215 PolarHBondContact OE1-N 3.33Å; E195-G215 WeakPolarHBondContact OE2-CA 3.38Å; E195-G215 PolarHBondContact OE2-N 3.3Å; E195-G216 PolarHBondContact OE2-N 2.68Å; E195-A217 HydrophobicContact CB-CB 3.72Å; E195-A217 HydrophobicContact CG-CB 3.79Å; E195-A217 PolarHBondContact OE2-N 3.16Å; E195-F228 HydrophobicContact CB-CE2 3.95Å; E195-F228 HydrophobicContact CB-CZ 4.02Å; E195-G230 PolarHBondContact N-O 3.07Å; E195-R231 HydrophobicContact CB-CG 4.18Å; E195-R231 CarbonylContact O-C 3.57Å; E195-R231 VanDerWaalsContact O-CA 3.3Å; E195-R231 WeakPolarHBondContact O-CA 3.19Å; E195-R231 IonicContact OE1-CZ 3.76Å; E195-R231 IonicContact OE1-NE 3.78Å; E195-R231 PolarHBondContact OE1-NE 2.86Å; E195-L232 PolarHBondContact O-N 2.9Å
196	N	95.1	Very high	87.8	Confident	18 Å²	18	51.2 Å²	51.2	10%	0.096	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	162.6	174.8	-165.5	23.1	0	0	0	111.3	V28 V33 V165 S166 P168 S198 L232	V28-N196 PolarHBondContact O-ND2 3.35Å; V33-N196 HydrophobicContact CG2-CB 4.42Å; V165-N196 HydrophobicContact CG1-CB 3.9Å; S166-N196 PolarHBondContact O-N 2.77Å; P168-N196 WeakPolarHBondContact CD-O 3.44Å; N196-S198 PolarHBondContact O-N 3.14Å; N196-S198 VanDerWaalsContact O-N 3.17Å; N196-L232 CarbonylContact C-O 3.56Å; N196-L232 WeakPolarHBondContact OD1-CB 3.46Å
197	M	92.3	Very high	87.3	Confident	36 Å²	36	55.8 Å²	55.8	18%	0.177	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	57	27.2	-179.1	-58.2	-179	-177	0	0	113.3	T167 G199 F212 L232 F234	T167-M197 HydrophobicContact CG2-CB 4.19Å; T167-M197 HydrophobicContact CG2-CG 4.28Å; T167-M197 HydrophobicContact CG2-SD 3.77Å; M197-G199 PolarHBondContact O-N 3.34Å; M197-F212 HydrophobicContact CB-CD2 4.29Å; M197-F212 HydrophobicContact CB-CE2 4.12Å; M197-F212 HydrophobicContact SD-CE2 4.37Å; M197-L232 PolarHBondContact N-O 3.39Å; M197-F234 HydrophobicContact CB-CD2 4.09Å; M197-F234 HydrophobicContact CB-CE1 4.14Å; M197-F234 HydrophobicContact CB-CE2 3.47Å; M197-F234 VanDerWaalsContact CB-CE2 3.47Å; M197-F234 HydrophobicContact CB-CZ 3.5Å; M197-F234 HydrophobicContact CE-CE1 4.31Å; M197-F234 HydrophobicContact CG-CD1 4.31Å; M197-F234 HydrophobicContact CG-CE1 3.64Å; M197-F234 HydrophobicContact CG-CE2 3.95Å; M197-F234 HydrophobicContact CG-CZ 3.44Å; M197-F234 VanDerWaalsContact CG-CZ 3.44Å; M197-F234 HydrophobicContact SD-CE1 3.88Å; M197-F234 HydrophobicContact SD-CE2 4.48Å; M197-F234 HydrophobicContact SD-CZ 3.57Å; M197-F234 VanDerWaalsContact SD-CZ 3.57Å
198	S	90.1	Very high	86.8	Confident	6 Å²	6	52.1 Å²	52.1	4%	0.042	28%	0.28	C	S	.	.			trans	-90.6	85.9	-178.6	178	0	0	0	0	110.7	E195 N196 Y214 L232 P233	E195-S198 PolarHBondContact OE1-OG 3.44Å; N196-S198 PolarHBondContact O-N 3.14Å; N196-S198 VanDerWaalsContact O-N 3.17Å; S198-Y214 WeakPolarHBondContact OG-CD2 3.43Å; S198-L232 PolarHBondContact N-O 3.48Å; S198-P233 WeakPolarHBondContact O-CA 3.49Å
199	G	87.7	Confident	86.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.01	30%	0.298	C	S	.	.			trans	94.8	166.9	-177.4	0	0	0	0	0	112.9	M197 T209 P233 F234	M197-G199 PolarHBondContact O-N 3.34Å; G199-T209 CarbonylContact C-O 3.56Å; G199-T209 VanDerWaalsContact CA-O 3.26Å; G199-T209 WeakPolarHBondContact CA-O 3.49Å; G199-P233 CarbonylContact O-C 3.57Å; G199-P233 VanDerWaalsContact O-CA 3.3Å; G199-P233 WeakPolarHBondContact O-CA 3.4Å; G199-P233 WeakPolarHBondContact O-CB 3.46Å; G199-F234 WeakPolarHBondContact O-CD2 3.28Å; G199-F234 PolarHBondContact O-N 2.95Å
200	Y	85.4	Confident	86	Confident	78 Å²	78	54.3 Å²	54.3	31%	0.306	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.3	175.8	172	-100.8	0	0	0	108.1	C202 P203 C208 T209 L211 F234	Y200-C202 PolarHBondContact O-N 3.15Å; Y200-P203 WeakPolarHBondContact OH-CD 2.99Å; Y200-C208 VanDerWaalsContact O-CA 3.29Å; Y200-C208 WeakPolarHBondContact O-CA 3.37Å; Y200-T209 PolarHBondContact N-O 2.94Å; Y200-T209 PolarHBondContact O-N 3.49Å; Y200-L211 HydrophobicContact CG-CD1 4.34Å; Y200-F234 HydrophobicContact CD2-CB 3.79Å
201	K	77.5	Confident	85.2	Confident	121 Å²	121	57.5 Å²	57.5	53%	0.526	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	113.6	176.6	-171.6	177	-179.5	-178.6	0	108.2	F234	K201-F234 PolarHBondContact N-O 3.18Å
202	C	76.7	Confident	84.5	Confident	35 Å²	35	60.9 Å²	60.9	24%	0.236	33%	0.331	C	S	.	.			trans	-60.9	132.1	177.3	-176.8	0	0	0	0	109.9	Y200 N204 C205 Q207	Y200-C202 PolarHBondContact O-N 3.15Å; C202-N204 PolarHBondContact O-N 3Å; C202-N204 PolarHBondContact SG-N 3.03Å; C202-N204 VanDerWaalsContact SG-N 3.39Å; C202-C205 WeakPolarHBondContact CB-SG 3.48Å; C202-C205 PolarHBondContact SG-SG 3.44Å; C202-Q207 PolarHBondContact N-O 2.83Å; C202-Q207 VanDerWaalsContact N-O 3.15Å
203	P	74.8	Confident	83.9	Confident	99 Å²	99	64.6 Å²	64.6	64%	0.643	36%	0.357	S	S	*	.	S	Bend	trans	-70.4	-18.8	175.9	27.1	-34	0	0	0	112.5	Y200	Y200-P203 WeakPolarHBondContact OH-CD 2.99Å
204	N	79.8	Confident	83.4	Confident	155 Å²	155	70.6 Å²	70.6	83%	0.829	38%	0.38	S	S	*	.	S	Bend	trans	-107.3	-7.4	-173.3	-152.1	39	0	0	0	113.9	C202	C202-N204 PolarHBondContact O-N 3Å; C202-N204 PolarHBondContact SG-N 3.03Å; C202-N204 VanDerWaalsContact SG-N 3.39Å
205	C	78.1	Confident	83	Confident	57 Å²	57	71.2 Å²	71.2	39%	0.385	39%	0.387	S	S	.	.	S	Bend	trans	-152.7	167.7	175.8	72.7	0	0	0	0	111.4	C202 Q207	C202-C205 WeakPolarHBondContact CB-SG 3.48Å; C202-C205 PolarHBondContact SG-SG 3.44Å; C205-Q207 PolarHBondContact O-N 3.46Å
206	T	73.1	Confident	82.8	Confident	141 Å²	141	72 Å²	72	87%	0.865	40%	0.395	S	S	*	.	S	Bend	trans	-78.6	0.7	-179.9	52	0	0	0	0	114
207	Q	75.8	Confident	82.8	Confident	135 Å²	135	71.1 Å²	71.1	63%	0.631	39%	0.39	S	S	*	.			trans	-73.3	134.8	-179.7	-66.4	-175.8	-10.3	0	0	111.1	C202 C205	C202-Q207 PolarHBondContact N-O 2.83Å; C202-Q207 VanDerWaalsContact N-O 3.15Å; C205-Q207 PolarHBondContact O-N 3.46Å
208	C	76.3	Confident	82.9	Confident	73 Å²	73	73.1 Å²	73.1	49%	0.493	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	119.6	168.9	-169	0	0	0	0	108.6	Y200	Y200-C208 VanDerWaalsContact O-CA 3.29Å; Y200-C208 WeakPolarHBondContact O-CA 3.37Å
209	T	81.6	Confident	83.2	Confident	76 Å²	76	75.8 Å²	75.8	47%	0.466	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.9	-179.2	-55.1	0	0	0	0	110	G199 Y200 L211	G199-T209 CarbonylContact C-O 3.56Å; G199-T209 VanDerWaalsContact CA-O 3.26Å; G199-T209 WeakPolarHBondContact CA-O 3.49Å; Y200-T209 PolarHBondContact N-O 2.94Å; Y200-T209 PolarHBondContact O-N 3.49Å; T209-L211 PolarHBondContact O-N 2.93Å; T209-L211 VanDerWaalsContact O-N 3.11Å
210	N	81.6	Confident	83.5	Confident	78 Å²	78	76.3 Å²	76.3	42%	0.417	42%	0.424	S	S	.	.			trans	-71.8	103.5	176.2	-67.4	-32.5	0	0	0	110.7	F212 Y214	N210-F212 VanDerWaalsContact C-N 3.34Å; N210-Y214 WeakPolarHBondContact OD1-CD2 3.48Å
211	L	80	Confident	84	Confident	98 Å²	98	72.6 Å²	72.6	51%	0.513	41%	0.41	S	S	.	.	S	Bend	trans	-72.6	-29.5	176.5	-66.2	-177.9	0	0	0	112.6	Y200 T209 F234	Y200-L211 HydrophobicContact CG-CD1 4.34Å; T209-L211 PolarHBondContact O-N 2.93Å; T209-L211 VanDerWaalsContact O-N 3.11Å; L211-F234 HydrophobicContact CD1-CD2 3.73Å; L211-F234 HydrophobicContact CD1-CE2 3.92Å; L211-F234 HydrophobicContact CD1-CG 4.48Å
212	F	80.5	Confident	85	Confident	72 Å²	72	72.3 Å²	72.3	32%	0.316	42%	0.418	S	S	.	.	S	Bend	trans	-112.5	-168.7	171.8	-60.2	-51.7	0	0	0	109.9	P168 Q169 M197 N210 F234	P168-F212 HydrophobicContact CB-CB 4.32Å; P168-F212 HydrophobicContact CG-CB 4.35Å; Q169-F212 HydrophobicContact CG-CB 4.18Å; Q169-F212 HydrophobicContact CG-CD1 3.93Å; Q169-F212 HydrophobicContact CG-CD2 4.45Å; Q169-F212 HydrophobicContact CG-CE1 4.47Å; Q169-F212 HydrophobicContact CG-CG 3.93Å; Q169-F212 VanDerWaalsContact NE2-CZ 3.3Å; M197-F212 HydrophobicContact CB-CD2 4.29Å; M197-F212 HydrophobicContact CB-CE2 4.12Å; M197-F212 HydrophobicContact SD-CE2 4.37Å; N210-F212 VanDerWaalsContact C-N 3.34Å; F212-F234 HydrophobicContact CD2-CE2 4.26Å; F212-F234 AromaticContact CE2-CE2 3.76Å; F212-F234 HydrophobicContact CE2-CE2 3.76Å; F212-F234 AromaticContact CE2-CZ 3.84Å; F212-F234 HydrophobicContact CE2-CZ 3.84Å; F212-F234 HydrophobicContact CZ-CZ 4.46Å
213	S	83.9	Confident	85.9	Confident	77 Å²	77	77 Å²	77	54%	0.538	44%	0.436	S	S	.	.			trans	-55	174.4	161.3	-52.2	0	0	0	0	111.2	P168	P168-S213 VanDerWaalsContact CB-C 3.43Å; P168-S213 WeakPolarHBondContact CB-O 3.15Å; P168-S213 VanDerWaalsContact CG-O 3.27Å; P168-S213 WeakPolarHBondContact CG-O 3.18Å
214	Y	87	Confident	86.9	Confident	127 Å²	127	75 Å²	75	50%	0.498	42%	0.417	S	S	.	.	S	Bend	trans	-137.4	138.1	-178.9	178.2	-92.2	0	0	0	110.4	S198 N210 G216 R231	S198-Y214 WeakPolarHBondContact OG-CD2 3.43Å; N210-Y214 WeakPolarHBondContact OD1-CD2 3.48Å; Y214-G216 VanDerWaalsContact C-N 3.27Å; Y214-G216 PolarHBondContact O-N 3.05Å; Y214-R231 WeakPolarHBondContact OH-CD 3.33Å; Y214-R231 PolarHBondContact OH-NE 3.24Å
215	G	89.6	Confident	87.7	Confident	13 Å²	13	75 Å²	75	13%	0.134	42%	0.417	C	S	.	.	S	Bend	trans	70.2	16.3	172.6	0	0	0	0	0	116.3	E195 A217 E218 A219	E195-G215 WeakPolarHBondContact OE1-CA 3.15Å; E195-G215 PolarHBondContact OE1-N 3.33Å; E195-G215 WeakPolarHBondContact OE2-CA 3.38Å; E195-G215 PolarHBondContact OE2-N 3.3Å; G215-A217 VanDerWaalsContact C-N 3.32Å; G215-E218 PolarHBondContact O-N 3.07Å; G215-A219 WeakPolarHBondContact O-CB 3.38Å; G215-A219 PolarHBondContact O-N 3.15Å
216	G	91.8	Very high	88.5	Confident	16 Å²	16	73.1 Å²	73.1	17%	0.165	40%	0.404	C	S	.	.	H	α-helix	trans	-65.2	-37.5	174.7	0	0	0	0	0	112.3	E195 Y214 L220	E195-G216 PolarHBondContact OE2-N 2.68Å; Y214-G216 VanDerWaalsContact C-N 3.27Å; Y214-G216 PolarHBondContact O-N 3.05Å; G216-L220 WeakPolarHBondContact O-CB 3.37Å; G216-L220 PolarHBondContact O-N 3.22Å
217	A	94.3	Very high	89.7	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-73.3	-38.7	177.8	0	0	0	0	0	111.2	L173 L193 E195 G215 A219 L220 A221 F228	L173-A217 HydrophobicContact CD2-CB 4.03Å; L193-A217 HydrophobicContact CD2-CB 3.75Å; L193-A217 VanDerWaalsContact CD2-O 3.23Å; L193-A217 WeakPolarHBondContact CD2-O 3.43Å; L193-A217 HydrophobicContact CG-CB 4.14Å; E195-A217 HydrophobicContact CB-CB 3.72Å; E195-A217 HydrophobicContact CG-CB 3.79Å; E195-A217 PolarHBondContact OE2-N 3.16Å; G215-A217 VanDerWaalsContact C-N 3.32Å; A217-A219 PolarHBondContact O-N 3.4Å; A217-L220 PolarHBondContact O-N 3.35Å; A217-A221 WeakPolarHBondContact O-CB 3.47Å; A217-A221 PolarHBondContact O-N 3.05Å; A217-F228 HydrophobicContact CB-CE2 4.27Å
218	E	95.8	Very high	90.7	Very high	77 Å²	77	67 Å²	67	36%	0.36	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-45.2	174.3	-175.6	168	-132	0	0	111.4	G215 L220 A221 V222 F228 R231	G215-E218 PolarHBondContact O-N 3.07Å; E218-L220 VanDerWaalsContact C-N 3.35Å; E218-L220 PolarHBondContact O-N 2.92Å; E218-A221 WeakPolarHBondContact O-CB 3.48Å; E218-A221 PolarHBondContact O-N 3.29Å; E218-V222 WeakPolarHBondContact O-CG2 2.93Å; E218-V222 PolarHBondContact O-N 3.33Å; E218-F228 HydrophobicContact CB-CD1 3.85Å; E218-F228 HydrophobicContact CB-CD2 4.02Å; E218-F228 HydrophobicContact CB-CE1 3.8Å; E218-F228 HydrophobicContact CB-CE2 3.99Å; E218-F228 HydrophobicContact CB-CG 3.95Å; E218-F228 HydrophobicContact CB-CZ 3.87Å; E218-F228 HydrophobicContact CG-CB 4.38Å; E218-F228 HydrophobicContact CG-CD1 3.65Å; E218-F228 HydrophobicContact CG-CD2 4.49Å; E218-F228 HydrophobicContact CG-CE1 3.99Å; E218-F228 HydrophobicContact CG-CG 3.92Å; E218-F228 WeakPolarHBondContact OE1-CD1 3.47Å; E218-R231 IonicContact OE1-NH1 3.74Å; E218-R231 IonicContact OE2-CZ 3.56Å; E218-R231 IonicContact OE2-NH1 2.65Å; E218-R231 PolarHBondContact OE2-NH1 3.21Å; E218-R231 IonicContact OE2-NH2 3.18Å; E218-R231 PolarHBondContact OE2-NH2 3.09Å
219	A	95.1	Very high	91.7	Very high	62 Å²	62	63.7 Å²	63.7	51%	0.512	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-43.1	175.4	0	0	0	0	0	112.2	G215 A217 V222 E223	G215-A219 WeakPolarHBondContact O-CB 3.38Å; G215-A219 PolarHBondContact O-N 3.15Å; A217-A219 PolarHBondContact O-N 3.4Å; A219-V222 PolarHBondContact O-N 2.92Å; A219-E223 PolarHBondContact O-N 3.41Å
220	L	95.3	Very high	92.4	Very high	12 Å²	12	60.8 Å²	60.8	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-39.1	176.2	179.8	63.9	0	0	0	112.2	L173 V176 I180 G216 A217 E218 V222 E223 K224	L173-L220 HydrophobicContact CB-CD2 4.31Å; L173-L220 HydrophobicContact CD2-CD2 4.36Å; L173-L220 WeakPolarHBondContact O-CD2 3.44Å; V176-L220 HydrophobicContact CB-CD2 4.13Å; V176-L220 HydrophobicContact CG1-CD2 3.65Å; I180-L220 HydrophobicContact CD1-CD2 4.3Å; I180-L220 HydrophobicContact CD1-CG 4.32Å; G216-L220 WeakPolarHBondContact O-CB 3.37Å; G216-L220 PolarHBondContact O-N 3.22Å; A217-L220 PolarHBondContact O-N 3.35Å; E218-L220 VanDerWaalsContact C-N 3.35Å; E218-L220 PolarHBondContact O-N 2.92Å; L220-V222 VanDerWaalsContact C-N 3.33Å; L220-V222 PolarHBondContact O-N 3.19Å; L220-E223 PolarHBondContact O-N 3.42Å; L220-K224 HydrophobicContact CD1-CG 3.86Å; L220-K224 HydrophobicContact CG-CG 4.36Å; L220-K224 WeakPolarHBondContact O-CB 3.48Å; L220-K224 WeakPolarHBondContact O-CG 3.44Å; L220-K224 PolarHBondContact O-N 3.43Å
221	A	96.3	Very high	93	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-60.8	-44.4	176.7	0	0	0	0	0	110.7	L193 A217 E218 K224 N225 V226 F228	L193-A221 HydrophobicContact CB-CB 4.45Å; L193-A221 HydrophobicContact CD2-CB 4.15Å; A217-A221 WeakPolarHBondContact O-CB 3.47Å; A217-A221 PolarHBondContact O-N 3.05Å; E218-A221 WeakPolarHBondContact O-CB 3.48Å; E218-A221 PolarHBondContact O-N 3.29Å; A221-K224 PolarHBondContact O-N 2.87Å; A221-N225 PolarHBondContact O-N 2.74Å; A221-V226 CarbonylContact C-O 3.52Å; A221-V226 WeakPolarHBondContact CB-O 3.4Å; A221-V226 PolarHBondContact O-N 2.85Å; A221-V226 VanDerWaalsContact O-O 3.11Å; A221-F228 HydrophobicContact CB-CB 3.91Å; A221-F228 HydrophobicContact CB-CD2 4.38Å
222	V	96.7	Very high	93.7	Very high	115 Å²	115	55.4 Å²	55.4	70%	0.697	29%	0.29	S	S	*	.	H	α-helix	trans	-62	-48.2	173.9	174.6	0	0	0	0	111.2	E218 A219 L220 K224 N225	E218-V222 WeakPolarHBondContact O-CG2 2.93Å; E218-V222 PolarHBondContact O-N 3.33Å; A219-V222 PolarHBondContact O-N 2.92Å; L220-V222 VanDerWaalsContact C-N 3.33Å; L220-V222 PolarHBondContact O-N 3.19Å; V222-K224 VanDerWaalsContact C-N 3.3Å; V222-K224 PolarHBondContact O-N 3.35Å; V222-N225 PolarHBondContact O-N 3.36Å; V222-N225 VanDerWaalsContact O-N 3.15Å
223	E	96.2	Very high	94.3	Very high	132 Å²	132	52.9 Å²	52.9	62%	0.617	28%	0.281	S	S	*	.	H	α-helix	trans	-56.9	-42.7	178.8	-173	-157.8	130.3	0	0	112.2	A219 L220 N225	A219-E223 PolarHBondContact O-N 3.41Å; L220-E223 PolarHBondContact O-N 3.42Å; E223-N225 VanDerWaalsContact C-N 3.34Å
224	K	96.1	Very high	94.5	Very high	59 Å²	59	52 Å²	52	26%	0.257	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	3.8	-178.5	-61.3	-55.8	-172.8	-146	0	113.9	S177 I180 M184 L220 A221 V222 V226	S177-K224 WeakPolarHBondContact OG-CE 3.4Å; I180-K224 HydrophobicContact CD1-CB 4.3Å; I180-K224 HydrophobicContact CD1-CG 4.12Å; I180-K224 HydrophobicContact CG2-CB 3.94Å; I180-K224 HydrophobicContact CG2-CG 4.13Å; M184-K224 WeakPolarHBondContact CE-O 3.48Å; L220-K224 HydrophobicContact CD1-CG 3.86Å; L220-K224 HydrophobicContact CG-CG 4.36Å; L220-K224 WeakPolarHBondContact O-CB 3.48Å; L220-K224 WeakPolarHBondContact O-CG 3.44Å; L220-K224 PolarHBondContact O-N 3.43Å; A221-K224 PolarHBondContact O-N 2.87Å; V222-K224 VanDerWaalsContact C-N 3.3Å; V222-K224 PolarHBondContact O-N 3.35Å; K224-V226 HydrophobicContact CB-CG2 4.06Å; K224-V226 PolarHBondContact O-N 2.88Å
225	N	95.9	Very high	94.6	Very high	154 Å²	154	47.1 Å²	47.1	82%	0.824	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	43.1	-174.4	-167	34.2	0	0	0	112.8	A221 V222 E223	A221-N225 PolarHBondContact O-N 2.74Å; V222-N225 PolarHBondContact O-N 3.36Å; V222-N225 VanDerWaalsContact O-N 3.15Å; E223-N225 VanDerWaalsContact C-N 3.34Å
226	V	96	Very high	94.5	Very high	18 Å²	18	48.8 Å²	48.8	11%	0.109	26%	0.259	C	S	.	.			trans	-110.6	145.9	175.7	175.5	0	0	0	0	108.8	I180 M184 I190 A221 K224 F228	I180-V226 HydrophobicContact CG2-CG2 3.84Å; M184-V226 HydrophobicContact CE-CG2 3.97Å; I190-V226 HydrophobicContact CB-CG1 4.32Å; I190-V226 HydrophobicContact CD1-CG2 4.08Å; I190-V226 HydrophobicContact CG2-CG1 3.51Å; A221-V226 CarbonylContact C-O 3.52Å; A221-V226 WeakPolarHBondContact CB-O 3.4Å; A221-V226 PolarHBondContact O-N 2.85Å; A221-V226 VanDerWaalsContact O-O 3.11Å; K224-V226 HydrophobicContact CB-CG2 4.06Å; K224-V226 PolarHBondContact O-N 2.88Å; V226-F228 PolarHBondContact O-N 2.96Å
227	R	96.9	Very high	94.3	Very high	122 Å²	122	50.7 Å²	50.7	46%	0.46	27%	0.27	S	S	.	.			trans	-64.9	129.8	176.8	-175.3	179.1	-68	116.6	-11	110.9	I191 G192 L193 L229 V268	I191-R227 PolarHBondContact O-NH1 3.04Å; I191-R227 VanDerWaalsContact O-NH1 3.14Å; G192-R227 CarbonylContact C-O 3.39Å; G192-R227 WeakPolarHBondContact CA-O 3.28Å; L193-R227 PolarHBondContact N-O 3.24Å; R227-L229 HydrophobicContact CG-CD2 4.44Å; R227-V268 VanDerWaalsContact CD-CG2 3.49Å; R227-V268 VanDerWaalsContact CZ-CG2 3.47Å
228	F	97.4	Very high	94.2	Very high	25 Å²	25	51.8 Å²	51.8	11%	0.11	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	119.5	166.7	-174.7	-118.4	0	0	0	110	L193 E195 A217 E218 A221 V226 G230 R231 K264	L193-F228 WeakPolarHBondContact O-CD2 3.45Å; E195-F228 HydrophobicContact CB-CE2 3.95Å; E195-F228 HydrophobicContact CB-CZ 4.02Å; A217-F228 HydrophobicContact CB-CE2 4.27Å; E218-F228 HydrophobicContact CB-CD1 3.85Å; E218-F228 HydrophobicContact CB-CD2 4.02Å; E218-F228 HydrophobicContact CB-CE1 3.8Å; E218-F228 HydrophobicContact CB-CE2 3.99Å; E218-F228 HydrophobicContact CB-CG 3.95Å; E218-F228 HydrophobicContact CB-CZ 3.87Å; E218-F228 HydrophobicContact CG-CB 4.38Å; E218-F228 HydrophobicContact CG-CD1 3.65Å; E218-F228 HydrophobicContact CG-CD2 4.49Å; E218-F228 HydrophobicContact CG-CE1 3.99Å; E218-F228 HydrophobicContact CG-CG 3.92Å; E218-F228 WeakPolarHBondContact OE1-CD1 3.47Å; A221-F228 HydrophobicContact CB-CB 3.91Å; A221-F228 HydrophobicContact CB-CD2 4.38Å; V226-F228 PolarHBondContact O-N 2.96Å; F228-G230 VanDerWaalsContact CZ-C 3.49Å; F228-G230 VanDerWaalsContact CZ-O 3.24Å; F228-G230 WeakPolarHBondContact CZ-O 3.12Å; F228-R231 HydrophobicContact CE1-CG 4.11Å; F228-R231 HydrophobicContact CZ-CG 3.68Å; F228-K264 VanDerWaalsContact O-CE 3.31Å; F228-K264 WeakPolarHBondContact O-CE 3.46Å; F228-K264 PolarHBondContact O-NZ 3.02Å
229	L	97.2	Very high	93.9	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-43.9	-178.7	-66	172	0	0	0	111	I163 I191 L193 I194 R227 L261 K264 I265	I163-L229 HydrophobicContact CG1-CD1 4.4Å; I163-L229 HydrophobicContact CG2-CD1 4.18Å; I191-L229 HydrophobicContact CG2-CD1 4.36Å; I191-L229 HydrophobicContact CG2-CD2 4.38Å; L193-L229 PolarHBondContact O-N 2.84Å; I194-L229 HydrophobicContact CD1-CD1 4.35Å; I194-L229 HydrophobicContact CG1-CB 4.06Å; I194-L229 HydrophobicContact CG1-CD1 3.95Å; R227-L229 HydrophobicContact CG-CD2 4.44Å; L229-L261 HydrophobicContact CB-CD1 3.63Å; L229-K264 HydrophobicContact CD2-CG 4.47Å; L229-K264 WeakPolarHBondContact O-CD 3.36Å; L229-K264 VanDerWaalsContact O-CE 3.27Å; L229-K264 WeakPolarHBondContact O-CE 3.45Å; L229-K264 PolarHBondContact O-NZ 2.76Å; L229-I265 HydrophobicContact CD1-CD1 4.27Å; L229-I265 HydrophobicContact CD1-CG1 3.9Å; L229-I265 HydrophobicContact CD2-CG1 4.12Å
230	G	96.2	Very high	93.7	Very high	14 Å²	14	52.8 Å²	52.8	14%	0.144	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.8	-168	175.9	0	0	0	0	0	113.5	E195 F228	E195-G230 PolarHBondContact N-O 3.07Å; F228-G230 VanDerWaalsContact CZ-C 3.49Å; F228-G230 VanDerWaalsContact CZ-O 3.24Å; F228-G230 WeakPolarHBondContact CZ-O 3.12Å
231	R	95.1	Very high	93.5	Very high	54 Å²	54	52.8 Å²	52.8	20%	0.204	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.9	-176	-64.2	-179	169.6	94	-8.4	110.3	E195 Y214 E218 F228	E195-R231 HydrophobicContact CB-CG 4.18Å; E195-R231 CarbonylContact O-C 3.57Å; E195-R231 VanDerWaalsContact O-CA 3.3Å; E195-R231 WeakPolarHBondContact O-CA 3.19Å; E195-R231 IonicContact OE1-CZ 3.76Å; E195-R231 IonicContact OE1-NE 3.78Å; E195-R231 PolarHBondContact OE1-NE 2.86Å; Y214-R231 WeakPolarHBondContact OH-CD 3.33Å; Y214-R231 PolarHBondContact OH-NE 3.24Å; E218-R231 IonicContact OE1-NH1 3.74Å; E218-R231 IonicContact OE2-CZ 3.56Å; E218-R231 IonicContact OE2-NH1 2.65Å; E218-R231 PolarHBondContact OE2-NH1 3.21Å; E218-R231 IonicContact OE2-NH2 3.18Å; E218-R231 PolarHBondContact OE2-NH2 3.09Å; F228-R231 HydrophobicContact CE1-CG 4.11Å; F228-R231 HydrophobicContact CZ-CG 3.68Å
232	L	94.3	Very high	93.2	Very high	9 Å²	9	53.4 Å²	53.4	5%	0.047	29%	0.287	C	S	.	.			trans	-117.2	117.8	169.8	-62.1	171.7	0	0	0	108.2	V33 I194 E195 N196 M197 S198 N257 L261	V33-L232 HydrophobicContact CG2-CD1 3.74Å; I194-L232 HydrophobicContact CG2-CD1 3.98Å; I194-L232 HydrophobicContact CG2-CG 4.26Å; E195-L232 PolarHBondContact O-N 2.9Å; N196-L232 CarbonylContact C-O 3.56Å; N196-L232 WeakPolarHBondContact OD1-CB 3.46Å; M197-L232 PolarHBondContact N-O 3.39Å; S198-L232 PolarHBondContact N-O 3.48Å; L232-N257 HydrophobicContact CD2-CB 3.87Å; L232-L261 HydrophobicContact CD1-CD2 3.85Å; L232-L261 HydrophobicContact CD2-CD2 4.1Å; L232-L261 HydrophobicContact CG-CD2 4.14Å
233	P	92.3	Very high	92.8	Very high	20 Å²	20	53.6 Å²	53.6	13%	0.13	28%	0.284	C	S	.	.			trans	-75.1	165.2	172.5	33.8	-35	0	0	0	110.3	S198 G199 D235 N257	S198-P233 WeakPolarHBondContact O-CA 3.49Å; G199-P233 CarbonylContact O-C 3.57Å; G199-P233 VanDerWaalsContact O-CA 3.3Å; G199-P233 WeakPolarHBondContact O-CA 3.4Å; G199-P233 WeakPolarHBondContact O-CB 3.46Å; P233-D235 PolarHBondContact O-N 3.17Å; P233-N257 WeakPolarHBondContact CD-ND2 3.45Å; P233-N257 WeakPolarHBondContact CG-ND2 3.48Å
234	F	89.6	Confident	92.5	Very high	57 Å²	57	55.8 Å²	55.8	25%	0.25	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-59	127.2	160.3	-75	-78.2	0	0	0	110.1	M197 G199 Y200 K201 L211 F212	M197-F234 HydrophobicContact CB-CD2 4.09Å; M197-F234 HydrophobicContact CB-CE1 4.14Å; M197-F234 HydrophobicContact CB-CE2 3.47Å; M197-F234 VanDerWaalsContact CB-CE2 3.47Å; M197-F234 HydrophobicContact CB-CZ 3.5Å; M197-F234 HydrophobicContact CE-CE1 4.31Å; M197-F234 HydrophobicContact CG-CD1 4.31Å; M197-F234 HydrophobicContact CG-CE1 3.64Å; M197-F234 HydrophobicContact CG-CE2 3.95Å; M197-F234 HydrophobicContact CG-CZ 3.44Å; M197-F234 VanDerWaalsContact CG-CZ 3.44Å; M197-F234 HydrophobicContact SD-CE1 3.88Å; M197-F234 HydrophobicContact SD-CE2 4.48Å; M197-F234 HydrophobicContact SD-CZ 3.57Å; M197-F234 VanDerWaalsContact SD-CZ 3.57Å; G199-F234 WeakPolarHBondContact O-CD2 3.28Å; G199-F234 PolarHBondContact O-N 2.95Å; Y200-F234 HydrophobicContact CD2-CB 3.79Å; K201-F234 PolarHBondContact N-O 3.18Å; L211-F234 HydrophobicContact CD1-CD2 3.73Å; L211-F234 HydrophobicContact CD1-CE2 3.92Å; L211-F234 HydrophobicContact CD1-CG 4.48Å; F212-F234 HydrophobicContact CD2-CE2 4.26Å; F212-F234 AromaticContact CE2-CE2 3.76Å; F212-F234 HydrophobicContact CE2-CE2 3.76Å; F212-F234 AromaticContact CE2-CZ 3.84Å; F212-F234 HydrophobicContact CE2-CZ 3.84Å; F212-F234 HydrophobicContact CZ-CZ 4.46Å
235	D	88.1	Confident	92.1	Very high	25 Å²	25	56.8 Å²	56.8	13%	0.134	31%	0.305	C	S	.	.			trans	-126.3	108.7	176.9	-173.3	-21.7	0	0	0	108.7	P233 S237 L238 T239 Y253 S255	P233-D235 PolarHBondContact O-N 3.17Å; D235-S237 PolarHBondContact O-N 2.85Å; D235-S237 WeakPolarHBondContact OD1-CA 3.33Å; D235-S237 WeakPolarHBondContact OD1-CB 3.27Å; D235-S237 PolarHBondContact OD1-N 2.95Å; D235-S237 PolarHBondContact OD1-OG 2.99Å; D235-S237 VanDerWaalsContact OD1-OG 3.12Å; D235-L238 HydrophobicContact CB-CB 4.02Å; D235-L238 PolarHBondContact O-N 3.4Å; D235-L238 PolarHBondContact OD1-N 2.9Å; D235-T239 PolarHBondContact O-N 2.83Å; D235-T239 VanDerWaalsContact O-N 3.11Å; D235-T239 PolarHBondContact O-OG1 2.81Å; D235-Y253 PolarHBondContact OD2-OH 2.89Å; D235-Y253 VanDerWaalsContact OD2-OH 3.11Å; D235-S255 WeakPolarHBondContact OD2-CB 2.89Å
236	S	87.2	Confident	91.8	Very high	48 Å²	48	51.1 Å²	51.1	34%	0.336	28%	0.284	S	S	.	.	H	α-helix	trans	-60.8	-30.5	179.8	52.5	0	0	0	0	112.5	L238 T239 V240	S236-L238 VanDerWaalsContact C-N 3.35Å; S236-T239 PolarHBondContact O-N 3.26Å; S236-V240 WeakPolarHBondContact O-CB 3.3Å; S236-V240 VanDerWaalsContact O-CG2 3.26Å; S236-V240 WeakPolarHBondContact O-CG2 3.46Å; S236-V240 PolarHBondContact O-N 2.97Å
237	S	89.4	Confident	91.7	Very high	56 Å²	56	55 Å²	55	39%	0.392	30%	0.304	S	S	.	.	H	α-helix	trans	-68.2	-39.8	180	-38.9	0	0	0	0	110.6	D235 V240 A241	D235-S237 PolarHBondContact O-N 2.85Å; D235-S237 WeakPolarHBondContact OD1-CA 3.33Å; D235-S237 WeakPolarHBondContact OD1-CB 3.27Å; D235-S237 PolarHBondContact OD1-N 2.95Å; D235-S237 PolarHBondContact OD1-OG 2.99Å; D235-S237 VanDerWaalsContact OD1-OG 3.12Å; S237-V240 PolarHBondContact O-N 3.16Å; S237-A241 WeakPolarHBondContact O-CB 3.46Å; S237-A241 PolarHBondContact O-N 2.68Å
238	L	90.4	Very high	91.5	Very high	23 Å²	23	49.4 Å²	49.4	12%	0.12	28%	0.283	C	S	.	.	H	α-helix	trans	-65	-45.6	174.1	178.4	58.4	0	0	0	111.1	T32 Q36 D235 S236 V240 A241 C242 Y253	T32-L238 HydrophobicContact CG2-CD2 3.91Å; T32-L238 HydrophobicContact CG2-CG 4.27Å; Q36-L238 HydrophobicContact CG-CD1 3.89Å; Q36-L238 HydrophobicContact CG-CD2 4.13Å; Q36-L238 VanDerWaalsContact NE2-CD1 3.3Å; D235-L238 HydrophobicContact CB-CB 4.02Å; D235-L238 PolarHBondContact O-N 3.4Å; D235-L238 PolarHBondContact OD1-N 2.9Å; S236-L238 VanDerWaalsContact C-N 3.35Å; L238-V240 VanDerWaalsContact C-N 3.33Å; L238-V240 PolarHBondContact O-N 3.31Å; L238-A241 PolarHBondContact O-N 2.91Å; L238-C242 PolarHBondContact O-N 3.26Å; L238-C242 PolarHBondContact O-SG 3.39Å; L238-C242 VanDerWaalsContact O-SG 3.35Å; L238-Y253 HydrophobicContact CB-CD1 4.09Å; L238-Y253 HydrophobicContact CB-CE1 3.99Å; L238-Y253 HydrophobicContact CD1-CD1 4.28Å
239	T	89.7	Confident	91.3	Very high	69 Å²	69	53.3 Å²	53.3	42%	0.423	30%	0.301	S	S	.	.	H	α-helix	trans	-56.8	-48	175.6	-56.2	0	0	0	0	111.3	D235 S236 A241 C242 D243	D235-T239 PolarHBondContact O-N 2.83Å; D235-T239 VanDerWaalsContact O-N 3.11Å; D235-T239 PolarHBondContact O-OG1 2.81Å; S236-T239 PolarHBondContact O-N 3.26Å; T239-A241 VanDerWaalsContact C-N 3.33Å; T239-A241 PolarHBondContact O-N 2.95Å; T239-C242 PolarHBondContact O-N 2.83Å; T239-D243 WeakPolarHBondContact CG2-OD2 3.39Å; T239-D243 WeakPolarHBondContact O-CB 3.38Å; T239-D243 PolarHBondContact O-N 3.35Å
240	V	91	Very high	91	Very high	92 Å²	92	55.6 Å²	55.6	56%	0.558	32%	0.318	S	S	*	.	H	α-helix	trans	-60.6	-42.2	177.7	169.7	0	0	0	0	111.4	S236 S237 L238 D243 R244	S236-V240 WeakPolarHBondContact O-CB 3.3Å; S236-V240 VanDerWaalsContact O-CG2 3.26Å; S236-V240 WeakPolarHBondContact O-CG2 3.46Å; S236-V240 PolarHBondContact O-N 2.97Å; S237-V240 PolarHBondContact O-N 3.16Å; L238-V240 VanDerWaalsContact C-N 3.33Å; L238-V240 PolarHBondContact O-N 3.31Å; V240-D243 PolarHBondContact O-N 3.02Å; V240-R244 WeakPolarHBondContact O-CB 3.24Å; V240-R244 PolarHBondContact O-N 2.91Å
241	A	91.3	Very high	90.9	Very high	12 Å²	12	55.3 Å²	55.3	10%	0.099	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-47.8	176	0	0	0	0	0	111	S237 L238 T239 D243 K251	S237-A241 WeakPolarHBondContact O-CB 3.46Å; S237-A241 PolarHBondContact O-N 2.68Å; L238-A241 PolarHBondContact O-N 2.91Å; T239-A241 VanDerWaalsContact C-N 3.33Å; T239-A241 PolarHBondContact O-N 2.95Å; A241-D243 PolarHBondContact O-N 3.39Å; A241-K251 WeakPolarHBondContact O-CD 3.26Å; A241-K251 WeakPolarHBondContact O-CE 3.5Å; A241-K251 PolarHBondContact O-NZ 3.36Å
242	C	90.3	Very high	90.8	Very high	13 Å²	13	55.3 Å²	55.3	9%	0.088	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-39.2	179.4	-67.1	0	0	0	0	113.5	L238 T239 K251	L238-C242 PolarHBondContact O-N 3.26Å; L238-C242 PolarHBondContact O-SG 3.39Å; L238-C242 VanDerWaalsContact O-SG 3.35Å; T239-C242 PolarHBondContact O-N 2.83Å; C242-K251 VanDerWaalsContact C-NZ 3.33Å; C242-K251 PolarHBondContact O-NZ 2.93Å
243	D	89.2	Confident	90.7	Very high	120 Å²	120	59.2 Å²	59.2	64%	0.642	33%	0.331	S	S	*	.	H	α-helix	trans	-86.8	-29.8	-173.2	-70	-15.1	0	0	0	114	T239 V240 A241 A245	T239-D243 WeakPolarHBondContact CG2-OD2 3.39Å; T239-D243 WeakPolarHBondContact O-CB 3.38Å; T239-D243 PolarHBondContact O-N 3.35Å; V240-D243 PolarHBondContact O-N 3.02Å; A241-D243 PolarHBondContact O-N 3.39Å; D243-A245 PolarHBondContact O-N 3.31Å
244	R	88.6	Confident	90.6	Very high	178 Å²	178	59.2 Å²	59.2	67%	0.672	33%	0.331	S	S	*	.	S	Bend	trans	-66.2	132.9	-175.5	-175.7	-176.9	177.5	174.7	1.1	111.3	V240 G246 K251	V240-R244 WeakPolarHBondContact O-CB 3.24Å; V240-R244 PolarHBondContact O-N 2.91Å; R244-G246 PolarHBondContact O-N 2.89Å; R244-K251 VanDerWaalsContact O-CE 3.24Å; R244-K251 WeakPolarHBondContact O-CE 3.49Å; R244-K251 PolarHBondContact O-NZ 3.46Å
245	A	87.9	Confident	90.6	Very high	79 Å²	79	56.9 Å²	56.9	65%	0.653	32%	0.321	S	S	*	.			trans	-59.6	139.7	170.3	0	0	0	0	0	111.3	D243	D243-A245 PolarHBondContact O-N 3.31Å
246	G	90.2	Very high	90.8	Very high	36 Å²	36	60.8 Å²	60.8	37%	0.371	34%	0.339	S	S	.	.			trans	164.9	-180	-178.9	0	0	0	0	0	112.3	G65 R244 S250	G65-G246 VanDerWaalsContact CA-O 3.29Å; G65-G246 WeakPolarHBondContact CA-O 3.27Å; R244-G246 PolarHBondContact O-N 2.89Å; G246-S250 WeakPolarHBondContact CA-OG 3.41Å
247	D	92.6	Very high	91	Very high	98 Å²	98	61.4 Å²	61.4	52%	0.524	34%	0.339	S	S	.	.			trans	-88.7	175.6	174.8	62.4	17	0	0	0	111.5	Q249 S250 K251	D247-Q249 PolarHBondContact O-N 3.29Å; D247-Q249 VanDerWaalsContact O-N 3.16Å; D247-Q249 WeakPolarHBondContact OD1-CB 3.4Å; D247-Q249 PolarHBondContact OD1-N 3.5Å; D247-Q249 VanDerWaalsContact OD1-N 3.15Å; D247-S250 PolarHBondContact N-OG 3.45Å; D247-S250 PolarHBondContact O-N 3.04Å; D247-S250 PolarHBondContact O-OG 3.45Å; D247-S250 PolarHBondContact OD1-N 3.01Å; D247-S250 VanDerWaalsContact OD1-N 3.07Å; D247-K251 WeakPolarHBondContact O-CG 3.36Å
248	F	94.2	Very high	91.1	Very high	6 Å²	6	59 Å²	59	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-52.8	-36.4	177.8	178.8	-114.4	0	0	0	113.5	I39 W42 L64 A83 D84 F90 S250 K251 I252	I39-F248 HydrophobicContact CG1-CE2 4.25Å; W42-F248 HydrophobicContact CE3-CE1 4.44Å; W42-F248 HydrophobicContact CE3-CZ 4.24Å; W42-F248 AromaticContact CH2-CE1 3.9Å; W42-F248 HydrophobicContact CH2-CE1 3.9Å; W42-F248 HydrophobicContact CH2-CZ 4.48Å; W42-F248 HydrophobicContact CZ2-CE1 4.16Å; W42-F248 HydrophobicContact CZ3-CE1 4.03Å; W42-F248 HydrophobicContact CZ3-CZ 4.17Å; L64-F248 HydrophobicContact CB-CD2 4.42Å; L64-F248 HydrophobicContact CD2-CD2 4.39Å; L64-F248 HydrophobicContact CD2-CE2 4.15Å; L64-F248 VanDerWaalsContact O-CA 3.32Å; L64-F248 WeakPolarHBondContact O-CA 3.28Å; A83-F248 HydrophobicContact CB-CB 4.01Å; A83-F248 HydrophobicContact CB-CD1 3.87Å; A83-F248 HydrophobicContact CB-CD2 3.51Å; A83-F248 HydrophobicContact CB-CE1 4.19Å; A83-F248 HydrophobicContact CB-CE2 3.87Å; A83-F248 HydrophobicContact CB-CG 3.51Å; A83-F248 HydrophobicContact CB-CZ 4.19Å; A83-F248 WeakPolarHBondContact O-CB 3.17Å; A83-F248 WeakPolarHBondContact O-CD1 3.45Å; A83-F248 WeakPolarHBondContact O-CG 3.38Å; D84-F248 HydrophobicContact CB-CE1 4.22Å; F90-F248 HydrophobicContact CD1-CE1 4.46Å; F90-F248 AromaticContact CD1-CE2 3.77Å; F90-F248 HydrophobicContact CD1-CE2 3.77Å; F90-F248 AromaticContact CD1-CZ 3.64Å; F90-F248 HydrophobicContact CD1-CZ 3.64Å; F90-F248 AromaticContact CE1-CE2 3.67Å; F90-F248 HydrophobicContact CE1-CE2 3.67Å; F90-F248 AromaticContact CE1-CZ 3.88Å; F90-F248 HydrophobicContact CE1-CZ 3.88Å; F90-F248 HydrophobicContact CG-CZ 4.29Å; F248-S250 VanDerWaalsContact C-N 3.28Å; F248-S250 PolarHBondContact O-N 3.05Å; F248-K251 WeakPolarHBondContact O-CA 3.46Å; F248-K251 WeakPolarHBondContact O-CB 3.37Å; F248-K251 PolarHBondContact O-N 2.73Å; F248-I252 HydrophobicContact CD1-CG2 4.37Å; F248-I252 HydrophobicContact CE1-CG2 4.1Å; F248-I252 HydrophobicContact CE2-CG2 4.48Å; F248-I252 HydrophobicContact CZ-CG2 4.16Å; F248-I252 VanDerWaalsContact O-CG2 3.28Å; F248-I252 WeakPolarHBondContact O-CG2 3.19Å; F248-I252 PolarHBondContact O-N 3.33Å
249	Q	92.7	Very high	91.3	Very high	106 Å²	106	61.8 Å²	61.8	50%	0.495	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-34.7	-179.7	-64.6	-58.8	-40.5	0	0	112.1	D247 K251 I252	D247-Q249 PolarHBondContact O-N 3.29Å; D247-Q249 VanDerWaalsContact O-N 3.16Å; D247-Q249 WeakPolarHBondContact OD1-CB 3.4Å; D247-Q249 PolarHBondContact OD1-N 3.5Å; D247-Q249 VanDerWaalsContact OD1-N 3.15Å; Q249-K251 PolarHBondContact O-N 3.38Å; Q249-I252 WeakPolarHBondContact O-CG1 3.44Å
250	S	91.9	Very high	91.6	Very high	53 Å²	53	62.6 Å²	62.6	37%	0.371	33%	0.334	S	S	.	.	H	α-helix	trans	-71.9	-11.7	173.6	74.1	0	0	0	0	114.5	G246 D247 F248	G246-S250 WeakPolarHBondContact CA-OG 3.41Å; D247-S250 PolarHBondContact N-OG 3.45Å; D247-S250 PolarHBondContact O-N 3.04Å; D247-S250 PolarHBondContact O-OG 3.45Å; D247-S250 PolarHBondContact OD1-N 3.01Å; D247-S250 VanDerWaalsContact OD1-N 3.07Å; F248-S250 VanDerWaalsContact C-N 3.28Å; F248-S250 PolarHBondContact O-N 3.05Å
251	K	92.9	Very high	91.8	Very high	7 Å²	7	58.8 Å²	58.8	3%	0.03	31%	0.31	C	S	.	.	H	α-helix	trans	-103.6	-6.4	-173.4	-57.3	-64.2	-167.9	164.5	0	114.7	I63 A241 C242 R244 D247 F248 Q249 Y253	I63-K251 WeakPolarHBondContact O-CD 3.26Å; I63-K251 WeakPolarHBondContact O-CG 3.31Å; A241-K251 WeakPolarHBondContact O-CD 3.26Å; A241-K251 WeakPolarHBondContact O-CE 3.5Å; A241-K251 PolarHBondContact O-NZ 3.36Å; C242-K251 VanDerWaalsContact C-NZ 3.33Å; C242-K251 PolarHBondContact O-NZ 2.93Å; R244-K251 VanDerWaalsContact O-CE 3.24Å; R244-K251 WeakPolarHBondContact O-CE 3.49Å; R244-K251 PolarHBondContact O-NZ 3.46Å; D247-K251 WeakPolarHBondContact O-CG 3.36Å; F248-K251 WeakPolarHBondContact O-CA 3.46Å; F248-K251 WeakPolarHBondContact O-CB 3.37Å; F248-K251 PolarHBondContact O-N 2.73Å; Q249-K251 PolarHBondContact O-N 3.38Å; K251-Y253 PolarHBondContact O-N 3.16Å
252	I	92.8	Very high	92	Very high	55 Å²	55	58.4 Å²	58.4	28%	0.282	31%	0.306	S	S	.	.			trans	-72.7	2.4	-172.3	68.9	-177.9	0	0	0	115	W42 F248 Q249 T254	W42-I252 HydrophobicContact CZ3-CG2 4.26Å; F248-I252 HydrophobicContact CD1-CG2 4.37Å; F248-I252 HydrophobicContact CE1-CG2 4.1Å; F248-I252 HydrophobicContact CE2-CG2 4.48Å; F248-I252 HydrophobicContact CZ-CG2 4.16Å; F248-I252 VanDerWaalsContact O-CG2 3.28Å; F248-I252 WeakPolarHBondContact O-CG2 3.19Å; F248-I252 PolarHBondContact O-N 3.33Å; Q249-I252 WeakPolarHBondContact O-CG1 3.44Å; I252-T254 PolarHBondContact O-N 3.4Å
253	Y	92.7	Very high	92.3	Very high	90 Å²	90	63.2 Å²	63.2	35%	0.353	33%	0.328	S	S	.	.			trans	-56.9	133.3	177	177.4	-93.6	0	0	0	110.7	Q36 D235 L238 K251	Q36-Y253 PolarHBondContact NE2-O 3.11Å; Q36-Y253 PolarHBondContact OE1-O 3.26Å; D235-Y253 PolarHBondContact OD2-OH 2.89Å; D235-Y253 VanDerWaalsContact OD2-OH 3.11Å; L238-Y253 HydrophobicContact CB-CD1 4.09Å; L238-Y253 HydrophobicContact CB-CE1 3.99Å; L238-Y253 HydrophobicContact CD1-CD1 4.28Å; K251-Y253 PolarHBondContact O-N 3.16Å
254	T	89.8	Confident	92.6	Very high	20 Å²	20	61.2 Å²	61.2	12%	0.123	31%	0.313	C	S	.	.			trans	-137.1	134.8	175.5	174.6	0	0	0	0	109.8	N40 I252 K259	N40-T254 VanDerWaalsContact CG-OG1 3.22Å; N40-T254 PolarHBondContact ND2-OG1 3.45Å; N40-T254 WeakPolarHBondContact OD1-CB 3.33Å; N40-T254 WeakPolarHBondContact OD1-CG2 3.39Å; N40-T254 PolarHBondContact OD1-OG1 3.19Å; I252-T254 PolarHBondContact O-N 3.4Å; T254-K259 HydrophobicContact CG2-CD 4.48Å; T254-K259 HydrophobicContact CG2-CG 4.15Å
255	S	89.6	Confident	92.9	Very high	8 Å²	8	52.8 Å²	52.8	6%	0.056	28%	0.281	C	S	.	.			trans	-79.1	153.2	177.3	75.1	0	0	0	0	110.9	D235 N257 T258 K259	D235-S255 WeakPolarHBondContact OD2-CB 2.89Å; S255-N257 PolarHBondContact O-N 2.88Å; S255-T258 WeakPolarHBondContact O-CA 3.42Å; S255-T258 WeakPolarHBondContact O-CB 3.3Å; S255-T258 PolarHBondContact O-N 3.47Å; S255-T258 PolarHBondContact OG-N 3.2Å; S255-T258 PolarHBondContact OG-OG1 3.11Å; S255-K259 PolarHBondContact O-N 3.11Å; S255-K259 VanDerWaalsContact O-N 3.12Å
256	E	91.4	Very high	93.2	Very high	108 Å²	108	50.4 Å²	50.4	51%	0.505	26%	0.258	S	S	.	.	H	α-helix	trans	-57.2	-39.1	179	-170.1	61	-166.1	0	0	112.4	T258 K259 L260	E256-T258 PolarHBondContact O-N 3.35Å; E256-K259 PolarHBondContact O-N 2.76Å; E256-K259 IonicContact OE2-NZ 3.64Å; E256-L260 HydrophobicContact CG-CD1 4.46Å; E256-L260 WeakPolarHBondContact O-CG 3.45Å; E256-L260 PolarHBondContact O-N 3.27Å
257	N	92.1	Very high	93.3	Very high	61 Å²	61	51.8 Å²	51.8	33%	0.326	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-33.9	176.5	-64.5	-36.1	0	0	0	112.2	L232 P233 S255 L261	L232-N257 HydrophobicContact CD2-CB 3.87Å; P233-N257 WeakPolarHBondContact CD-ND2 3.45Å; P233-N257 WeakPolarHBondContact CG-ND2 3.48Å; S255-N257 PolarHBondContact O-N 2.88Å; N257-L261 VanDerWaalsContact O-CB 3.26Å; N257-L261 WeakPolarHBondContact O-CB 3.46Å; N257-L261 PolarHBondContact O-N 2.95Å
258	T	92.5	Very high	93.3	Very high	5 Å²	5	47.7 Å²	47.7	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-73.8	-36.9	178.3	-52.1	0	0	0	0	111.5	Q36 N40 S255 E256 L261 T262	Q36-T258 HydrophobicContact CB-CG2 3.66Å; Q36-T258 HydrophobicContact CG-CG2 4.44Å; N40-T258 WeakPolarHBondContact ND2-CG2 3.08Å; S255-T258 WeakPolarHBondContact O-CA 3.42Å; S255-T258 WeakPolarHBondContact O-CB 3.3Å; S255-T258 PolarHBondContact O-N 3.47Å; S255-T258 PolarHBondContact OG-N 3.2Å; S255-T258 PolarHBondContact OG-OG1 3.11Å; E256-T258 PolarHBondContact O-N 3.35Å; T258-L261 WeakPolarHBondContact O-CB 3.49Å; T258-L261 PolarHBondContact O-N 3.39Å; T258-T262 PolarHBondContact O-N 2.77Å; T258-T262 PolarHBondContact O-OG1 3.28Å
259	K	94.5	Very high	93	Very high	82 Å²	82	47.9 Å²	47.9	36%	0.357	24%	0.241	S	C	.	.	H	α-helix	trans	-62.1	-51.3	172.8	-64.8	-179.8	-170	169.3	0	111.3	N40 T254 S255 E256 L261 T262 E263	N40-K259 WeakPolarHBondContact OD1-CG 3.2Å; T254-K259 HydrophobicContact CG2-CD 4.48Å; T254-K259 HydrophobicContact CG2-CG 4.15Å; S255-K259 PolarHBondContact O-N 3.11Å; S255-K259 VanDerWaalsContact O-N 3.12Å; E256-K259 PolarHBondContact O-N 2.76Å; E256-K259 IonicContact OE2-NZ 3.64Å; K259-L261 PolarHBondContact O-N 2.89Å; K259-T262 WeakPolarHBondContact O-CA 3.45Å; K259-T262 WeakPolarHBondContact O-CB 3.49Å; K259-T262 PolarHBondContact O-N 3.45Å; K259-E263 WeakPolarHBondContact O-CG 3.2Å; K259-E263 PolarHBondContact O-N 2.96Å
260	L	95	Very high	92.2	Very high	86 Å²	86	47.6 Å²	47.6	45%	0.45	25%	0.251	S	S	.	.	H	α-helix	trans	-58	-38.6	176.7	-67.9	172.7	0	0	0	112	E256 K264	E256-L260 HydrophobicContact CG-CD1 4.46Å; E256-L260 WeakPolarHBondContact O-CG 3.45Å; E256-L260 PolarHBondContact O-N 3.27Å; L260-K264 WeakPolarHBondContact O-CB 3.42Å; L260-K264 PolarHBondContact O-N 3.25Å
261	L	96	Very high	90.3	Very high	12 Å²	12	52.9 Å²	52.9	6%	0.063	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-43.2	174.5	-174.1	73	0	0	0	111.9	I194 L229 L232 N257 T258 K259 K264 I265	I194-L261 HydrophobicContact CD1-CD1 4.49Å; I194-L261 HydrophobicContact CD1-CD2 3.78Å; I194-L261 HydrophobicContact CD1-CG 4.49Å; I194-L261 HydrophobicContact CG1-CD1 4.14Å; I194-L261 HydrophobicContact CG1-CD2 4.18Å; I194-L261 HydrophobicContact CG2-CD2 4.18Å; L229-L261 HydrophobicContact CB-CD1 3.63Å; L232-L261 HydrophobicContact CD1-CD2 3.85Å; L232-L261 HydrophobicContact CD2-CD2 4.1Å; L232-L261 HydrophobicContact CG-CD2 4.14Å; N257-L261 VanDerWaalsContact O-CB 3.26Å; N257-L261 WeakPolarHBondContact O-CB 3.46Å; N257-L261 PolarHBondContact O-N 2.95Å; T258-L261 WeakPolarHBondContact O-CB 3.49Å; T258-L261 PolarHBondContact O-N 3.39Å; K259-L261 PolarHBondContact O-N 2.89Å; L261-K264 PolarHBondContact O-N 3.12Å; L261-I265 HydrophobicContact CG-CD1 4.23Å; L261-I265 WeakPolarHBondContact O-CG1 3.34Å; L261-I265 PolarHBondContact O-N 2.62Å
262	T	96	Very high	90.1	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.018	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-44.9	177.9	-55.6	0	0	0	0	111.1	L37 N40 L41 T258 K259 K264 I265 L266	L37-T262 HydrophobicContact CD1-CG2 4Å; N40-T262 HydrophobicContact CB-CG2 3.81Å; N40-T262 VanDerWaalsContact CB-OG1 3.28Å; N40-T262 WeakPolarHBondContact CB-OG1 3.47Å; L41-T262 HydrophobicContact CD2-CG2 3.92Å; L41-T262 HydrophobicContact CG-CG2 4.11Å; T258-T262 PolarHBondContact O-N 2.77Å; T258-T262 PolarHBondContact O-OG1 3.28Å; K259-T262 WeakPolarHBondContact O-CA 3.45Å; K259-T262 WeakPolarHBondContact O-CB 3.49Å; K259-T262 PolarHBondContact O-N 3.45Å; T262-K264 VanDerWaalsContact C-N 3.3Å; T262-K264 PolarHBondContact O-N 3.19Å; T262-I265 PolarHBondContact O-N 3.05Å; T262-I265 VanDerWaalsContact O-N 3.16Å; T262-L266 HydrophobicContact CG2-CD1 4.32Å; T262-L266 WeakPolarHBondContact O-CG 3.26Å; T262-L266 PolarHBondContact O-N 3.12Å
263	E	95.3	Very high	90	Very high	114 Å²	114	55.2 Å²	55.2	53%	0.533	29%	0.294	S	S	.	.	H	α-helix	trans	-58.3	-42.6	174.8	-70.8	172.9	179	0	0	111.8	K259 L266 S267	K259-E263 WeakPolarHBondContact O-CG 3.2Å; K259-E263 PolarHBondContact O-N 2.96Å; E263-L266 PolarHBondContact O-N 2.78Å; E263-S267 PolarHBondContact O-N 3.39Å
264	K	95.1	Very high	89.8	Confident	79 Å²	79	53.3 Å²	53.3	34%	0.343	29%	0.291	S	S	.	.	H	α-helix	trans	-65.6	-39.3	176.1	-172.6	164.5	167.3	-171.5	0	112.2	F228 L229 L260 L261 T262 S267 V268	F228-K264 VanDerWaalsContact O-CE 3.31Å; F228-K264 WeakPolarHBondContact O-CE 3.46Å; F228-K264 PolarHBondContact O-NZ 3.02Å; L229-K264 HydrophobicContact CD2-CG 4.47Å; L229-K264 WeakPolarHBondContact O-CD 3.36Å; L229-K264 VanDerWaalsContact O-CE 3.27Å; L229-K264 WeakPolarHBondContact O-CE 3.45Å; L229-K264 PolarHBondContact O-NZ 2.76Å; L260-K264 WeakPolarHBondContact O-CB 3.42Å; L260-K264 PolarHBondContact O-N 3.25Å; L261-K264 PolarHBondContact O-N 3.12Å; T262-K264 VanDerWaalsContact C-N 3.3Å; T262-K264 PolarHBondContact O-N 3.19Å; K264-S267 PolarHBondContact O-N 3.32Å; K264-S267 PolarHBondContact O-OG 3Å; K264-V268 WeakPolarHBondContact O-CG2 3.4Å; K264-V268 PolarHBondContact O-N 3.28Å
265	I	95.6	Very high	89.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-46.8	173.3	-70.8	161.6	0	0	0	110.4	L19 L37 I163 I191 L229 L261 T262 S267 V268 L269	L19-I265 HydrophobicContact CD1-CG2 4.15Å; L37-I265 HydrophobicContact CD1-CD1 3.68Å; L37-I265 HydrophobicContact CD2-CD1 4.14Å; I163-I265 HydrophobicContact CD1-CD1 3.84Å; I163-I265 HydrophobicContact CD1-CG1 4.37Å; I163-I265 HydrophobicContact CD1-CG2 4.38Å; I191-I265 HydrophobicContact CG2-CG2 4.39Å; L229-I265 HydrophobicContact CD1-CD1 4.27Å; L229-I265 HydrophobicContact CD1-CG1 3.9Å; L229-I265 HydrophobicContact CD2-CG1 4.12Å; L261-I265 HydrophobicContact CG-CD1 4.23Å; L261-I265 WeakPolarHBondContact O-CG1 3.34Å; L261-I265 PolarHBondContact O-N 2.62Å; T262-I265 PolarHBondContact O-N 3.05Å; T262-I265 VanDerWaalsContact O-N 3.16Å; I265-S267 VanDerWaalsContact C-N 3.31Å; I265-S267 PolarHBondContact O-N 3.41Å; I265-V268 WeakPolarHBondContact O-CB 3.22Å; I265-V268 PolarHBondContact O-N 3.04Å; I265-L269 HydrophobicContact CG2-CD1 3.89Å; I265-L269 HydrophobicContact CG2-CG 4.45Å; I265-L269 WeakPolarHBondContact O-CG 3.47Å; I265-L269 PolarHBondContact O-N 2.88Å; I265-L269 VanDerWaalsContact O-N 3.14Å
266	L	94.4	Very high	89.8	Confident	30 Å²	30	58.2 Å²	58.2	16%	0.157	32%	0.316	C	S	.	.	H	α-helix	trans	-58	-43.2	176.7	-71.8	170.5	0	0	0	111.8	L41 F46 Y131 T262 E263 V268 L269 S270	L41-L266 HydrophobicContact CD2-CD1 4.4Å; L41-L266 HydrophobicContact CD2-CD2 3.67Å; L41-L266 HydrophobicContact CD2-CG 4.12Å; F46-L266 HydrophobicContact CE2-CD1 3.89Å; F46-L266 HydrophobicContact CE2-CD2 3.9Å; F46-L266 HydrophobicContact CZ-CD2 4.23Å; Y131-L266 HydrophobicContact CE1-CD2 4.22Å; Y131-L266 HydrophobicContact CE2-CD2 4.06Å; Y131-L266 WeakPolarHBondContact OH-CD2 3.29Å; T262-L266 HydrophobicContact CG2-CD1 4.32Å; T262-L266 WeakPolarHBondContact O-CG 3.26Å; T262-L266 PolarHBondContact O-N 3.12Å; E263-L266 PolarHBondContact O-N 2.78Å; L266-V268 PolarHBondContact O-N 2.99Å; L266-L269 PolarHBondContact O-N 3.49Å; L266-L269 VanDerWaalsContact O-N 3.11Å; L266-S270 PolarHBondContact O-N 3.39Å; L266-S270 PolarHBondContact O-OG 3.15Å
267	S	93.1	Very high	89.7	Confident	64 Å²	64	54.9 Å²	54.9	45%	0.448	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-26	177.2	78.6	0	0	0	0	113.7	E263 K264 I265 S270 V271	E263-S267 PolarHBondContact O-N 3.39Å; K264-S267 PolarHBondContact O-N 3.32Å; K264-S267 PolarHBondContact O-OG 3Å; I265-S267 VanDerWaalsContact C-N 3.31Å; I265-S267 PolarHBondContact O-N 3.41Å; S267-S270 PolarHBondContact O-OG 3.29Å; S267-V271 WeakPolarHBondContact O-CG2 3.33Å
268	V	90.7	Very high	89.6	Confident	12 Å²	12	54.4 Å²	54.4	7%	0.073	30%	0.302	C	S	.	.	H	α-helix	trans	-80.8	-35.3	176.9	167.4	0	0	0	0	111.6	I191 R227 K264 I265 L266	I191-V268 HydrophobicContact CD1-CG1 4.2Å; I191-V268 HydrophobicContact CG2-CB 4.45Å; I191-V268 HydrophobicContact CG2-CG1 3.95Å; R227-V268 VanDerWaalsContact CD-CG2 3.49Å; R227-V268 VanDerWaalsContact CZ-CG2 3.47Å; K264-V268 WeakPolarHBondContact O-CG2 3.4Å; K264-V268 PolarHBondContact O-N 3.28Å; I265-V268 WeakPolarHBondContact O-CB 3.22Å; I265-V268 PolarHBondContact O-N 3.04Å; L266-V268 PolarHBondContact O-N 2.99Å
269	L	88.2	Confident	89.4	Confident	11 Å²	11	58.2 Å²	58.2	6%	0.058	32%	0.322	C	S	.	.	H	α-helix	trans	-79.8	-24.6	-178.3	-62.7	171.6	0	0	0	112.5	L19 Y131 I191 I265 L266 V271	L19-L269 HydrophobicContact CD1-CD1 4.14Å; L19-L269 HydrophobicContact CD2-CD1 3.76Å; L19-L269 HydrophobicContact CD2-CD2 4.05Å; L19-L269 HydrophobicContact CG-CD1 4.46Å; Y131-L269 HydrophobicContact CD1-CD1 4.28Å; Y131-L269 HydrophobicContact CE1-CD1 3.64Å; I191-L269 HydrophobicContact CD1-CD2 3.61Å; I191-L269 HydrophobicContact CG1-CD2 4.39Å; I265-L269 HydrophobicContact CG2-CD1 3.89Å; I265-L269 HydrophobicContact CG2-CG 4.45Å; I265-L269 WeakPolarHBondContact O-CG 3.47Å; I265-L269 PolarHBondContact O-N 2.88Å; I265-L269 VanDerWaalsContact O-N 3.14Å; L266-L269 PolarHBondContact O-N 3.49Å; L266-L269 VanDerWaalsContact O-N 3.11Å; L269-V271 PolarHBondContact O-N 3.35Å
270	S	76.8	Confident	88.9	Confident	99 Å²	99	56.3 Å²	56.3	69%	0.692	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-2.9	175.9	58.1	0	0	0	0	114.7	L266 S267	L266-S270 PolarHBondContact O-N 3.39Å; L266-S270 PolarHBondContact O-OG 3.15Å; S267-S270 PolarHBondContact O-OG 3.29Å
271	V	50.9	Low	88.4	Confident	165 Å²	165	53.5 Å²	53.5	100%	1	31%	0.308	S	S	*	.			trans	-104.2	0	179.7	178.3	0	0	0	0	109.6	S267 L269	S267-V271 WeakPolarHBondContact O-CG2 3.33Å; L269-V271 PolarHBondContact O-N 3.35Å

Retrieved 271 of 271 residues in 396.4 ms (Link to these results)

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