G4VA20_SCHMA Loading...

Oxidized purine nucleoside triphosphate hydrolase AlphaSync

AlphaFold DB , UniProt , Accession G4VA20, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 308 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	M	36.5	Very low	44.1	Very low	239 Å²	239	120.7 Å²	120.7	100%	1.177	64%	0.643	S	S	*	*				0	100.5	0	-69.6	179.8	-137.5	0	0	106.9	V3	M1-V3 PolarHBondContact O-N 3.2Å
2	S	37.2	Very low	44.7	Very low	118 Å²	118	116.1 Å²	116.1	83%	0.825	63%	0.627	S	S	*	*			trans	-67.2	110.5	166.1	47.9	0	0	0	0	106.1	S4	S2-S4 PolarHBondContact O-N 2.95Å
3	V	34.5	Very low	45.2	Very low	130 Å²	130	108.5 Å²	108.5	79%	0.788	59%	0.589	S	S	*	*			trans	-55.3	114.3	166.5	178.4	0	0	0	0	104.9	M1 K5	M1-V3 PolarHBondContact O-N 3.2Å; V3-K5 VanDerWaalsContact C-N 3.31Å; V3-K5 PolarHBondContact O-N 2.88Å
4	S	38.6	Very low	46.2	Very low	100 Å²	100	112 Å²	112	70%	0.699	60%	0.599	S	S	*	*			trans	-54.3	105.1	168.4	49.7	0	0	0	0	105	S2 C6	S2-S4 PolarHBondContact O-N 2.95Å; S4-C6 PolarHBondContact O-N 2.86Å
5	K	40.6	Very low	47.7	Very low	160 Å²	160	105.1 Å²	105.1	70%	0.696	56%	0.562	S	S	*	*			trans	-53	106.7	162.9	-78.3	-179.5	173	-176.2	0	102.9	V3 E7	V3-K5 VanDerWaalsContact C-N 3.31Å; V3-K5 PolarHBondContact O-N 2.88Å; K5-E7 PolarHBondContact O-N 3.14Å
6	C	39.2	Very low	49.1	Very low	100 Å²	100	104.3 Å²	104.3	68%	0.676	56%	0.561	S	S	*	*			trans	-47.9	109.8	158.4	-96.7	0	0	0	0	103	S4 Y8	S4-C6 PolarHBondContact O-N 2.86Å; C6-Y8 VanDerWaalsContact C-N 3.31Å; C6-Y8 PolarHBondContact O-N 2.91Å
7	E	44.7	Very low	50.8	Low	178 Å²	178	103.9 Å²	103.9	83%	0.832	56%	0.559	S	S	*	*			trans	-45	113	159.7	-72.5	169.5	168.2	0	0	103.4	K5 S9	K5-E7 PolarHBondContact O-N 3.14Å; E7-S9 PolarHBondContact O-N 3.25Å
8	Y	49.5	Very low	52.8	Low	162 Å²	162	101.3 Å²	101.3	64%	0.635	54%	0.54	S	S	*	.			trans	-66.6	79.7	179.1	-73.8	-89.5	0	0	0	104.9	C6 P10	C6-Y8 VanDerWaalsContact C-N 3.31Å; C6-Y8 PolarHBondContact O-N 2.91Å; Y8-P10 WeakPolarHBondContact O-CD 3.35Å; Y8-P10 VanDerWaalsContact O-N 3.13Å
9	S	56.2	Low	54.8	Low	46 Å²	46	98.9 Å²	98.9	32%	0.322	52%	0.524	S	S	.	.			trans	-59.5	122.6	173.3	172.6	0	0	0	0	103.8	E7 F11 S12	E7-S9 PolarHBondContact O-N 3.25Å; S9-F11 PolarHBondContact O-N 2.83Å; S9-F11 WeakPolarHBondContact OG-CD2 3.48Å; S9-S12 WeakPolarHBondContact O-CA 3.35Å; S9-S12 VanDerWaalsContact O-CB 3.29Å; S9-S12 WeakPolarHBondContact O-CB 3.43Å; S9-S12 PolarHBondContact O-N 2.58Å; S9-S12 PolarHBondContact O-OG 3.42Å
10	P	54.1	Low	56.9	Low	4 Å²	4	97.3 Å²	97.3	3%	0.026	52%	0.515	C	S	.	.	G	3₁₀ helix	trans	-59.2	-24.2	-179.9	22.9	-31.3	0	0	0	110.6	Y8 S12 S13 W201 H203 A237 P307	Y8-P10 WeakPolarHBondContact O-CD 3.35Å; Y8-P10 VanDerWaalsContact O-N 3.13Å; P10-S12 VanDerWaalsContact C-N 3.32Å; P10-S13 PolarHBondContact O-N 3.47Å; P10-W201 HydrophobicContact CB-CH2 4.03Å; P10-W201 HydrophobicContact CB-CZ2 4.45Å; P10-H203 HydrophobicContact CB-CB 3.86Å; P10-H203 WeakPolarHBondContact CB-CD2 3.26Å; P10-A237 HydrophobicContact CB-CB 3.65Å; P10-A237 HydrophobicContact CG-CB 3.4Å; P10-P307 HydrophobicContact CG-CG 3.84Å
11	F	54	Low	58.8	Low	91 Å²	91	94.9 Å²	94.9	40%	0.399	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-72.8	-18.5	171.1	-50.2	-69.8	0	0	0	114.6	S9 S13 Y306	S9-F11 PolarHBondContact O-N 2.83Å; S9-F11 WeakPolarHBondContact OG-CD2 3.48Å; F11-S13 VanDerWaalsContact C-N 3.3Å; F11-Y306 HydrophobicContact CE1-CD1 4.04Å; F11-Y306 AromaticContact CE1-CE1 3.71Å; F11-Y306 HydrophobicContact CE1-CE1 3.71Å; F11-Y306 HydrophobicContact CE2-CD1 4.09Å; F11-Y306 HydrophobicContact CE2-CE1 4.5Å; F11-Y306 AromaticContact CZ-CD1 3.26Å; F11-Y306 HydrophobicContact CZ-CD1 3.26Å; F11-Y306 AromaticContact CZ-CE1 3.32Å; F11-Y306 HydrophobicContact CZ-CE1 3.32Å; F11-Y306 HydrophobicContact CZ-CG 4.13Å
12	S	51.2	Low	61.8	Low	65 Å²	65	83.9 Å²	83.9	46%	0.455	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-81.9	-5.2	175	74.4	0	0	0	0	113.5	S9 P10 Q14	S9-S12 WeakPolarHBondContact O-CA 3.35Å; S9-S12 VanDerWaalsContact O-CB 3.29Å; S9-S12 WeakPolarHBondContact O-CB 3.43Å; S9-S12 PolarHBondContact O-N 2.58Å; S9-S12 PolarHBondContact O-OG 3.42Å; P10-S12 VanDerWaalsContact C-N 3.32Å; S12-Q14 VanDerWaalsContact C-N 3.3Å; S12-Q14 PolarHBondContact O-N 3.14Å
13	S	51	Low	64.7	Low	18 Å²	18	78.9 Å²	78.9	13%	0.126	41%	0.41	C	S	.	.			trans	-60.9	95.7	171	-177.3	0	0	0	0	109.3	P10 F11 W15 R281	P10-S13 PolarHBondContact O-N 3.47Å; F11-S13 VanDerWaalsContact C-N 3.3Å; S13-W15 PolarHBondContact O-N 2.99Å; S13-R281 PolarHBondContact O-NH1 2.84Å
14	Q	59.1	Low	67.8	Low	157 Å²	157	72.7 Å²	72.7	73%	0.734	37%	0.372	S	S	*	.			trans	-80.9	70.2	173.3	-67	-174.7	3.2	0	0	107.9	S12 V16	S12-Q14 VanDerWaalsContact C-N 3.3Å; S12-Q14 PolarHBondContact O-N 3.14Å; Q14-V16 PolarHBondContact O-N 3.12Å
15	W	69.5	Low	70.6	Confident	9 Å²	9	68.1 Å²	68.1	3%	0.034	34%	0.34	C	S	.	.			trans	-63.9	137.6	169.4	53.3	-96.8	0	0	0	109.7	S13 T120 T125 C127 D277 L280 R281	S13-W15 PolarHBondContact O-N 2.99Å; W15-T120 HydrophobicContact CG-CG2 4.35Å; W15-T125 CarbonylContact C-O 3.51Å; W15-T125 WeakPolarHBondContact CA-O 3.35Å; W15-T125 VanDerWaalsContact CB-O 3.27Å; W15-T125 WeakPolarHBondContact CB-O 3.36Å; W15-C127 HydrophobicContact CB-CB 4.04Å; W15-C127 HydrophobicContact CD2-CB 3.65Å; W15-C127 HydrophobicContact CE3-CB 3.9Å; W15-C127 HydrophobicContact CG-CB 3.74Å; W15-D277 HydrophobicContact CH2-CB 3.37Å; W15-D277 VanDerWaalsContact CH2-OD1 3.26Å; W15-D277 WeakPolarHBondContact CH2-OD1 3.44Å; W15-D277 HydrophobicContact CZ2-CB 4.22Å; W15-D277 HydrophobicContact CZ3-CB 3.89Å; W15-D277 WeakPolarHBondContact CZ3-OD2 3.45Å; W15-L280 HydrophobicContact CH2-CD2 4.2Å; W15-L280 HydrophobicContact CZ2-CD2 4.09Å; W15-R281 VanDerWaalsContact CE2-CZ 3.43Å; W15-R281 HydrophobicContact CZ2-CG 4.1Å; W15-R281 PolarHBondContact O-NH2 2.9Å
16	V	69.6	Low	73.4	Confident	92 Å²	92	60.5 Å²	60.5	56%	0.558	31%	0.307	S	S	*	.			trans	-111.8	-19.5	-173.9	-62	0	0	0	0	112.3	Q14 T125	Q14-V16 PolarHBondContact O-N 3.12Å; V16-T125 PolarHBondContact N-O 2.89Å
17	N	77.8	Confident	76.1	Confident	98 Å²	98	56.1 Å²	56.1	52%	0.524	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	137.5	179.7	-66.1	-39.3	0	0	0	110.2	C127	N17-C127 PolarHBondContact O-N 3.12Å
18	R	86.6	Confident	78.3	Confident	56 Å²	56	47.8 Å²	47.8	21%	0.211	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	128.7	172.1	-171.3	169.5	175.1	-180	-9.2	108.4	C127 E129 L273 D274	R18-C127 CarbonylContact C-O 3.48Å; R18-C127 WeakPolarHBondContact CA-O 3.15Å; R18-E129 HydrophobicContact CG-CB 4.14Å; R18-E129 IonicContact CZ-OE1 2.65Å; R18-E129 IonicContact CZ-OE2 2.87Å; R18-E129 IonicContact NE-OE1 3.63Å; R18-E129 IonicContact NE-OE2 3.05Å; R18-E129 PolarHBondContact NE-OE2 2.89Å; R18-E129 IonicContact NH2-OE1 3.52Å; R18-E129 PolarHBondContact NH2-OE1 3.12Å; R18-E129 IonicContact NH2-OE2 3.86Å; R18-E129 PolarHBondContact NH2-OE2 3.29Å; R18-L273 PolarHBondContact NH1-O 2.97Å; R18-D274 IonicContact NH2-OD1 3.94Å; R18-D274 PolarHBondContact NH2-OD1 3.39Å
19	K	92.2	Very high	80.1	Confident	57 Å²	57	43 Å²	43	25%	0.248	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134	175.8	-75.4	-175.1	-179.7	168.7	0	109.3	Y21 E126 C127 E129	K19-Y21 HydrophobicContact CB-CD2 4.22Å; K19-Y21 HydrophobicContact CB-CE2 3.52Å; K19-Y21 HydrophobicContact CD-CE2 4.41Å; K19-Y21 WeakPolarHBondContact O-CD2 3.29Å; K19-E126 VanDerWaalsContact CE-CD 3.44Å; K19-E126 WeakPolarHBondContact CE-OE1 3.15Å; K19-E126 WeakPolarHBondContact CE-OE2 3.42Å; K19-E126 IonicContact NZ-OE1 3.88Å; K19-E126 PolarHBondContact NZ-OE1 2.83Å; K19-E126 IonicContact NZ-OE2 2.73Å; K19-E126 PolarHBondContact NZ-OE2 3.45Å; K19-C127 PolarHBondContact N-O 2.91Å; K19-E129 PolarHBondContact O-N 3.42Å
20	L	95.4	Very high	81.3	Confident	66 Å²	66	43 Å²	43	35%	0.346	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	133.3	179.5	-59	-176.5	0	0	0	110.6	V83 E129	L20-V83 HydrophobicContact CB-CB 3.83Å; L20-V83 HydrophobicContact CB-CG2 3.72Å; L20-V83 PolarHBondContact O-N 2.92Å; L20-E129 CarbonylContact C-O 3.52Å; L20-E129 WeakPolarHBondContact CA-O 3.45Å; L20-E129 HydrophobicContact CD2-CB 4.07Å; L20-E129 HydrophobicContact CD2-CG 4.02Å; L20-E129 WeakPolarHBondContact CD2-OE2 3.44Å
21	Y	98.1	Very high	82.1	Confident	47 Å²	47	45.6 Å²	45.6	18%	0.184	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	167.7	176.4	-68.4	-93.3	0	0	0	109.3	K19 G81 K82 M128 E129 V130 H131	K19-Y21 HydrophobicContact CB-CD2 4.22Å; K19-Y21 HydrophobicContact CB-CE2 3.52Å; K19-Y21 HydrophobicContact CD-CE2 4.41Å; K19-Y21 WeakPolarHBondContact O-CD2 3.29Å; Y21-G81 CarbonylContact C-O 3.54Å; Y21-G81 WeakPolarHBondContact CA-O 3.42Å; Y21-K82 HydrophobicContact CD1-CB 3.86Å; Y21-K82 HydrophobicContact CD1-CG 4.32Å; Y21-K82 HydrophobicContact CE1-CB 3.63Å; Y21-K82 HydrophobicContact CE1-CD 4.5Å; Y21-K82 HydrophobicContact CE1-CG 3.96Å; Y21-M128 HydrophobicContact CD1-CE 4.02Å; Y21-M128 HydrophobicContact CD2-CB 3.88Å; Y21-M128 HydrophobicContact CD2-CE 3.76Å; Y21-M128 HydrophobicContact CD2-CG 4.07Å; Y21-M128 HydrophobicContact CE1-CE 4.03Å; Y21-M128 HydrophobicContact CE2-CB 3.97Å; Y21-M128 HydrophobicContact CE2-CE 3.74Å; Y21-M128 HydrophobicContact CE2-CG 3.65Å; Y21-M128 HydrophobicContact CE2-SD 4.29Å; Y21-M128 HydrophobicContact CG-CE 3.91Å; Y21-E129 PolarHBondContact N-O 2.74Å; Y21-V130 WeakPolarHBondContact O-CA 3.24Å; Y21-H131 PolarHBondContact O-N 2.87Å
22	T	98.5	Very high	82.5	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.043	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	156.4	178.7	62.1	0	0	0	0	110.8	G80 G81 V83 P90 A93 A94 H131 F133	T22-G80 WeakPolarHBondContact O-CA 3.49Å; T22-G81 PolarHBondContact N-O 2.91Å; T22-G81 PolarHBondContact OG1-N 3.27Å; T22-G81 PolarHBondContact OG1-O 2.93Å; T22-V83 HydrophobicContact CG2-CG2 3.81Å; T22-P90 HydrophobicContact CG2-CB 4.28Å; T22-P90 WeakPolarHBondContact CG2-O 3.31Å; T22-A93 HydrophobicContact CG2-CB 3.95Å; T22-A94 HydrophobicContact CG2-CB 3.98Å; T22-H131 CarbonylContact C-O 3.4Å; T22-H131 WeakPolarHBondContact CA-O 3.45Å; T22-F133 HydrophobicContact CG2-CE2 4.19Å
23	L	98.7	Very high	82.8	Confident	14 Å²	14	55.4 Å²	55.4	7%	0.073	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	132.8	168.8	-172.5	66.6	0	0	0	108.9	G78 F79 V130 H131 V132 F133 W188	L23-G78 VanDerWaalsContact CD1-C 3.49Å; L23-F79 CarbonylContact C-O 3.47Å; L23-F79 WeakPolarHBondContact CA-O 3.46Å; L23-V130 HydrophobicContact CB-CG1 3.64Å; L23-H131 PolarHBondContact N-O 2.96Å; L23-V132 CarbonylContact O-C 3.58Å; L23-V132 WeakPolarHBondContact O-CA 3.27Å; L23-F133 PolarHBondContact O-N 2.9Å; L23-W188 HydrophobicContact CD2-CH2 3.45Å; L23-W188 VanDerWaalsContact CD2-CH2 3.45Å; L23-W188 HydrophobicContact CD2-CZ2 3.67Å
24	M	98.7	Very high	83.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122.8	-175.3	-178.2	69.7	73.1	0	0	109.3	V26 F79 A94 L95 L98 V111 F133	M24-V26 HydrophobicContact CG-CG2 3.94Å; M24-F79 HydrophobicContact CB-CB 4.4Å; M24-F79 WeakPolarHBondContact CB-O 3.46Å; M24-F79 PolarHBondContact N-O 2.75Å; M24-F79 PolarHBondContact O-N 3.37Å; M24-A94 HydrophobicContact CE-CB 3.72Å; M24-L95 HydrophobicContact CE-CD2 4.41Å; M24-L98 HydrophobicContact CG-CD1 4.41Å; M24-L98 HydrophobicContact CG-CD2 4.21Å; M24-V111 HydrophobicContact CE-CB 4.43Å; M24-V111 HydrophobicContact CE-CG1 3.46Å; M24-V111 VanDerWaalsContact CE-CG1 3.46Å; M24-V111 HydrophobicContact CE-CG2 4.07Å; M24-V111 HydrophobicContact SD-CG1 3.84Å; M24-V111 HydrophobicContact SD-CG2 4.37Å; M24-F133 WeakPolarHBondContact CA-O 3.49Å; M24-F133 HydrophobicContact CE-CB 3.63Å; M24-F133 HydrophobicContact CE-CG 4.3Å; M24-F133 HydrophobicContact SD-CB 3.58Å; M24-F133 VanDerWaalsContact SD-CB 3.58Å
25	L	98.8	Very high	82.9	Confident	3 Å²	3	56 Å²	56	2%	0.016	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	132.6	168.6	-59.9	-177.2	0	0	0	109.2	L62 F133 I134 C135 W188 V192	L25-L62 HydrophobicContact CB-CD1 4.07Å; L25-L62 HydrophobicContact CD2-CD1 4.39Å; L25-F133 PolarHBondContact N-O 3.21Å; L25-I134 HydrophobicContact CB-CB 4.33Å; L25-I134 HydrophobicContact CB-CD1 4.11Å; L25-I134 HydrophobicContact CB-CG1 3.92Å; L25-I134 HydrophobicContact CD1-CD1 4.43Å; L25-I134 CarbonylContact O-C 3.56Å; L25-I134 VanDerWaalsContact O-CA 3.28Å; L25-I134 WeakPolarHBondContact O-CA 3.2Å; L25-C135 PolarHBondContact O-N 3.41Å; L25-W188 HydrophobicContact CD1-CH2 4.47Å; L25-W188 HydrophobicContact CD1-CZ3 4.11Å; L25-V192 HydrophobicContact CD1-CG1 4.15Å
26	V	98.3	Very high	82.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.2	179.5	-177	0	0	0	0	109.2	M24 L63 L98 L104 I106 W138 W160	M24-V26 HydrophobicContact CG-CG2 3.94Å; V26-L63 HydrophobicContact CB-CB 4.13Å; V26-L63 PolarHBondContact O-N 3.06Å; V26-L98 HydrophobicContact CG2-CD1 3.87Å; V26-L98 HydrophobicContact CG2-CD2 4.06Å; V26-L104 HydrophobicContact CG1-CD1 4.43Å; V26-I106 HydrophobicContact CG1-CD1 4.03Å; V26-I106 HydrophobicContact CG2-CD1 3.94Å; V26-W138 HydrophobicContact CG1-CB 3.57Å; V26-W138 HydrophobicContact CG1-CD2 4.33Å; V26-W138 HydrophobicContact CG1-CG 3.76Å; V26-W160 HydrophobicContact CG1-CH2 4.39Å
27	I	95.8	Very high	83.1	Confident	9 Å²	9	58.8 Å²	58.8	5%	0.046	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.5	177.3	-58.3	177.5	0	0	0	109.4	W61 L62 I134 C135 W138 L163 L193	I27-W61 CarbonylContact C-O 3.45Å; I27-W61 VanDerWaalsContact CA-O 3.27Å; I27-W61 WeakPolarHBondContact CA-O 3.29Å; I27-L62 HydrophobicContact CG1-CD1 4.13Å; I27-I134 HydrophobicContact CD1-CD1 3.93Å; I27-I134 HydrophobicContact CG1-CD1 4.48Å; I27-C135 PolarHBondContact N-O 3.27Å; I27-W138 WeakPolarHBondContact O-CB 3.41Å; I27-W138 PolarHBondContact O-N 2.85Å; I27-L163 HydrophobicContact CD1-CD1 4.18Å; I27-L163 HydrophobicContact CG1-CD1 4.35Å; I27-L193 HydrophobicContact CD1-CD2 3.73Å; I27-L193 HydrophobicContact CG1-CD2 4.46Å
28	Y	91.5	Very high	83.6	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.008	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.5	167.6	173.5	-117.1	0	0	0	109.7	P30 P38 S60 W61 W138 P140 W149 W160	Y28-P30 HydrophobicContact CD1-CG 4.27Å; Y28-P30 HydrophobicContact CE1-CB 4.28Å; Y28-P30 HydrophobicContact CE1-CG 3.64Å; Y28-P38 HydrophobicContact CD1-CB 3.56Å; Y28-P38 HydrophobicContact CD1-CG 3.94Å; Y28-P38 HydrophobicContact CE1-CB 3.74Å; Y28-P38 HydrophobicContact CE1-CG 4.21Å; Y28-S60 CarbonylContact O-C 3.52Å; Y28-S60 VanDerWaalsContact O-CA 3.28Å; Y28-S60 WeakPolarHBondContact O-CA 3.17Å; Y28-W61 PolarHBondContact N-O 2.78Å; Y28-W61 PolarHBondContact O-N 2.75Å; Y28-W138 AromaticContact CD2-CE3 3.83Å; Y28-W138 HydrophobicContact CD2-CE3 3.83Å; Y28-W138 AromaticContact CD2-CZ3 3.98Å; Y28-W138 HydrophobicContact CD2-CZ3 3.98Å; Y28-W138 WeakPolarHBondContact CD2-O 3.39Å; Y28-W138 HydrophobicContact CG-CE3 4.24Å; Y28-W138 HydrophobicContact CG-CZ3 4.36Å; Y28-P140 HydrophobicContact CE2-CG 4.02Å; Y28-W149 HydrophobicContact CE1-CH2 4.15Å; Y28-W149 HydrophobicContact CE1-CZ3 4.49Å; Y28-W149 HydrophobicContact CE2-CH2 4.44Å; Y28-W149 AromaticContact CZ-CH2 3.99Å; Y28-W160 VanDerWaalsContact CB-CZ3 3.47Å
29	T	87.7	Confident	83.8	Confident	61 Å²	61	52.2 Å²	52.2	37%	0.374	28%	0.277	S	S	.	.			trans	-120.9	114.5	169.2	-55.9	0	0	0	0	107.7	S31 S60	T29-S31 PolarHBondContact O-N 2.85Å; T29-S60 WeakPolarHBondContact OG1-CB 3.47Å; T29-S60 PolarHBondContact OG1-OG 3.33Å
30	P	80.4	Confident	83.9	Confident	47 Å²	47	49.7 Å²	49.7	31%	0.305	27%	0.266	S	S	.	.			trans	-54.1	137.9	176.5	-22.1	31.1	0	0	0	111	Y28 K59	Y28-P30 HydrophobicContact CD1-CG 4.27Å; Y28-P30 HydrophobicContact CE1-CB 4.28Å; Y28-P30 HydrophobicContact CE1-CG 3.64Å; P30-K59 WeakPolarHBondContact CD-O 3.25Å
31	S	71.9	Confident	83.9	Confident	58 Å²	58	48.4 Å²	48.4	41%	0.406	26%	0.259	S	S	.	.			trans	-98.8	161.5	171.3	73.7	0	0	0	0	109.8	T29 L33 I34	T29-S31 PolarHBondContact O-N 2.85Å; S31-L33 PolarHBondContact O-N 2.88Å; S31-I34 CarbonylContact O-C 3.5Å; S31-I34 PolarHBondContact O-N 3.18Å
32	E	62.2	Low	83.7	Confident	197 Å²	197	47.8 Å²	47.8	92%	0.921	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-22.7	179.9	-61.7	-172.5	174.4	0	0	114.2
33	L	56.9	Low	83.3	Confident	166 Å²	166	54.3 Å²	54.3	87%	0.869	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-15.9	-178.4	-65.1	169.6	0	0	0	113.9	S31	S31-L33 PolarHBondContact O-N 2.88Å
34	I	57.9	Low	83	Confident	60 Å²	60	57.6 Å²	57.6	31%	0.308	32%	0.318	S	S	.	.			trans	-123.1	103.1	-179.2	-58.9	173.7	0	0	0	107	S31	S31-I34 CarbonylContact O-C 3.5Å; S31-I34 PolarHBondContact O-N 3.18Å
35	T	55.1	Low	82.5	Confident	127 Å²	127	60 Å²	60	78%	0.779	34%	0.343	S	S	*	.			trans	-92.4	4.7	-174.3	49.8	0	0	0	0	113.8
36	D	65.5	Low	82.2	Confident	105 Å²	105	62.8 Å²	62.8	56%	0.561	36%	0.362	S	S	*	.	S	Bend	trans	-94.2	151.2	-175.7	-69.3	-48.3	0	0	0	113.1
37	F	77.7	Confident	81.8	Confident	54 Å²	54	68.9 Å²	68.9	24%	0.237	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-62.1	145.7	168.1	-64.5	-88.5	0	0	0	110	E52 T55 W61	F37-E52 HydrophobicContact CE2-CG 4.41Å; F37-E52 HydrophobicContact CZ-CB 4.42Å; F37-T55 HydrophobicContact CZ-CG2 4.26Å; F37-W61 HydrophobicContact CD1-CZ2 4.11Å
38	P	88.2	Confident	81.5	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-64.8	143.2	178.1	29.1	-34.7	0	0	0	111.4	Y28 A50 W61 W149 W160	Y28-P38 HydrophobicContact CD1-CB 3.56Å; Y28-P38 HydrophobicContact CD1-CG 3.94Å; Y28-P38 HydrophobicContact CE1-CB 3.74Å; Y28-P38 HydrophobicContact CE1-CG 4.21Å; P38-A50 HydrophobicContact CG-CB 3.97Å; P38-A50 PolarHBondContact O-N 3.16Å; P38-A50 VanDerWaalsContact O-N 3.12Å; P38-W61 HydrophobicContact CG-CB 4.17Å; P38-W61 HydrophobicContact CG-CD2 3.7Å; P38-W61 HydrophobicContact CG-CE3 4.27Å; P38-W61 HydrophobicContact CG-CG 3.63Å; P38-W149 HydrophobicContact CB-CE3 4.48Å; P38-W149 HydrophobicContact CB-CH2 3.97Å; P38-W149 HydrophobicContact CB-CZ3 3.6Å; P38-W160 HydrophobicContact CB-CB 4.37Å; P38-W160 HydrophobicContact CB-CD2 3.88Å; P38-W160 HydrophobicContact CB-CG 3.68Å; P38-W160 HydrophobicContact CG-CB 3.81Å; P38-W160 HydrophobicContact CG-CD2 4.15Å; P38-W160 HydrophobicContact CG-CG 3.68Å
39	L	91.1	Very high	81.2	Confident	16 Å²	16	76.9 Å²	76.9	8%	0.084	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	157.6	-177.3	-50.6	-179	0	0	0	111.1	E47 I48 K49 W149 W160	L39-E47 HydrophobicContact CD1-CB 4.35Å; L39-E47 HydrophobicContact CD1-CG 4.12Å; L39-I48 WeakPolarHBondContact CA-O 3.37Å; L39-K49 HydrophobicContact CD2-CB 4.24Å; L39-K49 HydrophobicContact CD2-CD 4.35Å; L39-K49 HydrophobicContact CD2-CG 3.33Å; L39-W149 HydrophobicContact CB-CB 4.32Å; L39-W149 HydrophobicContact CB-CD2 3.77Å; L39-W149 HydrophobicContact CB-CE3 4.38Å; L39-W149 HydrophobicContact CB-CG 3.72Å; L39-W149 HydrophobicContact CG-CD2 4.33Å; L39-W149 HydrophobicContact CG-CG 4.48Å; L39-W149 HydrophobicContact CG-CZ2 4.36Å; L39-W149 VanDerWaalsContact O-CE3 3.27Å; L39-W160 PolarHBondContact O-NE1 2.8Å
40	V	93.9	Very high	81	Confident	4 Å²	4	74.5 Å²	74.5	2%	0.024	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.5	161.7	-177.4	0	0	0	0	107.7	I48 P150 Y152 P158	V40-I48 PolarHBondContact N-O 3.12Å; V40-I48 PolarHBondContact O-N 3.02Å; V40-P150 CarbonylContact C-O 3.59Å; V40-P150 VanDerWaalsContact CA-O 3.27Å; V40-P150 WeakPolarHBondContact CA-O 3.22Å; V40-P150 WeakPolarHBondContact CG1-O 3.38Å; V40-P150 HydrophobicContact CG2-CG 4.19Å; V40-Y152 HydrophobicContact CG1-CD1 3.83Å; V40-Y152 HydrophobicContact CG1-CE1 3.81Å; V40-P158 HydrophobicContact CG1-CB 4.05Å; V40-P158 WeakPolarHBondContact CG1-O 3.46Å; V40-P158 HydrophobicContact CG2-CB 4.44Å
41	I	94.4	Very high	80.4	Confident	40 Å²	40	80.5 Å²	80.5	21%	0.205	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	124.8	175.6	-49	-55.6	0	0	0	109.3	S46 E47 W149 P150 C151 Y152	I41-S46 WeakPolarHBondContact CA-O 3.34Å; I41-E47 HydrophobicContact CD1-CB 4.48Å; I41-E47 HydrophobicContact CD1-CG 3.73Å; I41-W149 HydrophobicContact CD1-CB 4.35Å; I41-W149 HydrophobicContact CG1-CB 4.16Å; I41-P150 PolarHBondContact N-O 3.17Å; I41-C151 HydrophobicContact CB-CB 3.99Å; I41-C151 CarbonylContact O-C 3.44Å; I41-C151 WeakPolarHBondContact O-CA 3.47Å; I41-Y152 PolarHBondContact O-N 3.35Å
42	D	94.6	Very high	79.8	Confident	34 Å²	34	83.9 Å²	83.9	18%	0.182	45%	0.447	C	S	.	.			trans	-77.9	178.3	175.3	75	14.4	0	0	0	112.8	S44 G45 S46 I48 Y152	D42-S44 PolarHBondContact O-N 3.11Å; D42-S44 WeakPolarHBondContact OD1-CA 3.46Å; D42-S44 WeakPolarHBondContact OD1-CB 3.45Å; D42-S44 PolarHBondContact OD1-N 3.41Å; D42-S44 PolarHBondContact OD1-OG 3.45Å; D42-S44 PolarHBondContact OD2-OG 3.3Å; D42-G45 PolarHBondContact O-N 2.79Å; D42-G45 PolarHBondContact OD1-N 2.92Å; D42-G45 VanDerWaalsContact OD1-N 3.14Å; D42-S46 PolarHBondContact N-O 3.23Å; D42-S46 WeakPolarHBondContact OD1-CB 3.33Å; D42-S46 PolarHBondContact OD1-N 3.28Å; D42-S46 WeakPolarHBondContact OD2-CB 3.39Å; D42-I48 HydrophobicContact CB-CD1 3.81Å; D42-I48 HydrophobicContact CB-CG1 4.33Å; D42-Y152 HydrophobicContact CB-CD2 4.11Å; D42-Y152 HydrophobicContact CB-CE2 4.23Å; D42-Y152 HydrophobicContact CB-CG 4.38Å
43	D	89.6	Confident	79.3	Confident	143 Å²	143	79.6 Å²	79.6	77%	0.765	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.8	-179.7	63.8	-24.8	0	0	0	113.8	G45	D43-G45 VanDerWaalsContact C-N 3.32Å
44	S	92.6	Very high	79.1	Confident	84 Å²	84	76.4 Å²	76.4	59%	0.587	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-7.9	173.9	80.2	0	0	0	0	113.6	D42 S46	D42-S44 PolarHBondContact O-N 3.11Å; D42-S44 WeakPolarHBondContact OD1-CA 3.46Å; D42-S44 WeakPolarHBondContact OD1-CB 3.45Å; D42-S44 PolarHBondContact OD1-N 3.41Å; D42-S44 PolarHBondContact OD1-OG 3.45Å; D42-S44 PolarHBondContact OD2-OG 3.3Å; S44-S46 WeakPolarHBondContact OG-CB 3.24Å; S44-S46 PolarHBondContact OG-N 2.92Å; S44-S46 PolarHBondContact OG-OG 3.24Å
45	G	88.3	Confident	78.8	Confident	51 Å²	51	79.6 Å²	79.6	53%	0.526	45%	0.445	S	S	.	.	S	Bend	trans	84.4	10.5	-171.8	0	0	0	0	0	113.8	D42 D43	D42-G45 PolarHBondContact O-N 2.79Å; D42-G45 PolarHBondContact OD1-N 2.92Å; D42-G45 VanDerWaalsContact OD1-N 3.14Å; D43-G45 VanDerWaalsContact C-N 3.32Å
46	S	92.2	Very high	78.8	Confident	60 Å²	60	77.7 Å²	77.7	42%	0.42	43%	0.43	S	S	.	.			trans	-82.5	143.4	179.4	-58.8	0	0	0	0	111.2	I41 D42 S44	I41-S46 WeakPolarHBondContact CA-O 3.34Å; D42-S46 PolarHBondContact N-O 3.23Å; D42-S46 WeakPolarHBondContact OD1-CB 3.33Å; D42-S46 PolarHBondContact OD1-N 3.28Å; D42-S46 WeakPolarHBondContact OD2-CB 3.39Å; S44-S46 WeakPolarHBondContact OG-CB 3.24Å; S44-S46 PolarHBondContact OG-N 2.92Å; S44-S46 PolarHBondContact OG-OG 3.24Å
47	E	90.2	Very high	78.4	Confident	128 Å²	128	78.2 Å²	78.2	60%	0.598	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	119	177.9	-65.7	176.3	176.1	0	0	111.4	L39 I41	L39-E47 HydrophobicContact CD1-CB 4.35Å; L39-E47 HydrophobicContact CD1-CG 4.12Å; I41-E47 HydrophobicContact CD1-CB 4.48Å; I41-E47 HydrophobicContact CD1-CG 3.73Å
48	I	90	Very high	77.8	Confident	66 Å²	66	80.3 Å²	80.3	34%	0.338	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	115.2	169.5	-58.2	177.9	0	0	0	108.4	L39 V40 D42 Y152	L39-I48 WeakPolarHBondContact CA-O 3.37Å; V40-I48 PolarHBondContact N-O 3.12Å; V40-I48 PolarHBondContact O-N 3.02Å; D42-I48 HydrophobicContact CB-CD1 3.81Å; D42-I48 HydrophobicContact CB-CG1 4.33Å; I48-Y152 HydrophobicContact CD1-CE1 4.24Å; I48-Y152 HydrophobicContact CD1-CE2 4.45Å
49	K	85.1	Confident	77.3	Confident	114 Å²	114	81.2 Å²	81.2	50%	0.496	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	139.5	174.6	-73.8	176.9	-179.9	-167.7	0	110.8	L39	L39-K49 HydrophobicContact CD2-CB 4.24Å; L39-K49 HydrophobicContact CD2-CD 4.35Å; L39-K49 HydrophobicContact CD2-CG 3.33Å
50	A	83.2	Confident	77.2	Confident	11 Å²	11	81 Å²	81	9%	0.091	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-56.3	140.4	165.8	0	0	0	0	0	110.2	P38 E52 W61 W160	P38-A50 HydrophobicContact CG-CB 3.97Å; P38-A50 PolarHBondContact O-N 3.16Å; P38-A50 VanDerWaalsContact O-N 3.12Å; A50-E52 PolarHBondContact O-N 2.9Å; A50-W61 HydrophobicContact CB-CE3 3.98Å; A50-W61 HydrophobicContact CB-CH2 3.67Å; A50-W61 HydrophobicContact CB-CZ2 4.33Å; A50-W61 HydrophobicContact CB-CZ3 3.47Å; A50-W61 VanDerWaalsContact CB-CZ3 3.47Å; A50-W160 HydrophobicContact CB-CB 3.98Å
51	Q	68.8	Low	77.2	Confident	172 Å²	172	81.3 Å²	81.3	80%	0.804	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-57.2	126.5	-173.3	-74	-174	-9.9	0	0	111.8	S53	Q51-S53 PolarHBondContact O-N 2.99Å
52	E	58.4	Low	77.3	Confident	129 Å²	129	79.4 Å²	79.4	60%	0.603	45%	0.449	S	S	*	.			trans	-67.7	3.4	-167.2	-65.2	-177.5	164.2	0	0	115.6	F37 A50 I54	F37-E52 HydrophobicContact CE2-CG 4.41Å; F37-E52 HydrophobicContact CZ-CB 4.42Å; A50-E52 PolarHBondContact O-N 2.9Å; E52-I54 PolarHBondContact O-N 3.04Å
53	S	52.3	Low	77.4	Confident	108 Å²	108	77.8 Å²	77.8	76%	0.755	44%	0.44	S	S	*	.	S	Bend	trans	-53.4	-27.5	-152.6	-172	0	0	0	0	115.5	Q51	Q51-S53 PolarHBondContact O-N 2.99Å
54	I	52.5	Low	77.9	Confident	98 Å²	98	71 Å²	71	50%	0.503	40%	0.404	S	S	.	.			trans	-150.1	128	177.7	-61.1	176.1	0	0	0	111.4	E52 D56 K59	E52-I54 PolarHBondContact O-N 3.04Å; I54-D56 HydrophobicContact CG2-CB 4.25Å; I54-D56 PolarHBondContact O-N 2.8Å; I54-K59 WeakPolarHBondContact O-CE 3.3Å; I54-K59 PolarHBondContact O-NZ 3Å
55	T	50.9	Low	78.2	Confident	127 Å²	127	67 Å²	67	78%	0.779	38%	0.376	S	S	*	.			trans	-87.1	39	-174.6	55.8	0	0	0	0	115.5	F37	F37-T55 HydrophobicContact CZ-CG2 4.26Å
56	D	55.8	Low	78.6	Confident	87 Å²	87	64.7 Å²	64.7	47%	0.465	35%	0.352	S	S	.	.			trans	-84.8	141	-174.3	-153.8	-7.8	0	0	0	112.8	I54 N58 K59	I54-D56 HydrophobicContact CG2-CB 4.25Å; I54-D56 PolarHBondContact O-N 2.8Å; D56-N58 VanDerWaalsContact C-N 3.3Å; D56-N58 PolarHBondContact O-N 3.41Å; D56-K59 HydrophobicContact CB-CD 4.3Å; D56-K59 HydrophobicContact CB-CG 4.3Å; D56-K59 WeakPolarHBondContact O-CG 3.41Å
57	C	55.8	Low	78.9	Confident	116 Å²	116	62.7 Å²	62.7	78%	0.784	34%	0.335	S	S	*	.	S	Bend	trans	-75.8	-13.7	-175.1	55.8	0	0	0	0	114.1	K59	C57-K59 VanDerWaalsContact C-N 3.34Å; C57-K59 PolarHBondContact O-N 2.87Å
58	N	66	Low	79.3	Confident	98 Å²	98	58.5 Å²	58.5	52%	0.524	32%	0.316	S	S	.	.	S	Bend	trans	-97.6	43.3	179.5	-71	-20.8	0	0	0	112.6	D56 I165	D56-N58 VanDerWaalsContact C-N 3.3Å; D56-N58 PolarHBondContact O-N 3.41Å; N58-I165 PolarHBondContact O-N 3.25Å
59	K	77.6	Confident	79.6	Confident	20 Å²	20	57.8 Å²	57.8	9%	0.087	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.9	-175.5	-72	-173.3	171.4	-160.3	0	112.2	P30 I54 D56 C57 I164	P30-K59 WeakPolarHBondContact CD-O 3.25Å; I54-K59 WeakPolarHBondContact O-CE 3.3Å; I54-K59 PolarHBondContact O-NZ 3Å; D56-K59 HydrophobicContact CB-CD 4.3Å; D56-K59 HydrophobicContact CB-CG 4.3Å; D56-K59 WeakPolarHBondContact O-CG 3.41Å; C57-K59 VanDerWaalsContact C-N 3.34Å; C57-K59 PolarHBondContact O-N 2.87Å; K59-I164 HydrophobicContact CG-CG1 4.37Å
60	S	90	Very high	80	Confident	12 Å²	12	55.1 Å²	55.1	8%	0.084	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	170.1	161.2	-56.1	0	0	0	0	108.8	Y28 T29 L163	Y28-S60 CarbonylContact O-C 3.52Å; Y28-S60 VanDerWaalsContact O-CA 3.28Å; Y28-S60 WeakPolarHBondContact O-CA 3.17Å; T29-S60 WeakPolarHBondContact OG1-CB 3.47Å; T29-S60 PolarHBondContact OG1-OG 3.33Å; S60-L163 PolarHBondContact N-O 2.85Å; S60-L163 PolarHBondContact O-N 2.63Å; S60-L163 VanDerWaalsContact O-O 3.06Å
61	W	92.8	Very high	80.5	Confident	9 Å²	9	59.4 Å²	59.4	3%	0.034	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.6	179.2	-62.9	82.6	0	0	0	109.6	I27 Y28 F37 P38 A50 W160 F161 P162	I27-W61 CarbonylContact C-O 3.45Å; I27-W61 VanDerWaalsContact CA-O 3.27Å; I27-W61 WeakPolarHBondContact CA-O 3.29Å; Y28-W61 PolarHBondContact N-O 2.78Å; Y28-W61 PolarHBondContact O-N 2.75Å; F37-W61 HydrophobicContact CD1-CZ2 4.11Å; P38-W61 HydrophobicContact CG-CB 4.17Å; P38-W61 HydrophobicContact CG-CD2 3.7Å; P38-W61 HydrophobicContact CG-CE3 4.27Å; P38-W61 HydrophobicContact CG-CG 3.63Å; A50-W61 HydrophobicContact CB-CE3 3.98Å; A50-W61 HydrophobicContact CB-CH2 3.67Å; A50-W61 HydrophobicContact CB-CZ2 4.33Å; A50-W61 HydrophobicContact CB-CZ3 3.47Å; A50-W61 VanDerWaalsContact CB-CZ3 3.47Å; W61-W160 HydrophobicContact CB-CB 4.18Å; W61-W160 HydrophobicContact CB-CD2 4.31Å; W61-W160 HydrophobicContact CB-CE3 3.67Å; W61-W160 HydrophobicContact CB-CZ3 4.43Å; W61-W160 HydrophobicContact CD2-CB 4.31Å; W61-W160 HydrophobicContact CE3-CB 3.77Å; W61-F161 CarbonylContact C-O 3.6Å; W61-F161 VanDerWaalsContact CA-O 3.3Å; W61-F161 WeakPolarHBondContact CA-O 3.39Å; W61-F161 VanDerWaalsContact CE3-C 3.48Å; W61-P162 HydrophobicContact CE3-CB 4.3Å; W61-P162 HydrophobicContact CE3-CG 4.01Å; W61-P162 HydrophobicContact CH2-CB 4.43Å; W61-P162 HydrophobicContact CH2-CG 3.83Å; W61-P162 HydrophobicContact CZ3-CB 4.13Å; W61-P162 HydrophobicContact CZ3-CG 3.44Å; W61-P162 VanDerWaalsContact CZ3-CG 3.44Å
62	L	96	Very high	81.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.5	170.7	-177	62.7	0	0	0	109.1	L25 I27 L64 F161 L163 L176 L193	L25-L62 HydrophobicContact CB-CD1 4.07Å; L25-L62 HydrophobicContact CD2-CD1 4.39Å; I27-L62 HydrophobicContact CG1-CD1 4.13Å; L62-L64 HydrophobicContact CD2-CD1 4.45Å; L62-L64 HydrophobicContact CD2-CD2 3.93Å; L62-L64 HydrophobicContact CD2-CG 4.2Å; L62-L64 HydrophobicContact CG-CD2 4.14Å; L62-L64 HydrophobicContact CG-CG 4.22Å; L62-F161 PolarHBondContact N-O 3.4Å; L62-F161 PolarHBondContact O-N 3.4Å; L62-L163 HydrophobicContact CB-CD1 3.97Å; L62-L163 HydrophobicContact CB-CD2 4.37Å; L62-L163 HydrophobicContact CB-CG 4.08Å; L62-L176 HydrophobicContact CB-CD2 4.25Å; L62-L176 HydrophobicContact CD2-CD1 3.88Å; L62-L176 HydrophobicContact CD2-CD2 3.91Å; L62-L193 HydrophobicContact CD1-CD2 4.43Å
63	L	98.1	Very high	83.7	Confident	0 Å²	0	50 Å²	50	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	126.4	169.3	-165.9	64.5	0	0	0	109.3	V26 F79 L104 P150 P158 W160	V26-L63 HydrophobicContact CB-CB 4.13Å; V26-L63 PolarHBondContact O-N 3.06Å; L63-F79 HydrophobicContact CB-CE2 4.03Å; L63-F79 HydrophobicContact CD2-CE2 3.54Å; L63-F79 HydrophobicContact CD2-CZ 3.7Å; L63-F79 HydrophobicContact CG-CE2 3.52Å; L63-F79 HydrophobicContact CG-CZ 3.68Å; L63-L104 HydrophobicContact CD2-CD1 3.69Å; L63-P150 HydrophobicContact CD1-CB 4.28Å; L63-P150 HydrophobicContact CD1-CG 3.79Å; L63-P150 HydrophobicContact CD2-CB 3.86Å; L63-P150 HydrophobicContact CD2-CG 4.01Å; L63-P158 HydrophobicContact CD1-CB 3.81Å; L63-P158 HydrophobicContact CG-CB 4.33Å; L63-W160 HydrophobicContact CB-CD2 4.39Å; L63-W160 HydrophobicContact CB-CE3 3.8Å; L63-W160 HydrophobicContact CB-CH2 3.85Å; L63-W160 HydrophobicContact CB-CZ2 4.43Å; L63-W160 HydrophobicContact CB-CZ3 3.51Å; L63-W160 HydrophobicContact CD1-CD2 3.67Å; L63-W160 HydrophobicContact CD1-CE3 3.98Å; L63-W160 HydrophobicContact CD1-CG 4.16Å; L63-W160 HydrophobicContact CD1-CH2 4.16Å; L63-W160 HydrophobicContact CD1-CZ2 3.86Å; L63-W160 HydrophobicContact CD1-CZ3 4.22Å; L63-W160 HydrophobicContact CD2-CH2 4.29Å; L63-W160 HydrophobicContact CD2-CZ2 4.37Å; L63-W160 HydrophobicContact CG-CE3 4.48Å; L63-W160 HydrophobicContact CG-CH2 4.32Å; L63-W160 HydrophobicContact CG-CZ2 4.45Å; L63-W160 HydrophobicContact CG-CZ3 4.35Å
64	L	98.7	Very high	85.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	148.3	168.4	-61.9	174.4	0	0	0	109.2	L62 W76 N77 P158 A159 F161 P177 M181	L62-L64 HydrophobicContact CD2-CD1 4.45Å; L62-L64 HydrophobicContact CD2-CD2 3.93Å; L62-L64 HydrophobicContact CD2-CG 4.2Å; L62-L64 HydrophobicContact CG-CD2 4.14Å; L62-L64 HydrophobicContact CG-CG 4.22Å; L64-W76 HydrophobicContact CB-CB 4.39Å; L64-W76 HydrophobicContact CB-CE3 3.94Å; L64-W76 HydrophobicContact CD1-CB 4.27Å; L64-N77 CarbonylContact C-O 3.6Å; L64-N77 VanDerWaalsContact CA-O 3.31Å; L64-N77 WeakPolarHBondContact CA-O 3.44Å; L64-P158 CarbonylContact O-C 3.46Å; L64-P158 VanDerWaalsContact O-CA 3.3Å; L64-P158 WeakPolarHBondContact O-CA 3.23Å; L64-A159 PolarHBondContact N-O 3.04Å; L64-A159 PolarHBondContact O-N 2.74Å; L64-F161 HydrophobicContact CB-CD2 4Å; L64-F161 HydrophobicContact CB-CE2 3.94Å; L64-F161 HydrophobicContact CD1-CD2 3.79Å; L64-F161 HydrophobicContact CD1-CE2 4.08Å; L64-F161 HydrophobicContact CD1-CG 4.35Å; L64-F161 HydrophobicContact CG-CD2 4.06Å; L64-F161 HydrophobicContact CG-CE2 4.42Å; L64-P177 HydrophobicContact CD1-CG 4.05Å; L64-M181 HydrophobicContact CD1-CE 4.07Å; L64-M181 HydrophobicContact CD1-SD 4.01Å; L64-M181 HydrophobicContact CD2-CE 4.17Å
65	G	98.5	Very high	88.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129	171.7	0	0	0	0	0	111.2	K67 W76 N77	G65-K67 PolarHBondContact O-N 3Å; G65-W76 WeakPolarHBondContact O-CA 3.46Å; G65-N77 PolarHBondContact N-O 2.9Å; G65-N77 PolarHBondContact O-N 2.89Å
66	L	98.6	Very high	90.3	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	110.5	165.1	177.5	61.8	0	0	0	107.9	Q68 W76 H157 T225 N226 I228	L66-Q68 PolarHBondContact O-N 3.18Å; L66-Q68 PolarHBondContact O-NE2 3.01Å; L66-W76 HydrophobicContact CB-CD2 3.96Å; L66-W76 HydrophobicContact CB-CE3 3.75Å; L66-W76 HydrophobicContact CB-CH2 3.62Å; L66-W76 HydrophobicContact CB-CZ2 3.84Å; L66-W76 HydrophobicContact CB-CZ3 3.57Å; L66-W76 HydrophobicContact CD1-CD2 4.39Å; L66-W76 HydrophobicContact CD2-CZ2 4.26Å; L66-W76 HydrophobicContact CG-CZ2 4.47Å; L66-W76 VanDerWaalsContact N-CZ3 3.27Å; L66-H157 HydrophobicContact CB-CB 4.39Å; L66-H157 PolarHBondContact N-O 2.84Å; L66-H157 PolarHBondContact O-N 2.63Å; L66-T225 HydrophobicContact CD1-CG2 3.79Å; L66-T225 HydrophobicContact CD2-CG2 4.45Å; L66-N226 HydrophobicContact CD2-CB 4.13Å; L66-I228 HydrophobicContact CD2-CD1 4.08Å; L66-I228 HydrophobicContact CG-CD1 4.3Å
67	K	98.5	Very high	92.4	Very high	18 Å²	18	32.3 Å²	32.3	8%	0.078	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	114.3	-175.2	-164.9	156.9	-170.4	119.2	0	111.2	G65 S69 F71 K73 G74 R75 E101 E155 M156	G65-K67 PolarHBondContact O-N 3Å; K67-S69 WeakPolarHBondContact CE-O 3.47Å; K67-S69 VanDerWaalsContact CG-O 3.28Å; K67-S69 WeakPolarHBondContact CG-O 3.49Å; K67-F71 VanDerWaalsContact CD-O 3.3Å; K67-F71 WeakPolarHBondContact CD-O 3.47Å; K67-F71 WeakPolarHBondContact CE-O 3.28Å; K67-K73 WeakPolarHBondContact O-CA 3.48Å; K67-G74 PolarHBondContact O-N 3.12Å; K67-R75 PolarHBondContact N-O 3.4Å; K67-E101 IonicContact NZ-OE1 3.91Å; K67-E101 PolarHBondContact NZ-OE1 3.03Å; K67-E155 CarbonylContact C-O 3.49Å; K67-E155 WeakPolarHBondContact CA-O 3.42Å; K67-E155 WeakPolarHBondContact CE-OE1 3.32Å; K67-E155 IonicContact NZ-OE1 3.11Å; K67-E155 PolarHBondContact NZ-OE1 2.83Å; K67-M156 VanDerWaalsContact CA-SD 3.53Å; K67-M156 HydrophobicContact CB-CE 4.06Å; K67-M156 HydrophobicContact CB-SD 3.7Å; K67-M156 HydrophobicContact CD-CE 3.74Å; K67-M156 HydrophobicContact CD-SD 4.43Å; K67-M156 HydrophobicContact CG-CE 3.98Å; K67-M156 HydrophobicContact CG-SD 4.01Å
68	Q	97.9	Very high	94.4	Very high	40 Å²	40	26.9 Å²	26.9	19%	0.187	15%	0.149	C	C	.	.			trans	-82.7	-30	-175.8	-59.6	-55.3	-54.3	0	0	112.8	L66 K73 E155 H157	L66-Q68 PolarHBondContact O-N 3.18Å; L66-Q68 PolarHBondContact O-NE2 3.01Å; Q68-K73 VanDerWaalsContact O-CD 3.27Å; Q68-K73 WeakPolarHBondContact O-CD 3.27Å; Q68-K73 WeakPolarHBondContact O-CE 3.45Å; Q68-K73 WeakPolarHBondContact O-CG 3.43Å; Q68-K73 PolarHBondContact O-NZ 2.9Å; Q68-E155 PolarHBondContact N-O 2.9Å; Q68-H157 VanDerWaalsContact CD-CE1 3.46Å; Q68-H157 PolarHBondContact NE2-ND1 2.77Å
69	S	95.5	Very high	95.9	Very high	50 Å²	50	22.2 Å²	22.2	35%	0.35	13%	0.125	S	C	.	.	S	Bend	trans	-143.2	166.9	-175.4	56.5	0	0	0	0	113.3	K67	K67-S69 WeakPolarHBondContact CE-O 3.47Å; K67-S69 VanDerWaalsContact CG-O 3.28Å; K67-S69 WeakPolarHBondContact CG-O 3.49Å
70	G	93.6	Very high	96.9	Very high	59 Å²	59	21.8 Å²	21.8	61%	0.608	13%	0.126	S	C	*	.	S	Bend	trans	77.4	-162.8	174.4	0	0	0	0	0	114.9	K73	G70-K73 WeakPolarHBondContact O-CB 3.46Å; G70-K73 PolarHBondContact O-N 3Å
71	F	94.4	Very high	97.3	Very high	100 Å²	100	21.9 Å²	21.9	44%	0.439	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	128.2	179.7	179.8	-106.3	0	0	0	110.5	K67 F121 W182	K67-F71 VanDerWaalsContact CD-O 3.3Å; K67-F71 WeakPolarHBondContact CD-O 3.47Å; K67-F71 WeakPolarHBondContact CE-O 3.28Å; F71-F121 HydrophobicContact CE1-CZ 4.11Å; F71-F121 HydrophobicContact CE2-CE1 4.25Å; F71-F121 HydrophobicContact CE2-CZ 4.49Å; F71-F121 AromaticContact CZ-CE1 3.58Å; F71-F121 HydrophobicContact CZ-CE1 3.58Å; F71-F121 HydrophobicContact CZ-CE2 4.44Å; F71-F121 AromaticContact CZ-CZ 3.53Å; F71-F121 HydrophobicContact CZ-CZ 3.53Å; F71-W182 HydrophobicContact CD1-CH2 4.42Å; F71-W182 HydrophobicContact CD1-CZ2 4.06Å; F71-W182 AromaticContact CE1-CH2 3.68Å; F71-W182 HydrophobicContact CE1-CH2 3.68Å; F71-W182 AromaticContact CE1-CZ2 3.57Å; F71-W182 HydrophobicContact CE1-CZ2 3.57Å; F71-W182 AromaticContact CE2-CH2 3.91Å; F71-W182 HydrophobicContact CE2-CH2 3.91Å; F71-W182 HydrophobicContact CE2-CZ2 4.48Å; F71-W182 AromaticContact CZ-CH2 3.37Å; F71-W182 HydrophobicContact CZ-CH2 3.37Å; F71-W182 AromaticContact CZ-CZ2 3.8Å; F71-W182 HydrophobicContact CZ-CZ2 3.8Å; F71-W182 HydrophobicContact CZ-CZ3 4.28Å
72	G	95.8	Very high	97.5	Very high	7 Å²	7	26.3 Å²	26.3	7%	0.072	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	8.8	-173.7	0	0	0	0	0	115	G74 R75	G72-G74 PolarHBondContact O-N 3.34Å; G72-R75 WeakPolarHBondContact O-CB 3.21Å; G72-R75 PolarHBondContact O-N 3.11Å; G72-R75 VanDerWaalsContact O-N 3.1Å
73	K	97.9	Very high	97.6	Very high	97 Å²	97	27.5 Å²	27.5	42%	0.422	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.9	137.2	173.5	175.2	174.1	-180	165.2	0	112.2	K67 Q68 G70 R75 I228	K67-K73 WeakPolarHBondContact O-CA 3.48Å; Q68-K73 VanDerWaalsContact O-CD 3.27Å; Q68-K73 WeakPolarHBondContact O-CD 3.27Å; Q68-K73 WeakPolarHBondContact O-CE 3.45Å; Q68-K73 WeakPolarHBondContact O-CG 3.43Å; Q68-K73 PolarHBondContact O-NZ 2.9Å; G70-K73 WeakPolarHBondContact O-CB 3.46Å; G70-K73 PolarHBondContact O-N 3Å; K73-R75 VanDerWaalsContact C-N 3.3Å; K73-I228 HydrophobicContact CD-CG2 4.14Å; K73-I228 HydrophobicContact CG-CG2 3.58Å
74	G	98.3	Very high	97.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	-2.5	-178.7	0	0	0	0	0	114.3	K67 G72 T225 I230	K67-G74 PolarHBondContact O-N 3.12Å; G72-G74 PolarHBondContact O-N 3.34Å; G74-T225 WeakPolarHBondContact O-CB 3.27Å; G74-T225 PolarHBondContact O-OG1 3.29Å; G74-I230 WeakPolarHBondContact O-CD1 3.41Å; G74-I230 WeakPolarHBondContact O-CG1 3.45Å
75	R	98.5	Very high	97.2	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	22%	0.224	C	C	.	.			trans	-99.3	149.1	175.9	-62.7	-178.3	176.5	84.2	-7.5	112.4	K67 G72 K73 H180 W182 D220 I230 D231	K67-R75 PolarHBondContact N-O 3.4Å; G72-R75 WeakPolarHBondContact O-CB 3.21Å; G72-R75 PolarHBondContact O-N 3.11Å; G72-R75 VanDerWaalsContact O-N 3.1Å; K73-R75 VanDerWaalsContact C-N 3.3Å; R75-H180 CarbonylContact C-O 3.58Å; R75-H180 WeakPolarHBondContact CA-O 3.4Å; R75-H180 WeakPolarHBondContact CB-O 3.46Å; R75-W182 VanDerWaalsContact CD-CD2 3.41Å; R75-W182 VanDerWaalsContact CZ-CZ3 3.48Å; R75-D220 IonicContact CZ-OD1 3.82Å; R75-D220 IonicContact CZ-OD2 2.89Å; R75-D220 IonicContact NE-OD1 3.48Å; R75-D220 PolarHBondContact NE-OD1 2.91Å; R75-D220 VanDerWaalsContact NE-OD1 3.11Å; R75-D220 IonicContact NH2-OD1 3.75Å; R75-D220 PolarHBondContact NH2-OD1 2.84Å; R75-D220 IonicContact NH2-OD2 2.9Å; R75-D220 PolarHBondContact NH2-OD2 2.99Å; R75-I230 HydrophobicContact CG-CD1 4.46Å; R75-I230 HydrophobicContact CG-CG1 4.38Å; R75-I230 HydrophobicContact CG-CG2 4.2Å; R75-I230 VanDerWaalsContact NH2-CG2 3.29Å; R75-D231 PolarHBondContact NH1-O 2.93Å; R75-D231 PolarHBondContact NH2-O 3.39Å
76	W	98.7	Very high	97.1	Very high	24 Å²	24	45.8 Å²	45.8	9%	0.091	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	132.9	160.3	-69	100.9	0	0	0	109.2	L64 G65 L66 H157 A159 F161 P177 H180 M181	L64-W76 HydrophobicContact CB-CB 4.39Å; L64-W76 HydrophobicContact CB-CE3 3.94Å; L64-W76 HydrophobicContact CD1-CB 4.27Å; G65-W76 WeakPolarHBondContact O-CA 3.46Å; L66-W76 HydrophobicContact CB-CD2 3.96Å; L66-W76 HydrophobicContact CB-CE3 3.75Å; L66-W76 HydrophobicContact CB-CH2 3.62Å; L66-W76 HydrophobicContact CB-CZ2 3.84Å; L66-W76 HydrophobicContact CB-CZ3 3.57Å; L66-W76 HydrophobicContact CD1-CD2 4.39Å; L66-W76 HydrophobicContact CD2-CZ2 4.26Å; L66-W76 HydrophobicContact CG-CZ2 4.47Å; L66-W76 VanDerWaalsContact N-CZ3 3.27Å; W76-H157 WeakPolarHBondContact CZ3-O 3.33Å; W76-A159 HydrophobicContact CH2-CB 3.51Å; W76-A159 HydrophobicContact CZ3-CB 3.55Å; W76-F161 AromaticContact CD2-CE2 3.93Å; W76-F161 HydrophobicContact CD2-CE2 3.93Å; W76-F161 AromaticContact CD2-CZ 3.77Å; W76-F161 HydrophobicContact CD2-CZ 3.77Å; W76-F161 AromaticContact CE2-CZ 3.73Å; W76-F161 AromaticContact CE3-CE2 3.67Å; W76-F161 HydrophobicContact CE3-CE2 3.67Å; W76-F161 AromaticContact CE3-CZ 3.97Å; W76-F161 HydrophobicContact CE3-CZ 3.97Å; W76-F161 HydrophobicContact CG-CZ 4.36Å; W76-F161 HydrophobicContact CH2-CE2 4.23Å; W76-F161 HydrophobicContact CH2-CZ 4.11Å; W76-F161 HydrophobicContact CZ2-CE2 4.45Å; W76-F161 AromaticContact CZ2-CZ 3.91Å; W76-F161 HydrophobicContact CZ2-CZ 3.91Å; W76-F161 AromaticContact CZ3-CE2 3.84Å; W76-F161 HydrophobicContact CZ3-CE2 3.84Å; W76-F161 HydrophobicContact CZ3-CZ 4.13Å; W76-P177 HydrophobicContact CB-CG 3.79Å; W76-P177 HydrophobicContact CD2-CG 4.36Å; W76-P177 HydrophobicContact CG-CB 4.33Å; W76-P177 HydrophobicContact CG-CG 3.61Å; W76-H180 PolarHBondContact N-O 3.24Å; W76-M181 HydrophobicContact CB-CG 3.94Å; W76-M181 WeakPolarHBondContact O-CG 3.48Å
77	N	98.3	Very high	97	Very high	24 Å²	24	46.9 Å²	46.9	13%	0.128	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	165.7	-179.3	-161.5	15.3	0	0	0	111.6	L64 G65	L64-N77 CarbonylContact C-O 3.6Å; L64-N77 VanDerWaalsContact CA-O 3.31Å; L64-N77 WeakPolarHBondContact CA-O 3.44Å; G65-N77 PolarHBondContact N-O 2.9Å; G65-N77 PolarHBondContact O-N 2.89Å
78	G	98.4	Very high	96.9	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.01	30%	0.295	C	S	.	.			trans	-66	177	156.8	0	0	0	0	0	111.4	L23	L23-G78 VanDerWaalsContact CD1-C 3.49Å
79	F	98.8	Very high	96.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-97.3	140.7	-175.8	-59.4	-87.3	0	0	0	111.3	L23 M24 L63 L98 E101 M156 P158	L23-F79 CarbonylContact C-O 3.47Å; L23-F79 WeakPolarHBondContact CA-O 3.46Å; M24-F79 HydrophobicContact CB-CB 4.4Å; M24-F79 WeakPolarHBondContact CB-O 3.46Å; M24-F79 PolarHBondContact N-O 2.75Å; M24-F79 PolarHBondContact O-N 3.37Å; L63-F79 HydrophobicContact CB-CE2 4.03Å; L63-F79 HydrophobicContact CD2-CE2 3.54Å; L63-F79 HydrophobicContact CD2-CZ 3.7Å; L63-F79 HydrophobicContact CG-CE2 3.52Å; L63-F79 HydrophobicContact CG-CZ 3.68Å; F79-L98 HydrophobicContact CB-CB 4.45Å; F79-L98 HydrophobicContact CB-CD1 3.73Å; F79-L98 HydrophobicContact CD1-CD1 4.34Å; F79-L98 HydrophobicContact CD2-CD1 3.67Å; F79-L98 HydrophobicContact CE2-CD1 4.44Å; F79-L98 HydrophobicContact CG-CD1 3.63Å; F79-E101 WeakPolarHBondContact CA-OE2 3.28Å; F79-E101 WeakPolarHBondContact CB-OE2 3.09Å; F79-E101 HydrophobicContact CD1-CB 3.73Å; F79-E101 HydrophobicContact CE1-CB 4.43Å; F79-M156 HydrophobicContact CD1-CG 4.47Å; F79-M156 HydrophobicContact CE1-CB 4.33Å; F79-M156 HydrophobicContact CE1-CG 4.46Å; F79-P158 HydrophobicContact CE1-CG 4.12Å; F79-P158 HydrophobicContact CZ-CB 4.15Å; F79-P158 HydrophobicContact CZ-CG 4.18Å
80	G	98.2	Very high	96.7	Very high	11 Å²	11	50.3 Å²	50.3	11%	0.113	29%	0.293	C	S	.	.			trans	155.5	165.9	179.4	0	0	0	0	0	114.1	T22 E101	T22-G80 WeakPolarHBondContact O-CA 3.49Å; G80-E101 PolarHBondContact N-OE2 2.98Å
81	G	97	Very high	96.9	Very high	14 Å²	14	50 Å²	50	14%	0.144	28%	0.275	C	S	.	.			trans	-156.9	-155.8	-177.3	0	0	0	0	0	110.9	Y21 T22 E97	Y21-G81 CarbonylContact C-O 3.54Å; Y21-G81 WeakPolarHBondContact CA-O 3.42Å; T22-G81 PolarHBondContact N-O 2.91Å; T22-G81 PolarHBondContact OG1-N 3.27Å; T22-G81 PolarHBondContact OG1-O 2.93Å; G81-E97 VanDerWaalsContact CA-CD 3.42Å
82	K	97.5	Very high	97.1	Very high	103 Å²	103	46.6 Å²	46.6	45%	0.448	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-82.3	137.7	-175.4	-171.6	-178.2	170.1	-164.2	0	109.4	Y21 E84 R96	Y21-K82 HydrophobicContact CD1-CB 3.86Å; Y21-K82 HydrophobicContact CD1-CG 4.32Å; Y21-K82 HydrophobicContact CE1-CB 3.63Å; Y21-K82 HydrophobicContact CE1-CD 4.5Å; Y21-K82 HydrophobicContact CE1-CG 3.96Å; K82-E84 PolarHBondContact O-N 3.36Å; K82-R96 PolarHBondContact O-NH2 3.32Å
83	V	97.8	Very high	97.2	Very high	24 Å²	24	46.2 Å²	46.2	15%	0.145	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-68.9	123.9	170.3	-176.3	0	0	0	0	108.9	L20 T22 D87 P90 A93	L20-V83 HydrophobicContact CB-CB 3.83Å; L20-V83 HydrophobicContact CB-CG2 3.72Å; L20-V83 PolarHBondContact O-N 2.92Å; T22-V83 HydrophobicContact CG2-CG2 3.81Å; V83-D87 HydrophobicContact CG1-CB 4.09Å; V83-P90 HydrophobicContact CG2-CB 4.14Å; V83-P90 HydrophobicContact CG2-CG 4.38Å; V83-A93 HydrophobicContact CB-CB 4.23Å; V83-A93 HydrophobicContact CG1-CB 4.15Å; V83-A93 HydrophobicContact CG2-CB 3.92Å
84	E	96.2	Very high	97.2	Very high	100 Å²	100	41.6 Å²	41.6	47%	0.467	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-90.6	162.9	178.7	-59.2	-163.6	151.5	0	0	112	K82 S86 D87	K82-E84 PolarHBondContact O-N 3.36Å; E84-S86 PolarHBondContact O-N 3.27Å; E84-S86 PolarHBondContact OE2-OG 2.73Å; E84-D87 WeakPolarHBondContact CB-OD2 3.12Å; E84-D87 PolarHBondContact N-OD2 2.84Å; E84-D87 PolarHBondContact O-N 2.62Å; E84-D87 VanDerWaalsContact O-N 3.15Å
85	L	93.6	Very high	97.2	Very high	188 Å²	188	43.1 Å²	43.1	98%	0.984	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.2	175.6	-67.2	174.5	0	0	0	112.8
86	S	95.7	Very high	97.2	Very high	97 Å²	97	45.3 Å²	45.3	68%	0.678	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-21	175.5	25.4	0	0	0	0	113.2	E84	E84-S86 PolarHBondContact O-N 3.27Å; E84-S86 PolarHBondContact OE2-OG 2.73Å
87	D	97.2	Very high	97.2	Very high	26 Å²	26	45 Å²	45	14%	0.139	26%	0.258	C	S	.	.			trans	-73.5	129.2	179.4	-67.1	-49.6	0	0	0	109.8	V83 E84 N89 A93 R96	V83-D87 HydrophobicContact CG1-CB 4.09Å; E84-D87 WeakPolarHBondContact CB-OD2 3.12Å; E84-D87 PolarHBondContact N-OD2 2.84Å; E84-D87 PolarHBondContact O-N 2.62Å; E84-D87 VanDerWaalsContact O-N 3.15Å; D87-N89 PolarHBondContact O-N 2.94Å; D87-A93 HydrophobicContact CB-CB 3.93Å; D87-A93 VanDerWaalsContact OD2-CB 3.25Å; D87-A93 WeakPolarHBondContact OD2-CB 3.29Å; D87-R96 IonicContact OD1-CZ 2.9Å; D87-R96 IonicContact OD1-NE 3.55Å; D87-R96 PolarHBondContact OD1-NE 3.22Å; D87-R96 IonicContact OD1-NH2 3.66Å; D87-R96 IonicContact OD2-CZ 3.06Å; D87-R96 IonicContact OD2-NE 3.74Å; D87-R96 IonicContact OD2-NH2 2.62Å; D87-R96 PolarHBondContact OD2-NH2 3.29Å
88	A	94.8	Very high	97.2	Very high	92 Å²	92	43.9 Å²	43.9	76%	0.76	25%	0.252	S	S	*	.	S	Bend	trans	-64.8	-29.9	-177.9	0	0	0	0	0	112.9	A92	A88-A92 HydrophobicContact CB-CB 4.44Å
89	N	94.6	Very high	97.2	Very high	63 Å²	63	47.1 Å²	47.1	34%	0.337	27%	0.269	S	S	.	.	S	Bend	trans	-165.8	170.6	177.1	59.9	57.1	0	0	0	109.5	D87 K91 A92 A93	D87-N89 PolarHBondContact O-N 2.94Å; N89-K91 PolarHBondContact O-N 3.01Å; N89-K91 WeakPolarHBondContact OD1-CA 3.3Å; N89-K91 VanDerWaalsContact OD1-CB 3.28Å; N89-K91 WeakPolarHBondContact OD1-CB 3.46Å; N89-K91 PolarHBondContact OD1-N 2.85Å; N89-A92 WeakPolarHBondContact O-CB 3.2Å; N89-A92 PolarHBondContact O-N 2.84Å; N89-A92 VanDerWaalsContact O-N 3.14Å; N89-A92 PolarHBondContact OD1-N 3.49Å; N89-A93 PolarHBondContact O-N 2.84Å
90	P	95.9	Very high	97.2	Very high	26 Å²	26	52.2 Å²	52.2	17%	0.169	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-29.1	178	-28.3	37.1	0	0	0	114.8	T22 V83 A93 A94 H131 F133	T22-P90 HydrophobicContact CG2-CB 4.28Å; T22-P90 WeakPolarHBondContact CG2-O 3.31Å; V83-P90 HydrophobicContact CG2-CB 4.14Å; V83-P90 HydrophobicContact CG2-CG 4.38Å; P90-A93 PolarHBondContact O-N 2.67Å; P90-A94 PolarHBondContact O-N 2.88Å; P90-H131 HydrophobicContact CB-CB 4.11Å; P90-F133 HydrophobicContact CB-CE2 4.34Å; P90-F133 HydrophobicContact CB-CZ 4.21Å
91	K	97.5	Very high	97.2	Very high	51 Å²	51	51.8 Å²	51.8	22%	0.222	29%	0.288	C	S	.	.	H	α-helix	trans	-69.6	-39.7	176.9	-169.8	-177.8	-67.5	-164.3	0	111.6	N89 A93 A94 L95 E108 V111 F133	N89-K91 PolarHBondContact O-N 3.01Å; N89-K91 WeakPolarHBondContact OD1-CA 3.3Å; N89-K91 VanDerWaalsContact OD1-CB 3.28Å; N89-K91 WeakPolarHBondContact OD1-CB 3.46Å; N89-K91 PolarHBondContact OD1-N 2.85Å; K91-A93 VanDerWaalsContact C-N 3.33Å; K91-A94 PolarHBondContact O-N 2.89Å; K91-L95 WeakPolarHBondContact O-CG 3.39Å; K91-L95 PolarHBondContact O-N 2.75Å; K91-E108 HydrophobicContact CD-CG 3.31Å; K91-E108 HydrophobicContact CG-CG 4.08Å; K91-V111 HydrophobicContact CD-CG1 4.46Å; K91-V111 HydrophobicContact CG-CG1 4.34Å; K91-V111 PolarHBondContact NZ-O 2.94Å; K91-F133 HydrophobicContact CB-CE1 3.72Å; K91-F133 HydrophobicContact CB-CZ 3.77Å; K91-F133 HydrophobicContact CD-CE1 4.47Å; K91-F133 HydrophobicContact CG-CD1 4.2Å; K91-F133 HydrophobicContact CG-CE1 3.87Å; K91-F133 HydrophobicContact CG-CZ 4.32Å
92	A	97.8	Very high	97.2	Very high	29 Å²	29	51.1 Å²	51.1	24%	0.24	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-42.3	174	0	0	0	0	0	111.4	A88 N89 L95 R96	A88-A92 HydrophobicContact CB-CB 4.44Å; N89-A92 WeakPolarHBondContact O-CB 3.2Å; N89-A92 PolarHBondContact O-N 2.84Å; N89-A92 VanDerWaalsContact O-N 3.14Å; N89-A92 PolarHBondContact OD1-N 3.49Å; A92-L95 PolarHBondContact O-N 2.79Å; A92-R96 PolarHBondContact O-N 3Å
93	A	98.6	Very high	97.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.2	-46.5	173.4	0	0	0	0	0	111.6	T22 V83 D87 N89 P90 K91 L95 R96 E97	T22-A93 HydrophobicContact CG2-CB 3.95Å; V83-A93 HydrophobicContact CB-CB 4.23Å; V83-A93 HydrophobicContact CG1-CB 4.15Å; V83-A93 HydrophobicContact CG2-CB 3.92Å; D87-A93 HydrophobicContact CB-CB 3.93Å; D87-A93 VanDerWaalsContact OD2-CB 3.25Å; D87-A93 WeakPolarHBondContact OD2-CB 3.29Å; N89-A93 PolarHBondContact O-N 2.84Å; P90-A93 PolarHBondContact O-N 2.67Å; K91-A93 VanDerWaalsContact C-N 3.33Å; A93-L95 VanDerWaalsContact C-N 3.28Å; A93-L95 PolarHBondContact O-N 3Å; A93-R96 PolarHBondContact O-N 3.38Å; A93-E97 WeakPolarHBondContact O-CB 3.38Å; A93-E97 WeakPolarHBondContact O-CG 3.43Å; A93-E97 PolarHBondContact O-N 2.82Å
94	A	98.7	Very high	96.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.4	-36.9	179	0	0	0	0	0	113	T22 M24 P90 K91 L98 F133	T22-A94 HydrophobicContact CG2-CB 3.98Å; M24-A94 HydrophobicContact CE-CB 3.72Å; P90-A94 PolarHBondContact O-N 2.88Å; K91-A94 PolarHBondContact O-N 2.89Å; A94-L98 VanDerWaalsContact O-CB 3.27Å; A94-L98 WeakPolarHBondContact O-CB 3.19Å; A94-L98 PolarHBondContact O-N 3.28Å; A94-F133 HydrophobicContact CB-CD2 3.47Å; A94-F133 VanDerWaalsContact CB-CD2 3.47Å; A94-F133 HydrophobicContact CB-CE2 3.81Å; A94-F133 HydrophobicContact CB-CG 4.23Å
95	L	98.6	Very high	96.8	Very high	32 Å²	32	46.6 Å²	46.6	17%	0.168	28%	0.275	C	S	.	.	H	α-helix	trans	-70.8	-40.3	176.3	-71.2	169.5	0	0	0	112.3	M24 K91 A92 A93 N99 I106 E108 V111	M24-L95 HydrophobicContact CE-CD2 4.41Å; K91-L95 WeakPolarHBondContact O-CG 3.39Å; K91-L95 PolarHBondContact O-N 2.75Å; A92-L95 PolarHBondContact O-N 2.79Å; A93-L95 VanDerWaalsContact C-N 3.28Å; A93-L95 PolarHBondContact O-N 3Å; L95-N99 PolarHBondContact O-N 3.15Å; L95-N99 VanDerWaalsContact O-N 3.12Å; L95-I106 HydrophobicContact CD2-CB 4.12Å; L95-I106 WeakPolarHBondContact CD2-O 3.46Å; L95-E108 HydrophobicContact CD1-CB 3.87Å; L95-E108 HydrophobicContact CD1-CG 4.02Å; L95-V111 HydrophobicContact CD2-CG2 4.05Å
96	R	98.3	Very high	96.8	Very high	47 Å²	47	38.5 Å²	38.5	18%	0.177	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-52.7	174.7	174.6	-176.8	54.9	67.1	2.7	110.8	K82 D87 A92 A93 L98 N99 E100	K82-R96 PolarHBondContact O-NH2 3.32Å; D87-R96 IonicContact OD1-CZ 2.9Å; D87-R96 IonicContact OD1-NE 3.55Å; D87-R96 PolarHBondContact OD1-NE 3.22Å; D87-R96 IonicContact OD1-NH2 3.66Å; D87-R96 IonicContact OD2-CZ 3.06Å; D87-R96 IonicContact OD2-NE 3.74Å; D87-R96 IonicContact OD2-NH2 2.62Å; D87-R96 PolarHBondContact OD2-NH2 3.29Å; A92-R96 PolarHBondContact O-N 3Å; A93-R96 PolarHBondContact O-N 3.38Å; R96-L98 VanDerWaalsContact C-N 3.32Å; R96-L98 PolarHBondContact O-N 3.29Å; R96-N99 WeakPolarHBondContact O-CA 3.37Å; R96-N99 WeakPolarHBondContact O-CB 3.28Å; R96-N99 PolarHBondContact O-N 2.89Å; R96-E100 WeakPolarHBondContact CD-OE1 3.37Å; R96-E100 HydrophobicContact CG-CG 4.34Å; R96-E100 VanDerWaalsContact CG-OE1 3.27Å; R96-E100 WeakPolarHBondContact CG-OE1 3.25Å; R96-E100 IonicContact NH1-OE1 3.62Å; R96-E100 IonicContact NH1-OE2 3.23Å; R96-E100 PolarHBondContact NH1-OE2 3.06Å; R96-E100 WeakPolarHBondContact O-CG 3.4Å; R96-E100 PolarHBondContact O-N 3.2Å
97	E	98.6	Very high	96.7	Very high	18 Å²	18	38.9 Å²	38.9	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-42.2	-179.6	-65.1	-77.2	170.5	0	0	111.2	G81 A93 N99 E100 E101	G81-E97 VanDerWaalsContact CA-CD 3.42Å; A93-E97 WeakPolarHBondContact O-CB 3.38Å; A93-E97 WeakPolarHBondContact O-CG 3.43Å; A93-E97 PolarHBondContact O-N 2.82Å; E97-N99 VanDerWaalsContact C-N 3.27Å; E97-N99 PolarHBondContact O-N 2.87Å; E97-E100 PolarHBondContact O-N 3.42Å; E97-E101 VanDerWaalsContact O-CB 3.29Å; E97-E101 WeakPolarHBondContact O-CB 3.11Å; E97-E101 WeakPolarHBondContact O-CG 3.27Å; E97-E101 PolarHBondContact O-N 3.26Å
98	L	98.6	Very high	96.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.4	-42.2	173.1	177.9	69.4	0	0	0	111.7	M24 V26 F79 A94 R96 S102 L104 I106	M24-L98 HydrophobicContact CG-CD1 4.41Å; M24-L98 HydrophobicContact CG-CD2 4.21Å; V26-L98 HydrophobicContact CG2-CD1 3.87Å; V26-L98 HydrophobicContact CG2-CD2 4.06Å; F79-L98 HydrophobicContact CB-CB 4.45Å; F79-L98 HydrophobicContact CB-CD1 3.73Å; F79-L98 HydrophobicContact CD1-CD1 4.34Å; F79-L98 HydrophobicContact CD2-CD1 3.67Å; F79-L98 HydrophobicContact CE2-CD1 4.44Å; F79-L98 HydrophobicContact CG-CD1 3.63Å; A94-L98 VanDerWaalsContact O-CB 3.27Å; A94-L98 WeakPolarHBondContact O-CB 3.19Å; A94-L98 PolarHBondContact O-N 3.28Å; R96-L98 VanDerWaalsContact C-N 3.32Å; R96-L98 PolarHBondContact O-N 3.29Å; L98-S102 WeakPolarHBondContact CD1-OG 3.27Å; L98-S102 WeakPolarHBondContact O-CB 3.46Å; L98-S102 PolarHBondContact O-N 3.05Å; L98-S102 PolarHBondContact O-OG 2.83Å; L98-L104 HydrophobicContact CD2-CB 4.23Å; L98-L104 HydrophobicContact CG-CB 4.16Å; L98-I106 HydrophobicContact CD2-CB 4.41Å; L98-I106 HydrophobicContact CD2-CD1 3.39Å; L98-I106 HydrophobicContact CD2-CG1 3.69Å
99	N	97.4	Very high	96.4	Very high	69 Å²	69	42.5 Å²	42.5	37%	0.369	24%	0.238	S	C	.	.	H	α-helix	trans	-68	-43.1	178	-172.5	-109.6	0	0	0	112.1	L95 R96 E97 G103 L104 T105	L95-N99 PolarHBondContact O-N 3.15Å; L95-N99 VanDerWaalsContact O-N 3.12Å; R96-N99 WeakPolarHBondContact O-CA 3.37Å; R96-N99 WeakPolarHBondContact O-CB 3.28Å; R96-N99 PolarHBondContact O-N 2.89Å; E97-N99 VanDerWaalsContact C-N 3.27Å; E97-N99 PolarHBondContact O-N 2.87Å; N99-G103 PolarHBondContact ND2-O 3.29Å; N99-G103 WeakPolarHBondContact O-CA 3.32Å; N99-G103 PolarHBondContact O-N 3.26Å; N99-L104 VanDerWaalsContact CA-O 3.25Å; N99-L104 WeakPolarHBondContact CA-O 3.45Å; N99-L104 WeakPolarHBondContact CB-O 3.1Å; N99-L104 PolarHBondContact ND2-O 2.89Å; N99-L104 VanDerWaalsContact ND2-O 3.11Å; N99-T105 PolarHBondContact ND2-OG1 2.92Å
100	E	97.8	Very high	96.4	Very high	106 Å²	106	41.9 Å²	41.9	50%	0.495	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-37	179.4	-72.5	171.2	176.9	0	0	112.4	R96 E97 T153	R96-E100 WeakPolarHBondContact CD-OE1 3.37Å; R96-E100 HydrophobicContact CG-CG 4.34Å; R96-E100 VanDerWaalsContact CG-OE1 3.27Å; R96-E100 WeakPolarHBondContact CG-OE1 3.25Å; R96-E100 IonicContact NH1-OE1 3.62Å; R96-E100 IonicContact NH1-OE2 3.23Å; R96-E100 PolarHBondContact NH1-OE2 3.06Å; R96-E100 WeakPolarHBondContact O-CG 3.4Å; R96-E100 PolarHBondContact O-N 3.2Å; E97-E100 PolarHBondContact O-N 3.42Å; E100-T153 WeakPolarHBondContact O-CG2 3.44Å
101	E	98.2	Very high	96.3	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.014	23%	0.231	C	C	.	.	H	α-helix	trans	-91.8	-17.3	-176	-69.8	-170.7	138.9	0	0	114	K67 F79 G80 E97 T153 M156	K67-E101 IonicContact NZ-OE1 3.91Å; K67-E101 PolarHBondContact NZ-OE1 3.03Å; F79-E101 WeakPolarHBondContact CA-OE2 3.28Å; F79-E101 WeakPolarHBondContact CB-OE2 3.09Å; F79-E101 HydrophobicContact CD1-CB 3.73Å; F79-E101 HydrophobicContact CE1-CB 4.43Å; G80-E101 PolarHBondContact N-OE2 2.98Å; E97-E101 VanDerWaalsContact O-CB 3.29Å; E97-E101 WeakPolarHBondContact O-CB 3.11Å; E97-E101 WeakPolarHBondContact O-CG 3.27Å; E97-E101 PolarHBondContact O-N 3.26Å; E101-T153 VanDerWaalsContact C-CG2 3.4Å; E101-T153 VanDerWaalsContact O-CG2 3.24Å; E101-T153 WeakPolarHBondContact O-CG2 3.49Å; E101-T153 PolarHBondContact O-OG1 2.62Å; E101-M156 HydrophobicContact CB-CB 4.14Å; E101-M156 HydrophobicContact CB-CG 3.82Å; E101-M156 HydrophobicContact CG-CG 3.97Å; E101-M156 WeakPolarHBondContact O-CB 3.46Å; E101-M156 VanDerWaalsContact OE1-CE 3.29Å; E101-M156 WeakPolarHBondContact OE1-CE 3.23Å
102	S	97.3	Very high	96.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-139.9	-5.1	-176.8	75.9	0	0	0	0	115.9	L98 L104 P150 C151	L98-S102 WeakPolarHBondContact CD1-OG 3.27Å; L98-S102 WeakPolarHBondContact O-CB 3.46Å; L98-S102 PolarHBondContact O-N 3.05Å; L98-S102 PolarHBondContact O-OG 2.83Å; S102-L104 PolarHBondContact O-N 3.14Å; S102-L104 WeakPolarHBondContact OG-CB 3.49Å; S102-L104 WeakPolarHBondContact OG-CG 3.48Å; S102-L104 PolarHBondContact OG-N 3.21Å; S102-P150 CarbonylContact O-C 3.6Å; S102-P150 WeakPolarHBondContact O-CA 3.49Å; S102-C151 PolarHBondContact O-N 3.35Å
103	G	95	Very high	96.1	Very high	32 Å²	32	43.1 Å²	43.1	33%	0.33	24%	0.241	S	C	.	.			trans	73.5	-7	-173.2	0	0	0	0	0	114.8	N99	N99-G103 PolarHBondContact ND2-O 3.29Å; N99-G103 WeakPolarHBondContact O-CA 3.32Å; N99-G103 PolarHBondContact O-N 3.26Å
104	L	95.3	Very high	95.9	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.021	24%	0.244	C	C	.	.			trans	-71.6	137.2	-177.8	-67.1	-174.1	0	0	0	112.2	V26 L63 L98 N99 S102 W138 P150	V26-L104 HydrophobicContact CG1-CD1 4.43Å; L63-L104 HydrophobicContact CD2-CD1 3.69Å; L98-L104 HydrophobicContact CD2-CB 4.23Å; L98-L104 HydrophobicContact CG-CB 4.16Å; N99-L104 VanDerWaalsContact CA-O 3.25Å; N99-L104 WeakPolarHBondContact CA-O 3.45Å; N99-L104 WeakPolarHBondContact CB-O 3.1Å; N99-L104 PolarHBondContact ND2-O 2.89Å; N99-L104 VanDerWaalsContact ND2-O 3.11Å; S102-L104 PolarHBondContact O-N 3.14Å; S102-L104 WeakPolarHBondContact OG-CB 3.49Å; S102-L104 WeakPolarHBondContact OG-CG 3.48Å; S102-L104 PolarHBondContact OG-N 3.21Å; L104-W138 HydrophobicContact CD1-CZ2 4.29Å; L104-W138 HydrophobicContact CD2-CH2 4.22Å; L104-W138 HydrophobicContact CD2-CZ2 3.46Å; L104-W138 VanDerWaalsContact CD2-CZ2 3.46Å; L104-P150 HydrophobicContact CD1-CB 4.07Å; L104-P150 HydrophobicContact CD2-CB 4.08Å; L104-P150 HydrophobicContact CG-CB 3.9Å
105	T	94	Very high	95.8	Very high	96 Å²	96	43.6 Å²	43.6	59%	0.589	24%	0.244	S	C	*	.			trans	-111.9	122.8	166.3	-62.8	0	0	0	0	108.7	N99	N99-T105 PolarHBondContact ND2-OG1 2.92Å
106	I	94	Very high	95.7	Very high	17 Å²	17	42.2 Å²	42.2	9%	0.087	24%	0.237	C	C	.	.			trans	-120.2	141.5	179.3	-57	-170.2	0	0	0	109	V26 L95 L98 V111 C135 W138	V26-I106 HydrophobicContact CG1-CD1 4.03Å; V26-I106 HydrophobicContact CG2-CD1 3.94Å; L95-I106 HydrophobicContact CD2-CB 4.12Å; L95-I106 WeakPolarHBondContact CD2-O 3.46Å; L98-I106 HydrophobicContact CD2-CB 4.41Å; L98-I106 HydrophobicContact CD2-CD1 3.39Å; L98-I106 HydrophobicContact CD2-CG1 3.69Å; I106-V111 HydrophobicContact CG2-CG2 3.8Å; I106-C135 HydrophobicContact CD1-CB 3.96Å; I106-C135 HydrophobicContact CG2-CB 4.34Å; I106-W138 VanDerWaalsContact CD1-CD1 3.42Å; I106-W138 HydrophobicContact CD1-CG 4.22Å
107	N	92.7	Very high	95.7	Very high	106 Å²	106	40 Å²	40	57%	0.567	23%	0.228	S	C	*	.			trans	-68.6	132.5	172.9	-167	-55.3	0	0	0	110.5	S109 S110	N107-S109 PolarHBondContact O-N 2.86Å; N107-S109 VanDerWaalsContact O-N 3.11Å; N107-S109 WeakPolarHBondContact OD1-CB 3.49Å; N107-S109 PolarHBondContact OD1-N 2.89Å; N107-S109 PolarHBondContact OD1-OG 3.36Å; N107-S110 WeakPolarHBondContact O-CB 3.33Å; N107-S110 PolarHBondContact O-N 3.13Å
108	E	93.3	Very high	95.5	Very high	94 Å²	94	39.1 Å²	39.1	44%	0.439	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-53.2	-32.7	177.6	-167.4	-176.9	171.7	0	0	113.4	K91 L95 S110 V111	K91-E108 HydrophobicContact CD-CG 3.31Å; K91-E108 HydrophobicContact CG-CG 4.08Å; L95-E108 HydrophobicContact CD1-CB 3.87Å; L95-E108 HydrophobicContact CD1-CG 4.02Å; E108-S110 PolarHBondContact O-N 3.16Å; E108-V111 PolarHBondContact O-N 3.46Å
109	S	92.8	Very high	95.4	Very high	100 Å²	100	40 Å²	40	70%	0.699	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-68.6	-14.5	177.7	69.5	0	0	0	0	114.1	N107	N107-S109 PolarHBondContact O-N 2.86Å; N107-S109 VanDerWaalsContact O-N 3.11Å; N107-S109 WeakPolarHBondContact OD1-CB 3.49Å; N107-S109 PolarHBondContact OD1-N 2.89Å; N107-S109 PolarHBondContact OD1-OG 3.36Å
110	S	93.1	Very high	95.2	Very high	49 Å²	49	36.8 Å²	36.8	34%	0.343	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-97.8	8.8	179.4	-59.1	0	0	0	0	112.7	N107 E108 C135	N107-S110 WeakPolarHBondContact O-CB 3.33Å; N107-S110 PolarHBondContact O-N 3.13Å; E108-S110 PolarHBondContact O-N 3.16Å; S110-C135 PolarHBondContact O-SG 3.33Å
111	V	95.2	Very high	94.9	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.006	19%	0.19	C	C	.	.			trans	-122.5	120.2	-175.1	178.2	0	0	0	0	110.5	M24 K91 L95 I106 E108 F133 C135	M24-V111 HydrophobicContact CE-CB 4.43Å; M24-V111 HydrophobicContact CE-CG1 3.46Å; M24-V111 VanDerWaalsContact CE-CG1 3.46Å; M24-V111 HydrophobicContact CE-CG2 4.07Å; M24-V111 HydrophobicContact SD-CG1 3.84Å; M24-V111 HydrophobicContact SD-CG2 4.37Å; K91-V111 HydrophobicContact CD-CG1 4.46Å; K91-V111 HydrophobicContact CG-CG1 4.34Å; K91-V111 PolarHBondContact NZ-O 2.94Å; L95-V111 HydrophobicContact CD2-CG2 4.05Å; I106-V111 HydrophobicContact CG2-CG2 3.8Å; E108-V111 PolarHBondContact O-N 3.46Å; V111-F133 HydrophobicContact CG1-CB 3.68Å; V111-F133 HydrophobicContact CG1-CD1 3.89Å; V111-F133 HydrophobicContact CG1-CG 4.08Å; V111-C135 HydrophobicContact CG2-CB 4.34Å
112	D	94.8	Very high	94.5	Very high	92 Å²	92	34 Å²	34	49%	0.492	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	139	176.6	-65	-49.9	0	0	0	110.7	V114 F133 I134	D112-V114 HydrophobicContact CB-CG1 4.13Å; D112-F133 CarbonylContact O-C 3.41Å; D112-F133 WeakPolarHBondContact O-CA 3.5Å; D112-I134 HydrophobicContact CB-CG2 4.44Å; D112-I134 PolarHBondContact N-O 3.11Å; D112-I134 PolarHBondContact O-N 3.34Å
113	E	95.8	Very high	93.9	Very high	39 Å²	39	37.1 Å²	37.1	18%	0.182	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	120.9	165.9	-159	-174	167.6	0	0	108.5	R116 H131 V132 F133 L264	E113-R116 IonicContact OE1-CZ 3.6Å; E113-R116 IonicContact OE1-NE 2.63Å; E113-R116 PolarHBondContact OE1-NE 2.9Å; E113-R116 IonicContact OE1-NH2 3.22Å; E113-R116 PolarHBondContact OE1-NH2 3.44Å; E113-H131 IonicContact OE1-CE1 2.81Å; E113-H131 IonicContact OE1-CG 2.72Å; E113-H131 IonicContact OE1-ND1 3.11Å; E113-H131 PolarHBondContact OE1-ND1 2.86Å; E113-V132 CarbonylContact C-O 3.55Å; E113-V132 WeakPolarHBondContact CA-O 3.11Å; E113-F133 HydrophobicContact CB-CD1 3.76Å; E113-F133 HydrophobicContact CB-CE1 3.57Å; E113-F133 HydrophobicContact CB-CZ 4.47Å; E113-F133 HydrophobicContact CG-CD1 3.96Å; E113-F133 HydrophobicContact CG-CE1 3.6Å; E113-F133 HydrophobicContact CG-CZ 4.05Å; E113-L264 HydrophobicContact CB-CD2 4.04Å; E113-L264 VanDerWaalsContact CD-CD2 3.45Å; E113-L264 HydrophobicContact CG-CD2 3.43Å; E113-L264 VanDerWaalsContact CG-CD2 3.43Å; E113-L264 WeakPolarHBondContact OE1-CD2 3.34Å
114	V	95	Very high	93.6	Very high	11 Å²	11	38.2 Å²	38.2	7%	0.067	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	-3.6	-170.4	-69.5	0	0	0	0	113	D112 V132 I134 V192 I197 V198	D112-V114 HydrophobicContact CB-CG1 4.13Å; V114-V132 HydrophobicContact CG2-CG1 4.08Å; V114-V132 PolarHBondContact N-O 3.36Å; V114-I134 HydrophobicContact CB-CG2 4.21Å; V114-I134 HydrophobicContact CG1-CG2 3.44Å; V114-I134 VanDerWaalsContact CG1-CG2 3.44Å; V114-I134 HydrophobicContact CG2-CB 4.05Å; V114-I134 HydrophobicContact CG2-CG2 3.72Å; V114-V192 HydrophobicContact CB-CG1 4.23Å; V114-V192 HydrophobicContact CG2-CG1 3.55Å; V114-V192 HydrophobicContact CG2-CG2 4.45Å; V114-I197 CarbonylContact O-C 3.51Å; V114-I197 VanDerWaalsContact O-CA 3.25Å; V114-I197 WeakPolarHBondContact O-CA 3.37Å; V114-V198 PolarHBondContact O-N 2.7Å
115	G	96.3	Very high	93.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	167.9	170.7	0	0	0	0	0	115.1	V132 V198	G115-V132 PolarHBondContact N-O 2.96Å; G115-V132 PolarHBondContact O-N 3.28Å; G115-V198 CarbonylContact C-O 3.54Å; G115-V198 WeakPolarHBondContact CA-O 3.28Å
116	R	96.8	Very high	92.8	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	123.1	170	-163.1	67.6	62.5	74.3	4.4	109	E113 W118 E129 V130 H131 V198 L199 A200 I268 D274	E113-R116 IonicContact OE1-CZ 3.6Å; E113-R116 IonicContact OE1-NE 2.63Å; E113-R116 PolarHBondContact OE1-NE 2.9Å; E113-R116 IonicContact OE1-NH2 3.22Å; E113-R116 PolarHBondContact OE1-NH2 3.44Å; R116-W118 HydrophobicContact CB-CH2 3.72Å; R116-W118 HydrophobicContact CB-CZ2 4.15Å; R116-W118 HydrophobicContact CB-CZ3 4.07Å; R116-W118 HydrophobicContact CG-CD2 4.43Å; R116-W118 HydrophobicContact CG-CH2 3.5Å; R116-W118 VanDerWaalsContact CG-CH2 3.5Å; R116-W118 HydrophobicContact CG-CZ2 3.37Å; R116-W118 HydrophobicContact CG-CZ3 4.08Å; R116-E129 VanDerWaalsContact CD-OE1 3.22Å; R116-E129 WeakPolarHBondContact CD-OE1 3.37Å; R116-E129 HydrophobicContact CG-CG 4.18Å; R116-E129 IonicContact CZ-OE1 2.65Å; R116-E129 IonicContact NE-OE1 3.89Å; R116-E129 IonicContact NH1-OE1 3.18Å; R116-E129 PolarHBondContact NH1-OE1 3.36Å; R116-V130 WeakPolarHBondContact CA-O 3.38Å; R116-V130 WeakPolarHBondContact CD-O 3.12Å; R116-H131 VanDerWaalsContact CZ-ND1 3.31Å; R116-H131 PolarHBondContact NE-CE1 3.27Å; R116-H131 VanDerWaalsContact NE-CE1 3.32Å; R116-H131 PolarHBondContact NE-ND1 2.91Å; R116-H131 PolarHBondContact NH1-CE1 3.37Å; R116-H131 PolarHBondContact NH2-CE1 3.32Å; R116-H131 PolarHBondContact NH2-ND1 3.29Å; R116-V198 PolarHBondContact N-O 3.1Å; R116-L199 HydrophobicContact CB-CD2 3.72Å; R116-L199 WeakPolarHBondContact O-CA 3.18Å; R116-A200 PolarHBondContact O-N 3.11Å; R116-I268 HydrophobicContact CB-CD1 3.98Å; R116-I268 HydrophobicContact CG-CD1 4.29Å; R116-D274 IonicContact NH1-OD1 3.75Å; R116-D274 PolarHBondContact NH1-OD1 3.1Å; R116-D274 VanDerWaalsContact NH1-OD1 3.14Å; R116-D274 IonicContact NH1-OD2 3.71Å
117	L	97.6	Very high	92.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.3	179.5	-47	175.4	0	0	0	109.3	F119 E129 V130 V132 W188 V198 A200	L117-F119 HydrophobicContact CB-CD2 4.35Å; L117-F119 HydrophobicContact CB-CE2 3.49Å; L117-F119 VanDerWaalsContact CB-CE2 3.49Å; L117-F119 HydrophobicContact CB-CZ 3.79Å; L117-F119 HydrophobicContact CD1-CE2 4.1Å; L117-F119 HydrophobicContact CD1-CZ 3.82Å; L117-F119 HydrophobicContact CG-CE2 4.45Å; L117-F119 HydrophobicContact CG-CZ 4.45Å; L117-E129 CarbonylContact O-C 3.39Å; L117-E129 WeakPolarHBondContact O-CA 3.46Å; L117-V130 HydrophobicContact CB-CB 4.27Å; L117-V130 PolarHBondContact N-O 2.85Å; L117-V130 PolarHBondContact O-N 2.81Å; L117-V132 HydrophobicContact CD1-CG2 3.58Å; L117-V132 HydrophobicContact CD2-CG2 4.48Å; L117-V132 HydrophobicContact CG-CG2 3.63Å; L117-W188 HydrophobicContact CD1-CD2 4.09Å; L117-W188 HydrophobicContact CD1-CH2 4.48Å; L117-W188 HydrophobicContact CD1-CZ2 3.92Å; L117-W188 HydrophobicContact CD2-CG 4.42Å; L117-V198 HydrophobicContact CD2-CG1 4.17Å; L117-A200 CarbonylContact C-O 3.45Å; L117-A200 VanDerWaalsContact CA-O 3.26Å; L117-A200 WeakPolarHBondContact CA-O 3.15Å; L117-A200 HydrophobicContact CD2-CB 3.67Å
118	W	95.1	Very high	92.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.9	172.8	-65	-87.4	0	0	0	109.9	R116 M128 L199 A200 W201 F202 L273 L280 W283 M284	R116-W118 HydrophobicContact CB-CH2 3.72Å; R116-W118 HydrophobicContact CB-CZ2 4.15Å; R116-W118 HydrophobicContact CB-CZ3 4.07Å; R116-W118 HydrophobicContact CG-CD2 4.43Å; R116-W118 HydrophobicContact CG-CH2 3.5Å; R116-W118 VanDerWaalsContact CG-CH2 3.5Å; R116-W118 HydrophobicContact CG-CZ2 3.37Å; R116-W118 HydrophobicContact CG-CZ3 4.08Å; W118-M128 CarbonylContact C-O 3.55Å; W118-M128 VanDerWaalsContact CA-O 3.29Å; W118-M128 WeakPolarHBondContact CA-O 3.22Å; W118-L199 HydrophobicContact CH2-CD2 4.17Å; W118-L199 HydrophobicContact CZ3-CB 4.34Å; W118-L199 HydrophobicContact CZ3-CD2 4.22Å; W118-A200 PolarHBondContact N-O 2.87Å; W118-W201 HydrophobicContact CB-CB 4.31Å; W118-W201 CarbonylContact O-C 3.55Å; W118-W201 WeakPolarHBondContact O-CA 3.5Å; W118-W201 VanDerWaalsContact O-CD1 3.22Å; W118-F202 PolarHBondContact O-N 2.88Å; W118-L273 HydrophobicContact CH2-CB 4.32Å; W118-L273 HydrophobicContact CH2-CD1 3.67Å; W118-L273 HydrophobicContact CZ2-CB 4.22Å; W118-L273 HydrophobicContact CZ2-CD1 4.39Å; W118-L273 HydrophobicContact CZ3-CD1 4.27Å; W118-L280 HydrophobicContact CD2-CD1 3.7Å; W118-L280 HydrophobicContact CD2-CD2 4.39Å; W118-L280 HydrophobicContact CE3-CD1 4.05Å; W118-L280 HydrophobicContact CG-CD1 4.14Å; W118-L280 HydrophobicContact CG-CD2 4.13Å; W118-L280 HydrophobicContact CH2-CD1 4.26Å; W118-L280 HydrophobicContact CZ2-CD1 3.91Å; W118-L280 HydrophobicContact CZ3-CD1 4.33Å; W118-W283 HydrophobicContact CE3-CH2 4.07Å; W118-W283 AromaticContact CE3-CZ3 3.69Å; W118-W283 HydrophobicContact CE3-CZ3 3.69Å; W118-W283 AromaticContact CZ3-CH2 3.85Å; W118-W283 HydrophobicContact CZ3-CH2 3.85Å; W118-W283 AromaticContact CZ3-CZ3 3.76Å; W118-W283 HydrophobicContact CZ3-CZ3 3.76Å; W118-M284 HydrophobicContact CB-CE 3.67Å; W118-M284 HydrophobicContact CG-CE 4.03Å
119	F	95.4	Very high	92.8	Very high	20 Å²	20	31.3 Å²	31.3	9%	0.088	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.8	177.4	-55.8	-88.9	0	0	0	109.8	L117 F121 C127 M128 V130 D184 F202 Y204	L117-F119 HydrophobicContact CB-CD2 4.35Å; L117-F119 HydrophobicContact CB-CE2 3.49Å; L117-F119 VanDerWaalsContact CB-CE2 3.49Å; L117-F119 HydrophobicContact CB-CZ 3.79Å; L117-F119 HydrophobicContact CD1-CE2 4.1Å; L117-F119 HydrophobicContact CD1-CZ 3.82Å; L117-F119 HydrophobicContact CG-CE2 4.45Å; L117-F119 HydrophobicContact CG-CZ 4.45Å; F119-F121 HydrophobicContact CB-CE2 3.73Å; F119-F121 HydrophobicContact CB-CZ 4.14Å; F119-C127 WeakPolarHBondContact O-CA 3.42Å; F119-M128 HydrophobicContact CB-CB 4.19Å; F119-M128 HydrophobicContact CD2-CB 4.47Å; F119-M128 PolarHBondContact N-O 2.92Å; F119-M128 PolarHBondContact O-N 2.89Å; F119-V130 HydrophobicContact CD2-CG2 3.73Å; F119-V130 HydrophobicContact CE2-CB 4.08Å; F119-V130 HydrophobicContact CE2-CG2 3.56Å; F119-D184 WeakPolarHBondContact CE1-OD2 3.5Å; F119-F202 WeakPolarHBondContact CA-O 3.3Å; F119-F202 HydrophobicContact CD1-CB 3.93Å; F119-F202 HydrophobicContact CD1-CD2 4.08Å; F119-F202 HydrophobicContact CD1-CG 4.45Å; F119-F202 HydrophobicContact CE1-CB 4.14Å; F119-F202 AromaticContact CE1-CD2 3.54Å; F119-F202 HydrophobicContact CE1-CD2 3.54Å; F119-F202 HydrophobicContact CE1-CE2 4.38Å; F119-F202 HydrophobicContact CE1-CG 4.19Å; F119-F202 HydrophobicContact CZ-CD2 4.18Å; F119-Y204 HydrophobicContact CD1-CD2 4.01Å; F119-Y204 AromaticContact CD1-CE2 3.72Å; F119-Y204 HydrophobicContact CD1-CE2 3.72Å; F119-Y204 HydrophobicContact CE1-CE2 4.02Å
120	T	93.7	Very high	93.1	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.1	170.3	57	0	0	0	0	108.9	W15 C127 W201 F202 H203 Y204	W15-T120 HydrophobicContact CG-CG2 4.35Å; T120-C127 HydrophobicContact CG2-CB 4.25Å; T120-W201 PolarHBondContact OG1-NE1 3.48Å; T120-F202 PolarHBondContact N-O 3.02Å; T120-F202 VanDerWaalsContact N-O 3.1Å; T120-H203 CarbonylContact O-C 3.59Å; T120-H203 WeakPolarHBondContact O-CA 3.38Å; T120-H203 PolarHBondContact O-ND1 3.06Å; T120-H203 PolarHBondContact OG1-ND1 3.35Å; T120-Y204 PolarHBondContact O-N 3.15Å
121	F	91.8	Very high	93.3	Very high	12 Å²	12	25.5 Å²	25.5	5%	0.053	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.6	-178.1	-64.8	-93.8	0	0	0	109.4	F71 F119 E123 T124 M128 Y204 Y233	F71-F121 HydrophobicContact CE1-CZ 4.11Å; F71-F121 HydrophobicContact CE2-CE1 4.25Å; F71-F121 HydrophobicContact CE2-CZ 4.49Å; F71-F121 AromaticContact CZ-CE1 3.58Å; F71-F121 HydrophobicContact CZ-CE1 3.58Å; F71-F121 HydrophobicContact CZ-CE2 4.44Å; F71-F121 AromaticContact CZ-CZ 3.53Å; F71-F121 HydrophobicContact CZ-CZ 3.53Å; F119-F121 HydrophobicContact CB-CE2 3.73Å; F119-F121 HydrophobicContact CB-CZ 4.14Å; F121-E123 HydrophobicContact CB-CG 4.19Å; F121-E123 PolarHBondContact O-N 3.48Å; F121-T124 PolarHBondContact O-N 2.93Å; F121-T124 VanDerWaalsContact O-N 3.12Å; F121-M128 HydrophobicContact CD2-SD 4.44Å; F121-M128 HydrophobicContact CE2-CG 4.3Å; F121-M128 HydrophobicContact CE2-SD 3.59Å; F121-M128 VanDerWaalsContact CE2-SD 3.59Å; F121-M128 HydrophobicContact CZ-SD 4.26Å; F121-Y204 WeakPolarHBondContact CA-O 3.27Å; F121-Y204 HydrophobicContact CD1-CG 4.17Å; F121-Y204 HydrophobicContact CE1-CD1 4.17Å; F121-Y204 HydrophobicContact CE1-CD2 4.22Å; F121-Y204 AromaticContact CE1-CG 3.69Å; F121-Y204 HydrophobicContact CE1-CG 3.69Å; F121-Y204 HydrophobicContact CZ-CD2 4.38Å; F121-Y204 HydrophobicContact CZ-CG 4.29Å; F121-Y233 HydrophobicContact CD1-CD1 4.47Å; F121-Y233 AromaticContact CD1-CE1 3.86Å; F121-Y233 HydrophobicContact CD1-CE1 3.86Å; F121-Y233 HydrophobicContact CE1-CE1 4.15Å
122	A	89	Confident	93.5	Very high	38 Å²	38	25.5 Å²	25.5	31%	0.314	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.8	179.6	0	0	0	0	0	112.8	Y204 L205	A122-Y204 PolarHBondContact N-O 2.78Å; A122-L205 HydrophobicContact CB-CD1 3.84Å; A122-L205 HydrophobicContact CB-CG 3.78Å
123	E	85.8	Confident	93.7	Very high	66 Å²	66	21.2 Å²	21.2	31%	0.308	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-8.6	178.8	60.7	-105.1	-130.7	0	0	115.4	F121 R206 Y233	F121-E123 HydrophobicContact CB-CG 4.19Å; F121-E123 PolarHBondContact O-N 3.48Å; E123-R206 IonicContact OE1-CZ 3.44Å; E123-R206 IonicContact OE1-NE 3.8Å; E123-R206 PolarHBondContact OE1-NE 2.89Å; E123-R206 VanDerWaalsContact OE1-NE 3.11Å; E123-R206 IonicContact OE1-NH2 2.79Å; E123-R206 PolarHBondContact OE1-NH2 2.8Å; E123-Y233 VanDerWaalsContact OE1-CE1 3.32Å; E123-Y233 WeakPolarHBondContact OE1-CE1 3.17Å; E123-Y233 PolarHBondContact OE1-OH 3.01Å
124	T	87.4	Confident	93.8	Very high	55 Å²	55	19.3 Å²	19.3	34%	0.337	11%	0.107	S	C	.	.			trans	-135.7	158.3	-177.9	78.2	0	0	0	0	112.7	F121 E126	F121-T124 PolarHBondContact O-N 2.93Å; F121-T124 VanDerWaalsContact O-N 3.12Å; T124-E126 VanDerWaalsContact C-N 3.27Å; T124-E126 PolarHBondContact OG1-N 3.49Å
125	T	85.3	Confident	93.8	Very high	77 Å²	77	18.9 Å²	18.9	47%	0.472	11%	0.105	S	C	.	.	S	Bend	trans	-95.2	20.3	170.1	56.9	0	0	0	0	111.7	W15 V16	W15-T125 CarbonylContact C-O 3.51Å; W15-T125 WeakPolarHBondContact CA-O 3.35Å; W15-T125 VanDerWaalsContact CB-O 3.27Å; W15-T125 WeakPolarHBondContact CB-O 3.36Å; V16-T125 PolarHBondContact N-O 2.89Å
126	E	87.4	Confident	93.7	Very high	58 Å²	58	22.2 Å²	22.2	27%	0.271	12%	0.117	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.9	179.3	-57.1	-168.2	155.4	0	0	109.9	K19 T124	K19-E126 VanDerWaalsContact CE-CD 3.44Å; K19-E126 WeakPolarHBondContact CE-OE1 3.15Å; K19-E126 WeakPolarHBondContact CE-OE2 3.42Å; K19-E126 IonicContact NZ-OE1 3.88Å; K19-E126 PolarHBondContact NZ-OE1 2.83Å; K19-E126 IonicContact NZ-OE2 2.73Å; K19-E126 PolarHBondContact NZ-OE2 3.45Å; T124-E126 VanDerWaalsContact C-N 3.27Å; T124-E126 PolarHBondContact OG1-N 3.49Å
127	C	90.7	Very high	93.2	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	119	165.1	-178.3	0	0	0	0	107.7	W15 N17 R18 K19 F119 T120	W15-C127 HydrophobicContact CB-CB 4.04Å; W15-C127 HydrophobicContact CD2-CB 3.65Å; W15-C127 HydrophobicContact CE3-CB 3.9Å; W15-C127 HydrophobicContact CG-CB 3.74Å; N17-C127 PolarHBondContact O-N 3.12Å; R18-C127 CarbonylContact C-O 3.48Å; R18-C127 WeakPolarHBondContact CA-O 3.15Å; K19-C127 PolarHBondContact N-O 2.91Å; F119-C127 WeakPolarHBondContact O-CA 3.42Å; T120-C127 HydrophobicContact CG2-CB 4.25Å
128	M	94.9	Very high	93	Very high	30 Å²	30	27.5 Å²	27.5	15%	0.148	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	118.5	171.1	-59.5	178.1	52.8	0	0	108	Y21 W118 F119 F121	Y21-M128 HydrophobicContact CD1-CE 4.02Å; Y21-M128 HydrophobicContact CD2-CB 3.88Å; Y21-M128 HydrophobicContact CD2-CE 3.76Å; Y21-M128 HydrophobicContact CD2-CG 4.07Å; Y21-M128 HydrophobicContact CE1-CE 4.03Å; Y21-M128 HydrophobicContact CE2-CB 3.97Å; Y21-M128 HydrophobicContact CE2-CE 3.74Å; Y21-M128 HydrophobicContact CE2-CG 3.65Å; Y21-M128 HydrophobicContact CE2-SD 4.29Å; Y21-M128 HydrophobicContact CG-CE 3.91Å; W118-M128 CarbonylContact C-O 3.55Å; W118-M128 VanDerWaalsContact CA-O 3.29Å; W118-M128 WeakPolarHBondContact CA-O 3.22Å; F119-M128 HydrophobicContact CB-CB 4.19Å; F119-M128 HydrophobicContact CD2-CB 4.47Å; F119-M128 PolarHBondContact N-O 2.92Å; F119-M128 PolarHBondContact O-N 2.89Å; F121-M128 HydrophobicContact CD2-SD 4.44Å; F121-M128 HydrophobicContact CE2-CG 4.3Å; F121-M128 HydrophobicContact CE2-SD 3.59Å; F121-M128 VanDerWaalsContact CE2-SD 3.59Å; F121-M128 HydrophobicContact CZ-SD 4.26Å
129	E	95.2	Very high	92.6	Very high	6 Å²	6	31.7 Å²	31.7	3%	0.028	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.8	166.5	170.2	177.5	-150.3	0	0	108.9	R18 K19 L20 Y21 R116 L117 H131	R18-E129 HydrophobicContact CG-CB 4.14Å; R18-E129 IonicContact CZ-OE1 2.65Å; R18-E129 IonicContact CZ-OE2 2.87Å; R18-E129 IonicContact NE-OE1 3.63Å; R18-E129 IonicContact NE-OE2 3.05Å; R18-E129 PolarHBondContact NE-OE2 2.89Å; R18-E129 IonicContact NH2-OE1 3.52Å; R18-E129 PolarHBondContact NH2-OE1 3.12Å; R18-E129 IonicContact NH2-OE2 3.86Å; R18-E129 PolarHBondContact NH2-OE2 3.29Å; K19-E129 PolarHBondContact O-N 3.42Å; L20-E129 CarbonylContact C-O 3.52Å; L20-E129 WeakPolarHBondContact CA-O 3.45Å; L20-E129 HydrophobicContact CD2-CB 4.07Å; L20-E129 HydrophobicContact CD2-CG 4.02Å; L20-E129 WeakPolarHBondContact CD2-OE2 3.44Å; Y21-E129 PolarHBondContact N-O 2.74Å; R116-E129 VanDerWaalsContact CD-OE1 3.22Å; R116-E129 WeakPolarHBondContact CD-OE1 3.37Å; R116-E129 HydrophobicContact CG-CG 4.18Å; R116-E129 IonicContact CZ-OE1 2.65Å; R116-E129 IonicContact NE-OE1 3.89Å; R116-E129 IonicContact NH1-OE1 3.18Å; R116-E129 PolarHBondContact NH1-OE1 3.36Å; L117-E129 CarbonylContact O-C 3.39Å; L117-E129 WeakPolarHBondContact O-CA 3.46Å; E129-H131 IonicContact OE1-NE2 3.42Å
130	V	98.3	Very high	92	Very high	12 Å²	12	31.4 Å²	31.4	7%	0.073	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	118.4	-179.6	-178.1	0	0	0	0	109.5	Y21 L23 R116 L117 F119 V132	Y21-V130 WeakPolarHBondContact O-CA 3.24Å; L23-V130 HydrophobicContact CB-CG1 3.64Å; R116-V130 WeakPolarHBondContact CA-O 3.38Å; R116-V130 WeakPolarHBondContact CD-O 3.12Å; L117-V130 HydrophobicContact CB-CB 4.27Å; L117-V130 PolarHBondContact N-O 2.85Å; L117-V130 PolarHBondContact O-N 2.81Å; F119-V130 HydrophobicContact CD2-CG2 3.73Å; F119-V130 HydrophobicContact CE2-CB 4.08Å; F119-V130 HydrophobicContact CE2-CG2 3.56Å; V130-V132 HydrophobicContact CG1-CG2 4.33Å
131	H	98.1	Very high	91.2	Very high	15 Å²	15	35.1 Å²	35.1	7%	0.069	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	118.7	167.1	-67.7	-115.1	0	0	0	109.1	Y21 T22 L23 P90 E113 R116 E129 F133	Y21-H131 PolarHBondContact O-N 2.87Å; T22-H131 CarbonylContact C-O 3.4Å; T22-H131 WeakPolarHBondContact CA-O 3.45Å; L23-H131 PolarHBondContact N-O 2.96Å; P90-H131 HydrophobicContact CB-CB 4.11Å; E113-H131 IonicContact OE1-CE1 2.81Å; E113-H131 IonicContact OE1-CG 2.72Å; E113-H131 IonicContact OE1-ND1 3.11Å; E113-H131 PolarHBondContact OE1-ND1 2.86Å; R116-H131 VanDerWaalsContact CZ-ND1 3.31Å; R116-H131 PolarHBondContact NE-CE1 3.27Å; R116-H131 VanDerWaalsContact NE-CE1 3.32Å; R116-H131 PolarHBondContact NE-ND1 2.91Å; R116-H131 PolarHBondContact NH1-CE1 3.37Å; R116-H131 PolarHBondContact NH2-CE1 3.32Å; R116-H131 PolarHBondContact NH2-ND1 3.29Å; E129-H131 IonicContact OE1-NE2 3.42Å; H131-F133 HydrophobicContact CB-CD2 4.3Å; H131-F133 HydrophobicContact CB-CE2 3.5Å; H131-F133 HydrophobicContact CB-CZ 3.89Å
132	V	98.7	Very high	90.3	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.4	-179.1	-174	0	0	0	0	109.4	L23 E113 V114 G115 L117 V130 W188	L23-V132 CarbonylContact O-C 3.58Å; L23-V132 WeakPolarHBondContact O-CA 3.27Å; E113-V132 CarbonylContact C-O 3.55Å; E113-V132 WeakPolarHBondContact CA-O 3.11Å; V114-V132 HydrophobicContact CG2-CG1 4.08Å; V114-V132 PolarHBondContact N-O 3.36Å; G115-V132 PolarHBondContact N-O 2.96Å; G115-V132 PolarHBondContact O-N 3.28Å; L117-V132 HydrophobicContact CD1-CG2 3.58Å; L117-V132 HydrophobicContact CD2-CG2 4.48Å; L117-V132 HydrophobicContact CG-CG2 3.63Å; V130-V132 HydrophobicContact CG1-CG2 4.33Å; V132-W188 HydrophobicContact CG1-CH2 4.32Å; V132-W188 HydrophobicContact CG1-CZ3 3.92Å
133	F	98.4	Very high	89.3	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.009	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	154	178.2	-63	-79.5	0	0	0	111.1	T22 L23 M24 L25 P90 K91 A94 V111 D112 E113 H131	T22-F133 HydrophobicContact CG2-CE2 4.19Å; L23-F133 PolarHBondContact O-N 2.9Å; M24-F133 WeakPolarHBondContact CA-O 3.49Å; M24-F133 HydrophobicContact CE-CB 3.63Å; M24-F133 HydrophobicContact CE-CG 4.3Å; M24-F133 HydrophobicContact SD-CB 3.58Å; M24-F133 VanDerWaalsContact SD-CB 3.58Å; L25-F133 PolarHBondContact N-O 3.21Å; P90-F133 HydrophobicContact CB-CE2 4.34Å; P90-F133 HydrophobicContact CB-CZ 4.21Å; K91-F133 HydrophobicContact CB-CE1 3.72Å; K91-F133 HydrophobicContact CB-CZ 3.77Å; K91-F133 HydrophobicContact CD-CE1 4.47Å; K91-F133 HydrophobicContact CG-CD1 4.2Å; K91-F133 HydrophobicContact CG-CE1 3.87Å; K91-F133 HydrophobicContact CG-CZ 4.32Å; A94-F133 HydrophobicContact CB-CD2 3.47Å; A94-F133 VanDerWaalsContact CB-CD2 3.47Å; A94-F133 HydrophobicContact CB-CE2 3.81Å; A94-F133 HydrophobicContact CB-CG 4.23Å; V111-F133 HydrophobicContact CG1-CB 3.68Å; V111-F133 HydrophobicContact CG1-CD1 3.89Å; V111-F133 HydrophobicContact CG1-CG 4.08Å; D112-F133 CarbonylContact O-C 3.41Å; D112-F133 WeakPolarHBondContact O-CA 3.5Å; E113-F133 HydrophobicContact CB-CD1 3.76Å; E113-F133 HydrophobicContact CB-CE1 3.57Å; E113-F133 HydrophobicContact CB-CZ 4.47Å; E113-F133 HydrophobicContact CG-CD1 3.96Å; E113-F133 HydrophobicContact CG-CE1 3.6Å; E113-F133 HydrophobicContact CG-CZ 4.05Å; H131-F133 HydrophobicContact CB-CD2 4.3Å; H131-F133 HydrophobicContact CB-CE2 3.5Å; H131-F133 HydrophobicContact CB-CZ 3.89Å
134	I	98.1	Very high	88.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	137.4	174	-168.6	162.6	0	0	0	111.6	L25 I27 D112 V114 R136 V192 L193	L25-I134 HydrophobicContact CB-CB 4.33Å; L25-I134 HydrophobicContact CB-CD1 4.11Å; L25-I134 HydrophobicContact CB-CG1 3.92Å; L25-I134 HydrophobicContact CD1-CD1 4.43Å; L25-I134 CarbonylContact O-C 3.56Å; L25-I134 VanDerWaalsContact O-CA 3.28Å; L25-I134 WeakPolarHBondContact O-CA 3.2Å; I27-I134 HydrophobicContact CD1-CD1 3.93Å; I27-I134 HydrophobicContact CG1-CD1 4.48Å; D112-I134 HydrophobicContact CB-CG2 4.44Å; D112-I134 PolarHBondContact N-O 3.11Å; D112-I134 PolarHBondContact O-N 3.34Å; V114-I134 HydrophobicContact CB-CG2 4.21Å; V114-I134 HydrophobicContact CG1-CG2 3.44Å; V114-I134 VanDerWaalsContact CG1-CG2 3.44Å; V114-I134 HydrophobicContact CG2-CB 4.05Å; V114-I134 HydrophobicContact CG2-CG2 3.72Å; I134-R136 HydrophobicContact CD1-CG 4.15Å; I134-R136 HydrophobicContact CG1-CG 4.01Å; I134-R136 HydrophobicContact CG2-CG 4.18Å; I134-V192 HydrophobicContact CD1-CG1 4.11Å; I134-L193 HydrophobicContact CD1-CD2 4.38Å
135	C	96.7	Very high	87.5	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.007	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	105.8	163.1	-173	0	0	0	0	108.7	L25 I27 I106 S110 V111	L25-C135 PolarHBondContact O-N 3.41Å; I27-C135 PolarHBondContact N-O 3.27Å; I106-C135 HydrophobicContact CD1-CB 3.96Å; I106-C135 HydrophobicContact CG2-CB 4.34Å; S110-C135 PolarHBondContact O-SG 3.33Å; V111-C135 HydrophobicContact CG2-CB 4.34Å
136	R	93.2	Very high	86.7	Confident	70 Å²	70	51.1 Å²	51.1	26%	0.264	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-23.2	-174.2	-65.5	-174.6	-177.2	-80.4	-4.1	114.2	I134 V192 L193	I134-R136 HydrophobicContact CD1-CG 4.15Å; I134-R136 HydrophobicContact CG1-CG 4.01Å; I134-R136 HydrophobicContact CG2-CG 4.18Å; R136-V192 PolarHBondContact NH1-O 2.82Å; R136-V192 PolarHBondContact NH2-O 3.23Å; R136-L193 PolarHBondContact NH1-O 3.02Å; R136-L193 VanDerWaalsContact NH1-O 3.12Å
137	T	86.7	Confident	86	Confident	102 Å²	102	50.9 Å²	50.9	63%	0.626	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.1	48.2	-171.7	60.3	0	0	0	0	110.2	T139	T137-T139 PolarHBondContact O-N 3.15Å
138	W	92.3	Very high	85.7	Confident	11 Å²	11	55 Å²	55	4%	0.042	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	133.7	173.3	-179.6	79.9	0	0	0	109.1	V26 I27 Y28 L104 I106 P140 W149 W160	V26-W138 HydrophobicContact CG1-CB 3.57Å; V26-W138 HydrophobicContact CG1-CD2 4.33Å; V26-W138 HydrophobicContact CG1-CG 3.76Å; I27-W138 WeakPolarHBondContact O-CB 3.41Å; I27-W138 PolarHBondContact O-N 2.85Å; Y28-W138 AromaticContact CD2-CE3 3.83Å; Y28-W138 HydrophobicContact CD2-CE3 3.83Å; Y28-W138 AromaticContact CD2-CZ3 3.98Å; Y28-W138 HydrophobicContact CD2-CZ3 3.98Å; Y28-W138 WeakPolarHBondContact CD2-O 3.39Å; Y28-W138 HydrophobicContact CG-CE3 4.24Å; Y28-W138 HydrophobicContact CG-CZ3 4.36Å; L104-W138 HydrophobicContact CD1-CZ2 4.29Å; L104-W138 HydrophobicContact CD2-CH2 4.22Å; L104-W138 HydrophobicContact CD2-CZ2 3.46Å; L104-W138 VanDerWaalsContact CD2-CZ2 3.46Å; I106-W138 VanDerWaalsContact CD1-CD1 3.42Å; I106-W138 HydrophobicContact CD1-CG 4.22Å; W138-P140 HydrophobicContact CE3-CG 4.5Å; W138-P140 HydrophobicContact CH2-CB 3.76Å; W138-P140 HydrophobicContact CH2-CG 3.67Å; W138-P140 HydrophobicContact CZ2-CB 4.31Å; W138-P140 HydrophobicContact CZ3-CB 4.24Å; W138-P140 HydrophobicContact CZ3-CG 3.63Å; W138-W149 AromaticContact CH2-CE3 3.89Å; W138-W149 HydrophobicContact CH2-CE3 3.89Å; W138-W149 HydrophobicContact CH2-CZ3 4.07Å; W138-W149 HydrophobicContact CZ3-CE3 4.04Å; W138-W149 AromaticContact CZ3-CZ3 3.77Å; W138-W149 HydrophobicContact CZ3-CZ3 3.77Å; W138-W160 AromaticContact CE3-CH2 3.87Å; W138-W160 HydrophobicContact CE3-CH2 3.87Å; W138-W160 HydrophobicContact CE3-CZ2 4.19Å; W138-W160 HydrophobicContact CH2-CZ2 4.45Å; W138-W160 AromaticContact CZ3-CH2 3.99Å; W138-W160 HydrophobicContact CZ3-CH2 3.99Å; W138-W160 AromaticContact CZ3-CZ2 3.82Å; W138-W160 HydrophobicContact CZ3-CZ2 3.82Å
139	T	86.7	Confident	85.6	Confident	88 Å²	88	54.8 Å²	54.8	54%	0.54	31%	0.306	S	S	.	.			trans	-125.1	140.8	172.6	52.8	0	0	0	0	108.9	T137 T141	T137-T139 PolarHBondContact O-N 3.15Å; T139-T141 PolarHBondContact O-N 2.9Å
140	P	82.9	Confident	85.6	Confident	15 Å²	15	54.5 Å²	54.5	10%	0.097	31%	0.305	C	S	.	.			trans	-62.2	135	176.7	-16.5	25.2	0	0	0	111.5	Y28 W138 V147 W149	Y28-P140 HydrophobicContact CE2-CG 4.02Å; W138-P140 HydrophobicContact CE3-CG 4.5Å; W138-P140 HydrophobicContact CH2-CB 3.76Å; W138-P140 HydrophobicContact CH2-CG 3.67Å; W138-P140 HydrophobicContact CZ2-CB 4.31Å; W138-P140 HydrophobicContact CZ3-CB 4.24Å; W138-P140 HydrophobicContact CZ3-CG 3.63Å; P140-V147 HydrophobicContact CB-CB 4.48Å; P140-V147 HydrophobicContact CB-CG1 3.05Å; P140-V147 HydrophobicContact CG-CG1 3.96Å; P140-W149 HydrophobicContact CG-CE3 4.43Å; P140-W149 HydrophobicContact CG-CH2 3.63Å; P140-W149 HydrophobicContact CG-CZ2 3.95Å; P140-W149 HydrophobicContact CG-CZ3 3.91Å
141	T	78	Confident	85.5	Confident	78 Å²	78	55.9 Å²	55.9	48%	0.479	31%	0.314	S	S	.	.			trans	-82.7	134.2	174.3	-58.7	0	0	0	0	109.4	T139 E148	T139-T141 PolarHBondContact O-N 2.9Å; T141-E148 PolarHBondContact O-N 3.47Å; T141-E148 VanDerWaalsContact O-N 3.12Å
142	L	72.8	Confident	85.5	Confident	130 Å²	130	58.1 Å²	58.1	68%	0.681	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	113.9	173.4	-72.1	165.3	0	0	0	109.4	V147	L142-V147 HydrophobicContact CD2-CG2 3.83Å
143	N	68.5	Low	85.4	Confident	94 Å²	94	59.5 Å²	59.5	50%	0.503	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	92.5	169.5	-169.1	-6.7	0	0	0	108.7	H145 T146 E148	N143-H145 PolarHBondContact O-N 2.93Å; N143-T146 PolarHBondContact N-O 3.44Å; N143-T146 PolarHBondContact O-N 2.9Å; N143-T146 VanDerWaalsContact O-N 3.14Å; N143-T146 PolarHBondContact O-OG1 2.72Å; N143-E148 HydrophobicContact CB-CG 4.16Å; N143-E148 PolarHBondContact ND2-OE1 2.95Å
144	G	71.2	Confident	85.3	Confident	66 Å²	66	68.5 Å²	68.5	68%	0.68	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	-114.7	-171.5	0	0	0	0	0	111.8
145	H	63.3	Low	85.2	Confident	200 Å²	200	71.7 Å²	71.7	93%	0.926	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.4	177.1	-59.3	121.7	0	0	0	113.4	N143	N143-H145 PolarHBondContact O-N 2.93Å
146	T	67.7	Low	85.2	Confident	95 Å²	95	71.7 Å²	71.7	58%	0.583	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	144.3	-178.4	46.6	0	0	0	0	110.7	N143	N143-T146 PolarHBondContact N-O 3.44Å; N143-T146 PolarHBondContact O-N 2.9Å; N143-T146 VanDerWaalsContact O-N 3.14Å; N143-T146 PolarHBondContact O-OG1 2.72Å
147	V	74.1	Confident	85.5	Confident	52 Å²	52	70.7 Å²	70.7	32%	0.315	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.4	176.9	175	0	0	0	0	108.9	P140 L142 W149	P140-V147 HydrophobicContact CB-CB 4.48Å; P140-V147 HydrophobicContact CB-CG1 3.05Å; P140-V147 HydrophobicContact CG-CG1 3.96Å; L142-V147 HydrophobicContact CD2-CG2 3.83Å; V147-W149 HydrophobicContact CG1-CD2 4.13Å; V147-W149 HydrophobicContact CG1-CG 4.17Å; V147-W149 HydrophobicContact CG1-CZ2 4.15Å; V147-W149 VanDerWaalsContact CG1-NE1 3.34Å; V147-W149 PolarHBondContact O-N 3.32Å; V147-W149 VanDerWaalsContact O-N 3.12Å
148	E	84.3	Confident	86	Confident	86 Å²	86	65.9 Å²	65.9	40%	0.402	36%	0.357	S	S	.	.			trans	-80.1	91.8	175.2	-69.5	-177.8	175	0	0	110.4	T141 N143	T141-E148 PolarHBondContact O-N 3.47Å; T141-E148 VanDerWaalsContact O-N 3.12Å; N143-E148 HydrophobicContact CB-CG 4.16Å; N143-E148 PolarHBondContact ND2-OE1 2.95Å
149	W	92.1	Very high	86.2	Confident	26 Å²	26	66.6 Å²	66.6	10%	0.098	37%	0.365	C	S	.	.			trans	-85.8	156.1	172.1	-71.7	109	0	0	0	111.2	Y28 P38 L39 I41 W138 P140 V147 W160	Y28-W149 HydrophobicContact CE1-CH2 4.15Å; Y28-W149 HydrophobicContact CE1-CZ3 4.49Å; Y28-W149 HydrophobicContact CE2-CH2 4.44Å; Y28-W149 AromaticContact CZ-CH2 3.99Å; P38-W149 HydrophobicContact CB-CE3 4.48Å; P38-W149 HydrophobicContact CB-CH2 3.97Å; P38-W149 HydrophobicContact CB-CZ3 3.6Å; L39-W149 HydrophobicContact CB-CB 4.32Å; L39-W149 HydrophobicContact CB-CD2 3.77Å; L39-W149 HydrophobicContact CB-CE3 4.38Å; L39-W149 HydrophobicContact CB-CG 3.72Å; L39-W149 HydrophobicContact CG-CD2 4.33Å; L39-W149 HydrophobicContact CG-CG 4.48Å; L39-W149 HydrophobicContact CG-CZ2 4.36Å; L39-W149 VanDerWaalsContact O-CE3 3.27Å; I41-W149 HydrophobicContact CD1-CB 4.35Å; I41-W149 HydrophobicContact CG1-CB 4.16Å; W138-W149 AromaticContact CH2-CE3 3.89Å; W138-W149 HydrophobicContact CH2-CE3 3.89Å; W138-W149 HydrophobicContact CH2-CZ3 4.07Å; W138-W149 HydrophobicContact CZ3-CE3 4.04Å; W138-W149 AromaticContact CZ3-CZ3 3.77Å; W138-W149 HydrophobicContact CZ3-CZ3 3.77Å; P140-W149 HydrophobicContact CG-CE3 4.43Å; P140-W149 HydrophobicContact CG-CH2 3.63Å; P140-W149 HydrophobicContact CG-CZ2 3.95Å; P140-W149 HydrophobicContact CG-CZ3 3.91Å; V147-W149 HydrophobicContact CG1-CD2 4.13Å; V147-W149 HydrophobicContact CG1-CG 4.17Å; V147-W149 HydrophobicContact CG1-CZ2 4.15Å; V147-W149 VanDerWaalsContact CG1-NE1 3.34Å; V147-W149 PolarHBondContact O-N 3.32Å; V147-W149 VanDerWaalsContact O-N 3.12Å; W149-W160 HydrophobicContact CE3-CZ2 4.47Å; W149-W160 HydrophobicContact CZ3-CZ2 4.41Å
150	P	95.7	Very high	86.6	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.342	C	S	.	.			trans	-59.8	148	173.2	26.3	-33	0	0	0	110.4	V40 I41 L63 S102 L104 P158 W160	V40-P150 CarbonylContact C-O 3.59Å; V40-P150 VanDerWaalsContact CA-O 3.27Å; V40-P150 WeakPolarHBondContact CA-O 3.22Å; V40-P150 WeakPolarHBondContact CG1-O 3.38Å; V40-P150 HydrophobicContact CG2-CG 4.19Å; I41-P150 PolarHBondContact N-O 3.17Å; L63-P150 HydrophobicContact CD1-CB 4.28Å; L63-P150 HydrophobicContact CD1-CG 3.79Å; L63-P150 HydrophobicContact CD2-CB 3.86Å; L63-P150 HydrophobicContact CD2-CG 4.01Å; S102-P150 CarbonylContact O-C 3.6Å; S102-P150 WeakPolarHBondContact O-CA 3.49Å; L104-P150 HydrophobicContact CD1-CB 4.07Å; L104-P150 HydrophobicContact CD2-CB 4.08Å; L104-P150 HydrophobicContact CG-CB 3.9Å; P150-P158 HydrophobicContact CB-CB 4.18Å; P150-P158 HydrophobicContact CB-CG 4.35Å; P150-W160 HydrophobicContact CG-CZ2 3.81Å
151	C	95.8	Very high	87.2	Confident	41 Å²	41	63.8 Å²	63.8	28%	0.277	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-126.9	161.3	-177.4	62.5	0	0	0	0	112.9	I41 S102 P158	I41-C151 HydrophobicContact CB-CB 3.99Å; I41-C151 CarbonylContact O-C 3.44Å; I41-C151 WeakPolarHBondContact O-CA 3.47Å; S102-C151 PolarHBondContact O-N 3.35Å; C151-P158 VanDerWaalsContact O-CD 3.24Å; C151-P158 WeakPolarHBondContact O-CD 3.41Å; C151-P158 VanDerWaalsContact O-CG 3.29Å; C151-P158 WeakPolarHBondContact O-CG 3.45Å
152	Y	97.9	Very high	87.8	Confident	63 Å²	63	61.3 Å²	61.3	25%	0.247	33%	0.329	C	S	.	.			trans	-67.1	142	172.1	-78.9	21.2	0	0	0	110.2	V40 I41 D42 I48 H157	V40-Y152 HydrophobicContact CG1-CD1 3.83Å; V40-Y152 HydrophobicContact CG1-CE1 3.81Å; I41-Y152 PolarHBondContact O-N 3.35Å; D42-Y152 HydrophobicContact CB-CD2 4.11Å; D42-Y152 HydrophobicContact CB-CE2 4.23Å; D42-Y152 HydrophobicContact CB-CG 4.38Å; I48-Y152 HydrophobicContact CD1-CE1 4.24Å; I48-Y152 HydrophobicContact CD1-CE2 4.45Å; Y152-H157 HydrophobicContact CD1-CB 4.02Å; Y152-H157 HydrophobicContact CD2-CB 4.11Å; Y152-H157 AromaticContact CD2-CD2 3.46Å; Y152-H157 VanDerWaalsContact CD2-CD2 3.46Å; Y152-H157 WeakPolarHBondContact CD2-CD2 3.24Å; Y152-H157 AromaticContact CD2-CE1 3.8Å; Y152-H157 AromaticContact CD2-CG 3.51Å; Y152-H157 AromaticContact CD2-ND1 3.71Å; Y152-H157 AromaticContact CD2-NE2 3.67Å; Y152-H157 HydrophobicContact CE1-CB 3.76Å; Y152-H157 HydrophobicContact CE2-CB 3.88Å; Y152-H157 AromaticContact CE2-CD2 3.98Å; Y152-H157 AromaticContact CE2-CE1 3.91Å; Y152-H157 AromaticContact CE2-CG 3.52Å; Y152-H157 AromaticContact CE2-ND1 3.47Å; Y152-H157 WeakPolarHBondContact CE2-ND1 3.43Å; Y152-H157 HydrophobicContact CG-CB 4.16Å; Y152-H157 AromaticContact CG-CD2 3.68Å; Y152-H157 AromaticContact CG-CG 3.88Å; Y152-H157 AromaticContact CZ-CG 3.89Å
153	T	97	Very high	88.7	Confident	29 Å²	29	55.2 Å²	55.2	18%	0.178	30%	0.297	C	S	.	.			trans	-129.2	171.2	175.2	66.6	0	0	0	0	109.1	E100 E101 E155 M156	E100-T153 WeakPolarHBondContact O-CG2 3.44Å; E101-T153 VanDerWaalsContact C-CG2 3.4Å; E101-T153 VanDerWaalsContact O-CG2 3.24Å; E101-T153 WeakPolarHBondContact O-CG2 3.49Å; E101-T153 PolarHBondContact O-OG1 2.62Å; T153-E155 PolarHBondContact O-N 2.89Å; T153-M156 PolarHBondContact N-O 2.94Å; T153-M156 PolarHBondContact OG1-N 3.03Å; T153-M156 PolarHBondContact OG1-O 3.12Å
154	E	95.4	Very high	89.7	Confident	191 Å²	191	52.8 Å²	52.8	89%	0.893	28%	0.283	S	S	*	.	S	Bend	trans	-60.2	-29.7	176.4	-67.1	-169.8	171.9	0	0	112.2
155	E	96.8	Very high	90.4	Very high	68 Å²	68	52.9 Å²	52.9	32%	0.318	27%	0.268	S	S	.	.	S	Bend	trans	-94.6	-36.9	-176.1	-175.1	159.7	-175.3	0	0	113.5	K67 Q68 T153	K67-E155 CarbonylContact C-O 3.49Å; K67-E155 WeakPolarHBondContact CA-O 3.42Å; K67-E155 WeakPolarHBondContact CE-OE1 3.32Å; K67-E155 IonicContact NZ-OE1 3.11Å; K67-E155 PolarHBondContact NZ-OE1 2.83Å; Q68-E155 PolarHBondContact N-O 2.9Å; T153-E155 PolarHBondContact O-N 2.89Å
156	M	97.9	Very high	91.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.4	-172	-72	-68.5	-166.8	0	0	111.7	K67 F79 E101 T153 P158	K67-M156 VanDerWaalsContact CA-SD 3.53Å; K67-M156 HydrophobicContact CB-CE 4.06Å; K67-M156 HydrophobicContact CB-SD 3.7Å; K67-M156 HydrophobicContact CD-CE 3.74Å; K67-M156 HydrophobicContact CD-SD 4.43Å; K67-M156 HydrophobicContact CG-CE 3.98Å; K67-M156 HydrophobicContact CG-SD 4.01Å; F79-M156 HydrophobicContact CD1-CG 4.47Å; F79-M156 HydrophobicContact CE1-CB 4.33Å; F79-M156 HydrophobicContact CE1-CG 4.46Å; E101-M156 HydrophobicContact CB-CB 4.14Å; E101-M156 HydrophobicContact CB-CG 3.82Å; E101-M156 HydrophobicContact CG-CG 3.97Å; E101-M156 WeakPolarHBondContact O-CB 3.46Å; E101-M156 VanDerWaalsContact OE1-CE 3.29Å; E101-M156 WeakPolarHBondContact OE1-CE 3.23Å; T153-M156 PolarHBondContact N-O 2.94Å; T153-M156 PolarHBondContact OG1-N 3.03Å; T153-M156 PolarHBondContact OG1-O 3.12Å; M156-P158 WeakPolarHBondContact O-CD 3.35Å
157	H	97.9	Very high	92.6	Very high	49 Å²	49	52 Å²	52	23%	0.227	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	98.3	167	-70	-178.1	0	0	0	109	L66 Q68 W76 Y152	L66-H157 HydrophobicContact CB-CB 4.39Å; L66-H157 PolarHBondContact N-O 2.84Å; L66-H157 PolarHBondContact O-N 2.63Å; Q68-H157 VanDerWaalsContact CD-CE1 3.46Å; Q68-H157 PolarHBondContact NE2-ND1 2.77Å; W76-H157 WeakPolarHBondContact CZ3-O 3.33Å; Y152-H157 HydrophobicContact CD1-CB 4.02Å; Y152-H157 HydrophobicContact CD2-CB 4.11Å; Y152-H157 AromaticContact CD2-CD2 3.46Å; Y152-H157 VanDerWaalsContact CD2-CD2 3.46Å; Y152-H157 WeakPolarHBondContact CD2-CD2 3.24Å; Y152-H157 AromaticContact CD2-CE1 3.8Å; Y152-H157 AromaticContact CD2-CG 3.51Å; Y152-H157 AromaticContact CD2-ND1 3.71Å; Y152-H157 AromaticContact CD2-NE2 3.67Å; Y152-H157 HydrophobicContact CE1-CB 3.76Å; Y152-H157 HydrophobicContact CE2-CB 3.88Å; Y152-H157 AromaticContact CE2-CD2 3.98Å; Y152-H157 AromaticContact CE2-CE1 3.91Å; Y152-H157 AromaticContact CE2-CG 3.52Å; Y152-H157 AromaticContact CE2-ND1 3.47Å; Y152-H157 WeakPolarHBondContact CE2-ND1 3.43Å; Y152-H157 HydrophobicContact CG-CB 4.16Å; Y152-H157 AromaticContact CG-CD2 3.68Å; Y152-H157 AromaticContact CG-CG 3.88Å; Y152-H157 AromaticContact CZ-CG 3.89Å
158	P	98.3	Very high	93.3	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	151.3	-177.5	-23.5	35	0	0	0	113.7	V40 L63 L64 F79 P150 C151 M156	V40-P158 HydrophobicContact CG1-CB 4.05Å; V40-P158 WeakPolarHBondContact CG1-O 3.46Å; V40-P158 HydrophobicContact CG2-CB 4.44Å; L63-P158 HydrophobicContact CD1-CB 3.81Å; L63-P158 HydrophobicContact CG-CB 4.33Å; L64-P158 CarbonylContact O-C 3.46Å; L64-P158 VanDerWaalsContact O-CA 3.3Å; L64-P158 WeakPolarHBondContact O-CA 3.23Å; F79-P158 HydrophobicContact CE1-CG 4.12Å; F79-P158 HydrophobicContact CZ-CB 4.15Å; F79-P158 HydrophobicContact CZ-CG 4.18Å; P150-P158 HydrophobicContact CB-CB 4.18Å; P150-P158 HydrophobicContact CB-CG 4.35Å; C151-P158 VanDerWaalsContact O-CD 3.24Å; C151-P158 WeakPolarHBondContact O-CD 3.41Å; C151-P158 VanDerWaalsContact O-CG 3.29Å; C151-P158 WeakPolarHBondContact O-CG 3.45Å; M156-P158 WeakPolarHBondContact O-CD 3.35Å
159	A	96.8	Very high	93.3	Very high	26 Å²	26	56.4 Å²	56.4	22%	0.215	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	146.8	168.1	0	0	0	0	0	110.8	L64 W76 F161	L64-A159 PolarHBondContact N-O 3.04Å; L64-A159 PolarHBondContact O-N 2.74Å; W76-A159 HydrophobicContact CH2-CB 3.51Å; W76-A159 HydrophobicContact CZ3-CB 3.55Å; A159-F161 HydrophobicContact CB-CE2 3.87Å; A159-F161 HydrophobicContact CB-CZ 4.37Å; A159-F161 WeakPolarHBondContact O-CD2 3.35Å
160	W	94.8	Very high	93.2	Very high	13 Å²	13	57.7 Å²	57.7	5%	0.049	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125.3	176.4	-66.6	105	0	0	0	110.7	V26 Y28 P38 L39 A50 W61 L63 W138 W149 P150	V26-W160 HydrophobicContact CG1-CH2 4.39Å; Y28-W160 VanDerWaalsContact CB-CZ3 3.47Å; P38-W160 HydrophobicContact CB-CB 4.37Å; P38-W160 HydrophobicContact CB-CD2 3.88Å; P38-W160 HydrophobicContact CB-CG 3.68Å; P38-W160 HydrophobicContact CG-CB 3.81Å; P38-W160 HydrophobicContact CG-CD2 4.15Å; P38-W160 HydrophobicContact CG-CG 3.68Å; L39-W160 PolarHBondContact O-NE1 2.8Å; A50-W160 HydrophobicContact CB-CB 3.98Å; W61-W160 HydrophobicContact CB-CB 4.18Å; W61-W160 HydrophobicContact CB-CD2 4.31Å; W61-W160 HydrophobicContact CB-CE3 3.67Å; W61-W160 HydrophobicContact CB-CZ3 4.43Å; W61-W160 HydrophobicContact CD2-CB 4.31Å; W61-W160 HydrophobicContact CE3-CB 3.77Å; L63-W160 HydrophobicContact CB-CD2 4.39Å; L63-W160 HydrophobicContact CB-CE3 3.8Å; L63-W160 HydrophobicContact CB-CH2 3.85Å; L63-W160 HydrophobicContact CB-CZ2 4.43Å; L63-W160 HydrophobicContact CB-CZ3 3.51Å; L63-W160 HydrophobicContact CD1-CD2 3.67Å; L63-W160 HydrophobicContact CD1-CE3 3.98Å; L63-W160 HydrophobicContact CD1-CG 4.16Å; L63-W160 HydrophobicContact CD1-CH2 4.16Å; L63-W160 HydrophobicContact CD1-CZ2 3.86Å; L63-W160 HydrophobicContact CD1-CZ3 4.22Å; L63-W160 HydrophobicContact CD2-CH2 4.29Å; L63-W160 HydrophobicContact CD2-CZ2 4.37Å; L63-W160 HydrophobicContact CG-CE3 4.48Å; L63-W160 HydrophobicContact CG-CH2 4.32Å; L63-W160 HydrophobicContact CG-CZ2 4.45Å; L63-W160 HydrophobicContact CG-CZ3 4.35Å; W138-W160 AromaticContact CE3-CH2 3.87Å; W138-W160 HydrophobicContact CE3-CH2 3.87Å; W138-W160 HydrophobicContact CE3-CZ2 4.19Å; W138-W160 HydrophobicContact CH2-CZ2 4.45Å; W138-W160 AromaticContact CZ3-CH2 3.99Å; W138-W160 HydrophobicContact CZ3-CH2 3.99Å; W138-W160 AromaticContact CZ3-CZ2 3.82Å; W138-W160 HydrophobicContact CZ3-CZ2 3.82Å; W149-W160 HydrophobicContact CE3-CZ2 4.47Å; W149-W160 HydrophobicContact CZ3-CZ2 4.41Å; P150-W160 HydrophobicContact CG-CZ2 3.81Å
161	F	94	Very high	93	Very high	31 Å²	31	59.7 Å²	59.7	14%	0.136	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.3	176.2	-68.7	-92.4	0	0	0	111.4	W61 L62 L64 W76 A159 L163 L176 P177	W61-F161 CarbonylContact C-O 3.6Å; W61-F161 VanDerWaalsContact CA-O 3.3Å; W61-F161 WeakPolarHBondContact CA-O 3.39Å; W61-F161 VanDerWaalsContact CE3-C 3.48Å; L62-F161 PolarHBondContact N-O 3.4Å; L62-F161 PolarHBondContact O-N 3.4Å; L64-F161 HydrophobicContact CB-CD2 4Å; L64-F161 HydrophobicContact CB-CE2 3.94Å; L64-F161 HydrophobicContact CD1-CD2 3.79Å; L64-F161 HydrophobicContact CD1-CE2 4.08Å; L64-F161 HydrophobicContact CD1-CG 4.35Å; L64-F161 HydrophobicContact CG-CD2 4.06Å; L64-F161 HydrophobicContact CG-CE2 4.42Å; W76-F161 AromaticContact CD2-CE2 3.93Å; W76-F161 HydrophobicContact CD2-CE2 3.93Å; W76-F161 AromaticContact CD2-CZ 3.77Å; W76-F161 HydrophobicContact CD2-CZ 3.77Å; W76-F161 AromaticContact CE2-CZ 3.73Å; W76-F161 AromaticContact CE3-CE2 3.67Å; W76-F161 HydrophobicContact CE3-CE2 3.67Å; W76-F161 AromaticContact CE3-CZ 3.97Å; W76-F161 HydrophobicContact CE3-CZ 3.97Å; W76-F161 HydrophobicContact CG-CZ 4.36Å; W76-F161 HydrophobicContact CH2-CE2 4.23Å; W76-F161 HydrophobicContact CH2-CZ 4.11Å; W76-F161 HydrophobicContact CZ2-CE2 4.45Å; W76-F161 AromaticContact CZ2-CZ 3.91Å; W76-F161 HydrophobicContact CZ2-CZ 3.91Å; W76-F161 AromaticContact CZ3-CE2 3.84Å; W76-F161 HydrophobicContact CZ3-CE2 3.84Å; W76-F161 HydrophobicContact CZ3-CZ 4.13Å; A159-F161 HydrophobicContact CB-CE2 3.87Å; A159-F161 HydrophobicContact CB-CZ 4.37Å; A159-F161 WeakPolarHBondContact O-CD2 3.35Å; F161-L163 PolarHBondContact O-N 3.3Å; F161-L176 HydrophobicContact CB-CD2 3.57Å; F161-L176 HydrophobicContact CG-CD2 4.39Å; F161-P177 HydrophobicContact CD1-CG 4.13Å; F161-P177 HydrophobicContact CE1-CB 3.9Å; F161-P177 HydrophobicContact CE1-CG 3.62Å; F161-P177 HydrophobicContact CE2-CG 4.26Å; F161-P177 HydrophobicContact CZ-CB 4.27Å; F161-P177 HydrophobicContact CZ-CG 3.69Å
162	P	92.1	Very high	92.8	Very high	26 Å²	26	60.1 Å²	60.1	17%	0.169	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	136.9	-177	-16.3	24.8	0	0	0	112.9	W61	W61-P162 HydrophobicContact CE3-CB 4.3Å; W61-P162 HydrophobicContact CE3-CG 4.01Å; W61-P162 HydrophobicContact CH2-CB 4.43Å; W61-P162 HydrophobicContact CH2-CG 3.83Å; W61-P162 HydrophobicContact CZ3-CB 4.13Å; W61-P162 HydrophobicContact CZ3-CG 3.44Å; W61-P162 VanDerWaalsContact CZ3-CG 3.44Å
163	L	91.3	Very high	92.6	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.016	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.3	163.5	-63	-178.2	0	0	0	108.2	I27 S60 L62 F161 I171 T173 L176 L193	I27-L163 HydrophobicContact CD1-CD1 4.18Å; I27-L163 HydrophobicContact CG1-CD1 4.35Å; S60-L163 PolarHBondContact N-O 2.85Å; S60-L163 PolarHBondContact O-N 2.63Å; S60-L163 VanDerWaalsContact O-O 3.06Å; L62-L163 HydrophobicContact CB-CD1 3.97Å; L62-L163 HydrophobicContact CB-CD2 4.37Å; L62-L163 HydrophobicContact CB-CG 4.08Å; F161-L163 PolarHBondContact O-N 3.3Å; L163-I171 HydrophobicContact CB-CG2 4.09Å; L163-I171 HydrophobicContact CD2-CG2 4.12Å; L163-I171 HydrophobicContact CG-CG2 4.48Å; L163-T173 HydrophobicContact CD2-CG2 4.36Å; L163-L176 HydrophobicContact CD2-CD1 4.29Å; L163-L176 HydrophobicContact CD2-CD2 4.03Å; L163-L176 HydrophobicContact CD2-CG 4.29Å; L163-L193 HydrophobicContact CD1-CD1 4.33Å; L163-L193 HydrophobicContact CD1-CD2 4.02Å; L163-L193 HydrophobicContact CD2-CD1 3.94Å
164	I	88.8	Confident	92.4	Very high	42 Å²	42	61 Å²	61	22%	0.215	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.3	-178.8	-58.4	172.2	0	0	0	108.6	K59 N166 N172	K59-I164 HydrophobicContact CG-CG1 4.37Å; I164-N166 PolarHBondContact O-N 3Å; I164-N172 HydrophobicContact CB-CB 4.15Å; I164-N172 PolarHBondContact N-O 2.89Å; I164-N172 WeakPolarHBondContact O-CB 3.3Å; I164-N172 PolarHBondContact O-N 3.11Å
165	I	87.2	Confident	92.3	Very high	69 Å²	69	54.2 Å²	54.2	35%	0.354	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	117.9	174.5	-56.6	175	0	0	0	108.3	N58	N58-I165 PolarHBondContact O-N 3.25Å
166	N	88.3	Confident	92.2	Very high	57 Å²	57	51.3 Å²	51.3	31%	0.305	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-71.9	164.7	175.9	-66.6	-41.4	0	0	0	110.9	I164 D168 N169 T170	I164-N166 PolarHBondContact O-N 3Å; N166-D168 VanDerWaalsContact CB-OD1 3.24Å; N166-D168 WeakPolarHBondContact CB-OD1 3.24Å; N166-D168 PolarHBondContact O-N 3.41Å; N166-D168 VanDerWaalsContact O-N 3.12Å; N166-N169 PolarHBondContact O-N 3.05Å; N166-T170 WeakPolarHBondContact CB-O 3.41Å; N166-T170 WeakPolarHBondContact CB-OG1 3.49Å; N166-T170 PolarHBondContact N-O 3.37Å; N166-T170 PolarHBondContact ND2-OG1 3.25Å
167	K	87.6	Confident	92.2	Very high	220 Å²	220	52.1 Å²	52.1	96%	0.957	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.7	179.9	-67.7	-177	179.4	178.5	0	114.2	N169	K167-N169 VanDerWaalsContact C-N 3.3Å
168	D	90	Very high	92.2	Very high	109 Å²	109	52.1 Å²	52.1	58%	0.583	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	11.5	176.7	63.6	-1.9	0	0	0	113	N166 T170	N166-D168 VanDerWaalsContact CB-OD1 3.24Å; N166-D168 WeakPolarHBondContact CB-OD1 3.24Å; N166-D168 PolarHBondContact O-N 3.41Å; N166-D168 VanDerWaalsContact O-N 3.12Å; D168-T170 PolarHBondContact O-N 3Å; D168-T170 WeakPolarHBondContact OD1-CB 3.1Å; D168-T170 WeakPolarHBondContact OD1-CG2 3.43Å; D168-T170 PolarHBondContact OD1-N 2.79Å; D168-T170 PolarHBondContact OD1-OG1 3.31Å
169	N	84.6	Confident	92.1	Very high	121 Å²	121	57.2 Å²	57.2	65%	0.647	30%	0.304	S	S	*	.	S	Bend	trans	64.2	14.2	-174.9	-55.2	-48.7	0	0	0	114.8	N166 K167 Q194	N166-N169 PolarHBondContact O-N 3.05Å; K167-N169 VanDerWaalsContact C-N 3.3Å; N169-Q194 PolarHBondContact O-NE2 2.48Å
170	T	89.9	Confident	92.2	Very high	52 Å²	52	58 Å²	58	32%	0.319	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-76.9	147.4	167.3	63.2	0	0	0	0	110.7	N166 D168 Q194	N166-T170 WeakPolarHBondContact CB-O 3.41Å; N166-T170 WeakPolarHBondContact CB-OG1 3.49Å; N166-T170 PolarHBondContact N-O 3.37Å; N166-T170 PolarHBondContact ND2-OG1 3.25Å; D168-T170 PolarHBondContact O-N 3Å; D168-T170 WeakPolarHBondContact OD1-CB 3.1Å; D168-T170 WeakPolarHBondContact OD1-CG2 3.43Å; D168-T170 PolarHBondContact OD1-N 2.79Å; D168-T170 PolarHBondContact OD1-OG1 3.31Å; T170-Q194 VanDerWaalsContact CA-OE1 3.3Å
171	I	91.1	Very high	92.4	Very high	43 Å²	43	57.6 Å²	57.6	22%	0.221	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	120.1	176.7	-59.1	179.6	0	0	0	109.4	L163 T173 L193 Q194	L163-I171 HydrophobicContact CB-CG2 4.09Å; L163-I171 HydrophobicContact CD2-CG2 4.12Å; L163-I171 HydrophobicContact CG-CG2 4.48Å; I171-T173 HydrophobicContact CG2-CG2 4.07Å; I171-T173 PolarHBondContact O-N 3.2Å; I171-L193 HydrophobicContact CD1-CB 4.12Å; I171-L193 WeakPolarHBondContact CD1-O 3.45Å; I171-Q194 VanDerWaalsContact N-OE1 3.13Å
172	N	91.8	Very high	92.6	Very high	49 Å²	49	57.2 Å²	57.2	26%	0.262	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	116.4	169.8	-173.3	-22.3	0	0	0	109.8	I164 S174	I164-N172 HydrophobicContact CB-CB 4.15Å; I164-N172 PolarHBondContact N-O 2.89Å; I164-N172 WeakPolarHBondContact O-CB 3.3Å; I164-N172 PolarHBondContact O-N 3.11Å; N172-S174 VanDerWaalsContact OD1-CB 3.22Å; N172-S174 WeakPolarHBondContact OD1-CB 2.9Å; N172-S174 PolarHBondContact OD1-N 3.22Å; N172-S174 PolarHBondContact OD1-OG 2.81Å
173	T	93.5	Very high	92.8	Very high	23 Å²	23	56.4 Å²	56.4	14%	0.141	29%	0.294	C	S	.	.			trans	-107.8	13.5	-178.7	61	0	0	0	0	112.9	L163 I171 S175 L176 W178 L193	L163-T173 HydrophobicContact CD2-CG2 4.36Å; I171-T173 HydrophobicContact CG2-CG2 4.07Å; I171-T173 PolarHBondContact O-N 3.2Å; T173-S175 PolarHBondContact O-N 3.32Å; T173-S175 VanDerWaalsContact O-N 3.15Å; T173-L176 HydrophobicContact CG2-CD1 4.35Å; T173-L176 WeakPolarHBondContact O-CB 3.48Å; T173-L176 PolarHBondContact O-N 3.22Å; T173-W178 PolarHBondContact O-NE1 3.08Å; T173-L193 HydrophobicContact CG2-CD1 3.69Å
174	S	92.4	Very high	93.1	Very high	87 Å²	87	56.4 Å²	56.4	61%	0.608	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.3	-176.7	70.4	0	0	0	0	113.9	N172 L176	N172-S174 VanDerWaalsContact OD1-CB 3.22Å; N172-S174 WeakPolarHBondContact OD1-CB 2.9Å; N172-S174 PolarHBondContact OD1-N 3.22Å; N172-S174 PolarHBondContact OD1-OG 2.81Å; S174-L176 VanDerWaalsContact C-N 3.35Å
175	S	92.4	Very high	93.6	Very high	49 Å²	49	54.6 Å²	54.6	34%	0.343	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-5.3	176.9	-56.6	0	0	0	0	113.3	T173	T173-S175 PolarHBondContact O-N 3.32Å; T173-S175 VanDerWaalsContact O-N 3.15Å
176	L	95.9	Very high	94	Very high	8 Å²	8	54.1 Å²	54.1	4%	0.042	28%	0.28	C	S	.	.	S	Bend	trans	-73.7	144.8	173.9	-61.1	-171.1	0	0	0	110.4	L62 F161 L163 T173 S174 W178 V189 L193	L62-L176 HydrophobicContact CB-CD2 4.25Å; L62-L176 HydrophobicContact CD2-CD1 3.88Å; L62-L176 HydrophobicContact CD2-CD2 3.91Å; F161-L176 HydrophobicContact CB-CD2 3.57Å; F161-L176 HydrophobicContact CG-CD2 4.39Å; L163-L176 HydrophobicContact CD2-CD1 4.29Å; L163-L176 HydrophobicContact CD2-CD2 4.03Å; L163-L176 HydrophobicContact CD2-CG 4.29Å; T173-L176 HydrophobicContact CG2-CD1 4.35Å; T173-L176 WeakPolarHBondContact O-CB 3.48Å; T173-L176 PolarHBondContact O-N 3.22Å; S174-L176 VanDerWaalsContact C-N 3.35Å; L176-W178 HydrophobicContact CB-CD2 4.12Å; L176-W178 HydrophobicContact CB-CH2 4.42Å; L176-W178 HydrophobicContact CB-CZ2 3.94Å; L176-W178 HydrophobicContact CD1-CH2 3.61Å; L176-W178 HydrophobicContact CD1-CZ2 3.56Å; L176-W178 HydrophobicContact CD1-CZ3 4.37Å; L176-W178 HydrophobicContact CG-CZ2 4.2Å; L176-W178 PolarHBondContact O-N 3Å; L176-V189 HydrophobicContact CD1-CG1 4.25Å; L176-L193 HydrophobicContact CD1-CD1 4.11Å
177	P	97	Very high	94.4	Very high	17 Å²	17	52.4 Å²	52.4	11%	0.11	27%	0.271	C	S	.	.			trans	-82.2	54.9	-171.9	36.8	-37.6	0	0	0	111.3	L64 W76 F161 E179 H180 M181	L64-P177 HydrophobicContact CD1-CG 4.05Å; W76-P177 HydrophobicContact CB-CG 3.79Å; W76-P177 HydrophobicContact CD2-CG 4.36Å; W76-P177 HydrophobicContact CG-CB 4.33Å; W76-P177 HydrophobicContact CG-CG 3.61Å; F161-P177 HydrophobicContact CD1-CG 4.13Å; F161-P177 HydrophobicContact CE1-CB 3.9Å; F161-P177 HydrophobicContact CE1-CG 3.62Å; F161-P177 HydrophobicContact CE2-CG 4.26Å; F161-P177 HydrophobicContact CZ-CB 4.27Å; F161-P177 HydrophobicContact CZ-CG 3.69Å; P177-E179 PolarHBondContact O-N 3.48Å; P177-H180 HydrophobicContact CB-CB 4.43Å; P177-H180 CarbonylContact O-C 3.55Å; P177-H180 WeakPolarHBondContact O-CA 2.94Å; P177-H180 WeakPolarHBondContact O-CB 3.25Å; P177-H180 PolarHBondContact O-N 3.14Å; P177-M181 HydrophobicContact CG-CG 4.14Å; P177-M181 HydrophobicContact CG-SD 4.29Å; P177-M181 WeakPolarHBondContact O-CG 3.48Å; P177-M181 PolarHBondContact O-N 3.48Å
178	W	97.9	Very high	94.8	Very high	49 Å²	49	42 Å²	42	19%	0.186	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-52.7	-33.2	-169.5	-64.5	117.5	0	0	0	114.9	T173 L176 H180 M181 D185 F186 V189 P190	T173-W178 PolarHBondContact O-NE1 3.08Å; L176-W178 HydrophobicContact CB-CD2 4.12Å; L176-W178 HydrophobicContact CB-CH2 4.42Å; L176-W178 HydrophobicContact CB-CZ2 3.94Å; L176-W178 HydrophobicContact CD1-CH2 3.61Å; L176-W178 HydrophobicContact CD1-CZ2 3.56Å; L176-W178 HydrophobicContact CD1-CZ3 4.37Å; L176-W178 HydrophobicContact CG-CZ2 4.2Å; L176-W178 PolarHBondContact O-N 3Å; W178-H180 PolarHBondContact O-N 3.26Å; W178-M181 HydrophobicContact CD2-SD 4.49Å; W178-M181 HydrophobicContact CE3-SD 3.67Å; W178-M181 HydrophobicContact CZ3-CE 4.26Å; W178-M181 HydrophobicContact CZ3-SD 3.85Å; W178-M181 PolarHBondContact O-N 2.88Å; W178-D185 HydrophobicContact CZ3-CB 4.19Å; W178-D185 WeakPolarHBondContact CZ3-O 3.22Å; W178-F186 HydrophobicContact CD2-CB 4.34Å; W178-F186 HydrophobicContact CE3-CB 3.98Å; W178-F186 HydrophobicContact CZ3-CB 4.41Å; W178-V189 HydrophobicContact CH2-CB 3.77Å; W178-V189 HydrophobicContact CH2-CG1 3.79Å; W178-V189 HydrophobicContact CZ3-CB 4.02Å; W178-V189 HydrophobicContact CZ3-CG1 4.3Å; W178-V189 HydrophobicContact CZ3-CG2 4.45Å; W178-P190 HydrophobicContact CH2-CG 3.95Å; W178-P190 HydrophobicContact CZ2-CG 4.03Å
179	E	97.3	Very high	95.2	Very high	107 Å²	107	36.9 Å²	36.9	50%	0.5	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-71.3	-14.5	178.9	68.5	-169.1	156.4	0	0	113.8	P177 R221 S222	P177-E179 PolarHBondContact O-N 3.48Å; E179-R221 HydrophobicContact CB-CB 3.98Å; E179-S222 WeakPolarHBondContact O-CB 3.44Å; E179-S222 PolarHBondContact O-N 2.79Å; E179-S222 PolarHBondContact O-OG 3.18Å
180	H	98.3	Very high	95.8	Very high	42 Å²	42	32.9 Å²	32.9	19%	0.194	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-115.7	8.8	179.9	-60.2	-70.2	0	0	0	112.3	R75 W76 P177 W178 S222 E224 T225	R75-H180 CarbonylContact C-O 3.58Å; R75-H180 WeakPolarHBondContact CA-O 3.4Å; R75-H180 WeakPolarHBondContact CB-O 3.46Å; W76-H180 PolarHBondContact N-O 3.24Å; P177-H180 HydrophobicContact CB-CB 4.43Å; P177-H180 CarbonylContact O-C 3.55Å; P177-H180 WeakPolarHBondContact O-CA 2.94Å; P177-H180 WeakPolarHBondContact O-CB 3.25Å; P177-H180 PolarHBondContact O-N 3.14Å; W178-H180 PolarHBondContact O-N 3.26Å; H180-S222 PolarHBondContact CE1-OG 2.91Å; H180-S222 VanDerWaalsContact CE1-OG 3.28Å; H180-S222 WeakPolarHBondContact ND1-CB 3.26Å; H180-S222 PolarHBondContact ND1-OG 2.93Å; H180-E224 PolarHBondContact CE1-O 3.35Å; H180-E224 PolarHBondContact ND1-O 3.35Å; H180-T225 HydrophobicContact CB-CG2 4.08Å; H180-T225 WeakPolarHBondContact CB-OG1 2.92Å; H180-T225 PolarHBondContact ND1-OG1 3.25Å
181	M	98.5	Very high	95.9	Very high	6 Å²	6	31.4 Å²	31.4	3%	0.03	17%	0.169	C	C	.	.	S	Bend	trans	-100.1	177.4	173.4	-68.9	-176.3	75.5	0	0	110.4	L64 W76 P177 W178 D185	L64-M181 HydrophobicContact CD1-CE 4.07Å; L64-M181 HydrophobicContact CD1-SD 4.01Å; L64-M181 HydrophobicContact CD2-CE 4.17Å; W76-M181 HydrophobicContact CB-CG 3.94Å; W76-M181 WeakPolarHBondContact O-CG 3.48Å; P177-M181 HydrophobicContact CG-CG 4.14Å; P177-M181 HydrophobicContact CG-SD 4.29Å; P177-M181 WeakPolarHBondContact O-CG 3.48Å; P177-M181 PolarHBondContact O-N 3.48Å; W178-M181 HydrophobicContact CD2-SD 4.49Å; W178-M181 HydrophobicContact CE3-SD 3.67Å; W178-M181 HydrophobicContact CZ3-CE 4.26Å; W178-M181 HydrophobicContact CZ3-SD 3.85Å; W178-M181 PolarHBondContact O-N 2.88Å; M181-D185 HydrophobicContact CB-CB 4.17Å; M181-D185 HydrophobicContact CE-CB 3.89Å
182	W	98.2	Very high	96.1	Very high	23 Å²	23	29.4 Å²	29.4	9%	0.087	16%	0.159	C	C	.	.			trans	-65	147.3	172	-73.9	100.3	0	0	0	110.9	F71 R75 D184 D185 Y204 Y233	F71-W182 HydrophobicContact CD1-CH2 4.42Å; F71-W182 HydrophobicContact CD1-CZ2 4.06Å; F71-W182 AromaticContact CE1-CH2 3.68Å; F71-W182 HydrophobicContact CE1-CH2 3.68Å; F71-W182 AromaticContact CE1-CZ2 3.57Å; F71-W182 HydrophobicContact CE1-CZ2 3.57Å; F71-W182 AromaticContact CE2-CH2 3.91Å; F71-W182 HydrophobicContact CE2-CH2 3.91Å; F71-W182 HydrophobicContact CE2-CZ2 4.48Å; F71-W182 AromaticContact CZ-CH2 3.37Å; F71-W182 HydrophobicContact CZ-CH2 3.37Å; F71-W182 AromaticContact CZ-CZ2 3.8Å; F71-W182 HydrophobicContact CZ-CZ2 3.8Å; F71-W182 HydrophobicContact CZ-CZ3 4.28Å; R75-W182 VanDerWaalsContact CD-CD2 3.41Å; R75-W182 VanDerWaalsContact CZ-CZ3 3.48Å; W182-D184 WeakPolarHBondContact CB-OD1 3.45Å; W182-D184 PolarHBondContact O-N 3.07Å; W182-D184 VanDerWaalsContact O-N 3.13Å; W182-D185 WeakPolarHBondContact CB-OD2 3.43Å; W182-D185 PolarHBondContact N-OD2 3.28Å; W182-D185 WeakPolarHBondContact O-CB 3.42Å; W182-D185 PolarHBondContact O-N 2.98Å; W182-D185 VanDerWaalsContact O-N 3.1Å; W182-Y204 AromaticContact CE3-CE1 3.82Å; W182-Y204 HydrophobicContact CE3-CE1 3.82Å; W182-Y204 HydrophobicContact CZ3-CE1 4.04Å; W182-Y233 HydrophobicContact CH2-CD2 4.4Å; W182-Y233 HydrophobicContact CH2-CE2 4.38Å; W182-Y233 AromaticContact CZ3-CD2 3.87Å; W182-Y233 HydrophobicContact CZ3-CD2 3.87Å; W182-Y233 HydrophobicContact CZ3-CE2 4.28Å; W182-Y233 HydrophobicContact CZ3-CG 4.4Å
183	P	96.9	Very high	96.3	Very high	8 Å²	8	27.2 Å²	27.2	5%	0.052	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.2	179	-25	34.6	0	0	0	114.6	F186 Y204 L218 D220 I235	P183-F186 WeakPolarHBondContact O-CD1 2.94Å; P183-F186 WeakPolarHBondContact O-CE1 3.46Å; P183-Y204 WeakPolarHBondContact CD-OH 3.29Å; P183-L218 HydrophobicContact CB-CB 4.31Å; P183-D220 HydrophobicContact CG-CB 4.39Å; P183-I235 HydrophobicContact CB-CD1 3.91Å; P183-I235 HydrophobicContact CB-CG1 4.32Å
184	D	97.9	Very high	96.2	Very high	3 Å²	3	30 Å²	30	2%	0.016	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-25.5	174.9	64.3	-76.2	0	0	0	113.5	F119 W182 F186 L187 W188 F202 Y204 I235	F119-D184 WeakPolarHBondContact CE1-OD2 3.5Å; W182-D184 WeakPolarHBondContact CB-OD1 3.45Å; W182-D184 PolarHBondContact O-N 3.07Å; W182-D184 VanDerWaalsContact O-N 3.13Å; D184-F186 PolarHBondContact O-N 3.45Å; D184-F186 VanDerWaalsContact O-N 3.11Å; D184-L187 WeakPolarHBondContact O-CB 3.47Å; D184-L187 PolarHBondContact O-N 3.1Å; D184-W188 PolarHBondContact OD2-NE1 3.46Å; D184-F202 HydrophobicContact CB-CD1 3.6Å; D184-F202 HydrophobicContact CB-CD2 3.78Å; D184-F202 HydrophobicContact CB-CE1 3.64Å; D184-F202 HydrophobicContact CB-CE2 3.74Å; D184-F202 HydrophobicContact CB-CG 3.72Å; D184-F202 HydrophobicContact CB-CZ 3.7Å; D184-Y204 PolarHBondContact N-OH 2.96Å; D184-Y204 PolarHBondContact OD1-OH 2.87Å; D184-I235 HydrophobicContact CB-CD1 3.77Å
185	D	98.4	Very high	96.2	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-56.2	-36.3	-174.2	-68.2	-25.9	0	0	0	112.1	W178 M181 W182 L187 W188 V189	W178-D185 HydrophobicContact CZ3-CB 4.19Å; W178-D185 WeakPolarHBondContact CZ3-O 3.22Å; M181-D185 HydrophobicContact CB-CB 4.17Å; M181-D185 HydrophobicContact CE-CB 3.89Å; W182-D185 WeakPolarHBondContact CB-OD2 3.43Å; W182-D185 PolarHBondContact N-OD2 3.28Å; W182-D185 WeakPolarHBondContact O-CB 3.42Å; W182-D185 PolarHBondContact O-N 2.98Å; W182-D185 VanDerWaalsContact O-N 3.1Å; D185-L187 PolarHBondContact O-N 3.48Å; D185-L187 VanDerWaalsContact O-N 3.15Å; D185-W188 PolarHBondContact O-N 2.95Å; D185-W188 VanDerWaalsContact OD1-CZ2 3.23Å; D185-W188 WeakPolarHBondContact OD1-CZ2 3.24Å; D185-W188 PolarHBondContact OD1-NE1 3.38Å; D185-V189 HydrophobicContact CB-CG2 3.96Å; D185-V189 VanDerWaalsContact O-CB 3.23Å; D185-V189 WeakPolarHBondContact O-CB 3.27Å; D185-V189 WeakPolarHBondContact O-CG2 3.47Å; D185-V189 PolarHBondContact O-N 3.4Å
186	F	96	Very high	96.1	Very high	59 Å²	59	26.1 Å²	26.1	26%	0.259	14%	0.135	S	C	.	.	H	α-helix	trans	-64	-20.3	179.5	87.2	-98.5	0	0	0	113.2	W178 P183 D184 L218	W178-F186 HydrophobicContact CD2-CB 4.34Å; W178-F186 HydrophobicContact CE3-CB 3.98Å; W178-F186 HydrophobicContact CZ3-CB 4.41Å; P183-F186 WeakPolarHBondContact O-CD1 2.94Å; P183-F186 WeakPolarHBondContact O-CE1 3.46Å; D184-F186 PolarHBondContact O-N 3.45Å; D184-F186 VanDerWaalsContact O-N 3.11Å; F186-L218 HydrophobicContact CE1-CB 4.27Å; F186-L218 HydrophobicContact CE1-CD1 3.63Å; F186-L218 HydrophobicContact CE1-CD2 3.63Å; F186-L218 HydrophobicContact CE1-CG 4.01Å; F186-L218 HydrophobicContact CZ-CD1 3.58Å; F186-L218 HydrophobicContact CZ-CD2 3.35Å; F186-L218 HydrophobicContact CZ-CG 4.01Å
187	L	96.2	Very high	96	Very high	21 Å²	21	26.3 Å²	26.3	11%	0.11	14%	0.135	C	C	.	.	H	α-helix	trans	-83.1	-50.1	178.3	-68.6	173.6	0	0	0	111.6	D184 D185 F202 L218 Y238 M240	D184-L187 WeakPolarHBondContact O-CB 3.47Å; D184-L187 PolarHBondContact O-N 3.1Å; D185-L187 PolarHBondContact O-N 3.48Å; D185-L187 VanDerWaalsContact O-N 3.15Å; L187-F202 HydrophobicContact CD1-CE1 3.64Å; L187-F202 HydrophobicContact CD1-CZ 4.32Å; L187-L218 HydrophobicContact CD1-CD1 3.52Å; L187-L218 HydrophobicContact CG-CD1 4.21Å; L187-Y238 HydrophobicContact CD1-CD1 4.5Å; L187-Y238 HydrophobicContact CD1-CD2 3.94Å; L187-Y238 HydrophobicContact CD1-CE1 4.23Å; L187-Y238 HydrophobicContact CD1-CE2 3.61Å; L187-Y238 HydrophobicContact CD1-CG 4.38Å; L187-M240 HydrophobicContact CB-SD 3.81Å; L187-M240 WeakPolarHBondContact O-CE 3.42Å
188	W	97.8	Very high	95.9	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-101.1	-31	-166.5	66.1	-98.5	0	0	0	114.8	L23 L25 L117 V132 D184 D185 D191 V192 V198 F202 M240	L23-W188 HydrophobicContact CD2-CH2 3.45Å; L23-W188 VanDerWaalsContact CD2-CH2 3.45Å; L23-W188 HydrophobicContact CD2-CZ2 3.67Å; L25-W188 HydrophobicContact CD1-CH2 4.47Å; L25-W188 HydrophobicContact CD1-CZ3 4.11Å; L117-W188 HydrophobicContact CD1-CD2 4.09Å; L117-W188 HydrophobicContact CD1-CH2 4.48Å; L117-W188 HydrophobicContact CD1-CZ2 3.92Å; L117-W188 HydrophobicContact CD2-CG 4.42Å; V132-W188 HydrophobicContact CG1-CH2 4.32Å; V132-W188 HydrophobicContact CG1-CZ3 3.92Å; D184-W188 PolarHBondContact OD2-NE1 3.46Å; D185-W188 PolarHBondContact O-N 2.95Å; D185-W188 VanDerWaalsContact OD1-CZ2 3.23Å; D185-W188 WeakPolarHBondContact OD1-CZ2 3.24Å; D185-W188 PolarHBondContact OD1-NE1 3.38Å; W188-D191 PolarHBondContact O-N 3.19Å; W188-D191 VanDerWaalsContact O-N 3.17Å; W188-V192 HydrophobicContact CE3-CB 4.45Å; W188-V192 HydrophobicContact CE3-CG2 3.86Å; W188-V192 HydrophobicContact CZ3-CG2 4.26Å; W188-V192 PolarHBondContact O-N 2.76Å; W188-V198 HydrophobicContact CB-CG1 3.93Å; W188-V198 HydrophobicContact CB-CG2 4.47Å; W188-F202 AromaticContact CD1-CE2 3.99Å; W188-M240 VanDerWaalsContact CA-CE 3.46Å; W188-M240 HydrophobicContact CB-CE 3.63Å; W188-M240 HydrophobicContact CB-SD 3.93Å
189	V	98.1	Very high	95.8	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-57.7	-44.5	179.6	172.6	0	0	0	0	111.2	L176 W178 D185 D191 V192 L193	L176-V189 HydrophobicContact CD1-CG1 4.25Å; W178-V189 HydrophobicContact CH2-CB 3.77Å; W178-V189 HydrophobicContact CH2-CG1 3.79Å; W178-V189 HydrophobicContact CZ3-CB 4.02Å; W178-V189 HydrophobicContact CZ3-CG1 4.3Å; W178-V189 HydrophobicContact CZ3-CG2 4.45Å; D185-V189 HydrophobicContact CB-CG2 3.96Å; D185-V189 VanDerWaalsContact O-CB 3.23Å; D185-V189 WeakPolarHBondContact O-CB 3.27Å; D185-V189 WeakPolarHBondContact O-CG2 3.47Å; D185-V189 PolarHBondContact O-N 3.4Å; V189-D191 VanDerWaalsContact C-N 3.33Å; V189-D191 PolarHBondContact O-N 3.41Å; V189-V192 PolarHBondContact O-N 3.35Å; V189-L193 HydrophobicContact CG1-CD1 3.74Å; V189-L193 HydrophobicContact CG1-CG 4.03Å; V189-L193 WeakPolarHBondContact O-CB 3.32Å; V189-L193 VanDerWaalsContact O-CG 3.24Å; V189-L193 WeakPolarHBondContact O-CG 3.46Å; V189-L193 PolarHBondContact O-N 2.86Å
190	P	95.8	Very high	95.7	Very high	36 Å²	36	18.1 Å²	18.1	23%	0.234	10%	0.098	C	C	.	.	H	α-helix	trans	-58.9	-40.9	177.4	-25.1	36.1	0	0	0	113.7	W178 L193 Q194	W178-P190 HydrophobicContact CH2-CG 3.95Å; W178-P190 HydrophobicContact CZ2-CG 4.03Å; P190-L193 PolarHBondContact O-N 2.72Å; P190-Q194 WeakPolarHBondContact O-CB 3.45Å; P190-Q194 PolarHBondContact O-N 2.7Å
191	D	93.7	Very high	95.5	Very high	22 Å²	22	16.3 Å²	16.3	12%	0.118	9%	0.089	C	C	.	.	H	α-helix	trans	-67.9	-42.6	-179.7	-79.5	-0	0	0	0	110.8	W188 V189 Q194 G195 N196 V198 M240 S242 K301	W188-D191 PolarHBondContact O-N 3.19Å; W188-D191 VanDerWaalsContact O-N 3.17Å; V189-D191 VanDerWaalsContact C-N 3.33Å; V189-D191 PolarHBondContact O-N 3.41Å; D191-Q194 PolarHBondContact O-N 2.73Å; D191-G195 PolarHBondContact O-N 3.37Å; D191-N196 HydrophobicContact CB-CB 4.37Å; D191-N196 VanDerWaalsContact O-CB 3.3Å; D191-N196 WeakPolarHBondContact O-CB 2.85Å; D191-N196 PolarHBondContact O-N 2.91Å; D191-V198 HydrophobicContact CB-CG2 3.98Å; D191-M240 HydrophobicContact CB-CE 4.28Å; D191-S242 VanDerWaalsContact OD2-CB 3.29Å; D191-S242 WeakPolarHBondContact OD2-CB 2.84Å; D191-S242 PolarHBondContact OD2-OG 3.2Å; D191-K301 IonicContact OD1-NZ 2.59Å; D191-K301 IonicContact OD2-NZ 3.85Å
192	V	95.3	Very high	95.4	Very high	1 Å²	1	16 Å²	16	1%	0.006	9%	0.088	C	C	.	.	H	α-helix	trans	-62.5	-44.1	174.3	169.1	0	0	0	0	111.4	L25 V114 I134 R136 W188 V189 Q194 G195 V198	L25-V192 HydrophobicContact CD1-CG1 4.15Å; V114-V192 HydrophobicContact CB-CG1 4.23Å; V114-V192 HydrophobicContact CG2-CG1 3.55Å; V114-V192 HydrophobicContact CG2-CG2 4.45Å; I134-V192 HydrophobicContact CD1-CG1 4.11Å; R136-V192 PolarHBondContact NH1-O 2.82Å; R136-V192 PolarHBondContact NH2-O 3.23Å; W188-V192 HydrophobicContact CE3-CB 4.45Å; W188-V192 HydrophobicContact CE3-CG2 3.86Å; W188-V192 HydrophobicContact CZ3-CG2 4.26Å; W188-V192 PolarHBondContact O-N 2.76Å; V189-V192 PolarHBondContact O-N 3.35Å; V192-Q194 VanDerWaalsContact C-N 3.29Å; V192-Q194 PolarHBondContact O-N 2.9Å; V192-G195 PolarHBondContact O-N 3.11Å; V192-V198 HydrophobicContact CG2-CB 4.19Å; V192-V198 HydrophobicContact CG2-CG2 3.75Å
193	L	94.8	Very high	95.2	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.016	8%	0.084	C	C	.	.	H	α-helix	trans	-60.3	-41.5	177.6	-71.4	177.8	0	0	0	110.8	I27 L62 I134 R136 L163 I171 T173 L176 V189 P190 G195	I27-L193 HydrophobicContact CD1-CD2 3.73Å; I27-L193 HydrophobicContact CG1-CD2 4.46Å; L62-L193 HydrophobicContact CD1-CD2 4.43Å; I134-L193 HydrophobicContact CD1-CD2 4.38Å; R136-L193 PolarHBondContact NH1-O 3.02Å; R136-L193 VanDerWaalsContact NH1-O 3.12Å; L163-L193 HydrophobicContact CD1-CD1 4.33Å; L163-L193 HydrophobicContact CD1-CD2 4.02Å; L163-L193 HydrophobicContact CD2-CD1 3.94Å; I171-L193 HydrophobicContact CD1-CB 4.12Å; I171-L193 WeakPolarHBondContact CD1-O 3.45Å; T173-L193 HydrophobicContact CG2-CD1 3.69Å; L176-L193 HydrophobicContact CD1-CD1 4.11Å; V189-L193 HydrophobicContact CG1-CD1 3.74Å; V189-L193 HydrophobicContact CG1-CG 4.03Å; V189-L193 WeakPolarHBondContact O-CB 3.32Å; V189-L193 VanDerWaalsContact O-CG 3.24Å; V189-L193 WeakPolarHBondContact O-CG 3.46Å; V189-L193 PolarHBondContact O-N 2.86Å; P190-L193 PolarHBondContact O-N 2.72Å; L193-G195 PolarHBondContact O-N 2.87Å; L193-G195 VanDerWaalsContact O-N 3.11Å
194	Q	92	Very high	95	Very high	82 Å²	82	14.8 Å²	14.8	38%	0.383	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-8.6	177.1	-165.2	56.4	61.3	0	0	114.2	N169 T170 I171 P190 D191 V192	N169-Q194 PolarHBondContact O-NE2 2.48Å; T170-Q194 VanDerWaalsContact CA-OE1 3.3Å; I171-Q194 VanDerWaalsContact N-OE1 3.13Å; P190-Q194 WeakPolarHBondContact O-CB 3.45Å; P190-Q194 PolarHBondContact O-N 2.7Å; D191-Q194 PolarHBondContact O-N 2.73Å; V192-Q194 VanDerWaalsContact C-N 3.29Å; V192-Q194 PolarHBondContact O-N 2.9Å
195	G	91.1	Very high	94.8	Very high	31 Å²	31	15.6 Å²	15.6	32%	0.32	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.4	6.3	177.3	0	0	0	0	0	114.4	D191 V192 L193	D191-G195 PolarHBondContact O-N 3.37Å; V192-G195 PolarHBondContact O-N 3.11Å; L193-G195 PolarHBondContact O-N 2.87Å; L193-G195 VanDerWaalsContact O-N 3.11Å
196	N	91.9	Very high	94.5	Very high	23 Å²	23	19 Å²	19	12%	0.123	10%	0.099	C	C	.	.			trans	-81.5	156.4	178.4	-56.6	-38.1	0	0	0	111.1	D191 F243	D191-N196 HydrophobicContact CB-CB 4.37Å; D191-N196 VanDerWaalsContact O-CB 3.3Å; D191-N196 WeakPolarHBondContact O-CB 2.85Å; D191-N196 PolarHBondContact O-N 2.91Å; N196-F243 WeakPolarHBondContact CA-O 3.19Å
197	I	92.9	Very high	94.2	Very high	11 Å²	11	17.7 Å²	17.7	6%	0.056	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	138.4	168.5	-65.5	170.1	0	0	0	108.3	V114 S242 F243 M245 N263 L264 I267	V114-I197 CarbonylContact O-C 3.51Å; V114-I197 VanDerWaalsContact O-CA 3.25Å; V114-I197 WeakPolarHBondContact O-CA 3.37Å; I197-S242 CarbonylContact O-C 3.51Å; I197-S242 WeakPolarHBondContact O-CA 3.43Å; I197-F243 HydrophobicContact CB-CB 4.32Å; I197-F243 PolarHBondContact N-O 3.39Å; I197-F243 PolarHBondContact O-N 3.07Å; I197-M245 HydrophobicContact CD1-CG 4.14Å; I197-M245 HydrophobicContact CD1-SD 4.12Å; I197-M245 HydrophobicContact CG1-CG 4.47Å; I197-N263 HydrophobicContact CD1-CB 3.72Å; I197-L264 HydrophobicContact CG2-CB 4.12Å; I197-L264 HydrophobicContact CG2-CD1 3.6Å; I197-L264 HydrophobicContact CG2-CG 4.4Å; I197-I267 HydrophobicContact CG2-CD1 4.34Å
198	V	94.8	Very high	93.7	Very high	1 Å²	1	21 Å²	21	1%	0.006	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.6	-179.4	175.9	0	0	0	0	112	V114 G115 R116 L117 W188 D191 V192 A200 M240 E241	V114-V198 PolarHBondContact O-N 2.7Å; G115-V198 CarbonylContact C-O 3.54Å; G115-V198 WeakPolarHBondContact CA-O 3.28Å; R116-V198 PolarHBondContact N-O 3.1Å; L117-V198 HydrophobicContact CD2-CG1 4.17Å; W188-V198 HydrophobicContact CB-CG1 3.93Å; W188-V198 HydrophobicContact CB-CG2 4.47Å; D191-V198 HydrophobicContact CB-CG2 3.98Å; V192-V198 HydrophobicContact CG2-CB 4.19Å; V192-V198 HydrophobicContact CG2-CG2 3.75Å; V198-A200 HydrophobicContact CG1-CB 4.1Å; V198-M240 HydrophobicContact CG1-CE 3.82Å; V198-M240 HydrophobicContact CG1-CG 4.1Å; V198-M240 HydrophobicContact CG2-CE 3.98Å; V198-E241 WeakPolarHBondContact CA-O 3.33Å
199	L	95.2	Very high	92.8	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.2	159.7	-62.2	-175.6	0	0	0	108.4	R116 W118 M240 E241 F243 L264 I267 I268 L271 L273 W283	R116-L199 HydrophobicContact CB-CD2 3.72Å; R116-L199 WeakPolarHBondContact O-CA 3.18Å; W118-L199 HydrophobicContact CH2-CD2 4.17Å; W118-L199 HydrophobicContact CZ3-CB 4.34Å; W118-L199 HydrophobicContact CZ3-CD2 4.22Å; L199-M240 WeakPolarHBondContact O-CA 3.06Å; L199-E241 PolarHBondContact N-O 3.13Å; L199-E241 PolarHBondContact O-N 2.85Å; L199-F243 HydrophobicContact CB-CE2 4.23Å; L199-F243 HydrophobicContact CD1-CE2 3.96Å; L199-F243 HydrophobicContact CD1-CZ 4.28Å; L199-F243 HydrophobicContact CG-CE2 3.89Å; L199-L264 HydrophobicContact CD2-CD1 3.55Å; L199-I267 HydrophobicContact CD1-CG2 3.68Å; L199-I268 HydrophobicContact CD2-CD1 4.34Å; L199-I268 HydrophobicContact CD2-CG1 4.07Å; L199-L271 HydrophobicContact CD1-CD1 3.71Å; L199-L273 HydrophobicContact CD1-CD1 4.02Å; L199-W283 HydrophobicContact CB-CH2 3.89Å; L199-W283 HydrophobicContact CB-CZ2 3.55Å; L199-W283 HydrophobicContact CD1-CZ2 4.5Å
200	A	96.2	Very high	91.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	149.9	177.9	0	0	0	0	0	113.5	R116 L117 W118 V198 F202 H239 M240	R116-A200 PolarHBondContact O-N 3.11Å; L117-A200 CarbonylContact C-O 3.45Å; L117-A200 VanDerWaalsContact CA-O 3.26Å; L117-A200 WeakPolarHBondContact CA-O 3.15Å; L117-A200 HydrophobicContact CD2-CB 3.67Å; W118-A200 PolarHBondContact N-O 2.87Å; V198-A200 HydrophobicContact CG1-CB 4.1Å; A200-F202 HydrophobicContact CB-CD2 4.26Å; A200-F202 HydrophobicContact CB-CE2 3.37Å; A200-F202 HydrophobicContact CB-CZ 3.6Å; A200-H239 CarbonylContact C-O 3.6Å; A200-H239 VanDerWaalsContact CA-O 3.25Å; A200-H239 WeakPolarHBondContact CA-O 3.39Å; A200-M240 HydrophobicContact CB-CB 3.96Å; A200-M240 HydrophobicContact CB-CG 3.88Å
201	W	95	Very high	90.3	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.015	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.5	167.4	164.1	71.1	0	0	0	110.3	P10 W118 T120 H203 A237 Y238 H239 W283 M284	P10-W201 HydrophobicContact CB-CH2 4.03Å; P10-W201 HydrophobicContact CB-CZ2 4.45Å; W118-W201 HydrophobicContact CB-CB 4.31Å; W118-W201 CarbonylContact O-C 3.55Å; W118-W201 WeakPolarHBondContact O-CA 3.5Å; W118-W201 VanDerWaalsContact O-CD1 3.22Å; T120-W201 PolarHBondContact OG1-NE1 3.48Å; W201-H203 HydrophobicContact CH2-CB 4.06Å; W201-H203 HydrophobicContact CZ2-CB 3.64Å; W201-A237 HydrophobicContact CH2-CB 3.97Å; W201-A237 HydrophobicContact CZ3-CB 4.07Å; W201-Y238 CarbonylContact O-C 3.52Å; W201-Y238 WeakPolarHBondContact O-CA 3.29Å; W201-Y238 WeakPolarHBondContact O-CB 3.29Å; W201-H239 HydrophobicContact CE3-CB 4.16Å; W201-H239 PolarHBondContact N-O 3.32Å; W201-H239 PolarHBondContact O-N 2.72Å; W201-W283 HydrophobicContact CB-CZ3 3.97Å; W201-M284 HydrophobicContact CB-CE 4.13Å; W201-M284 HydrophobicContact CB-CG 3.76Å; W201-M284 VanDerWaalsContact CD1-CE 3.45Å; W201-M284 HydrophobicContact CD2-CB 4Å; W201-M284 HydrophobicContact CD2-CG 3.76Å; W201-M284 HydrophobicContact CD2-SD 4.11Å; W201-M284 HydrophobicContact CE3-CB 3.96Å; W201-M284 HydrophobicContact CE3-CG 4.19Å; W201-M284 HydrophobicContact CG-CB 4.32Å; W201-M284 HydrophobicContact CG-CE 3.8Å; W201-M284 HydrophobicContact CG-CG 3.56Å; W201-M284 HydrophobicContact CG-SD 3.87Å; W201-M284 HydrophobicContact CZ3-CB 4.43Å
202	F	95.5	Very high	89.1	Confident	0 Å²	0	36 Å²	36	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.8	177.2	-56.3	-81.3	0	0	0	110.3	W118 F119 T120 D184 L187 W188 A200 Y204 I235 Y238	W118-F202 PolarHBondContact O-N 2.88Å; F119-F202 WeakPolarHBondContact CA-O 3.3Å; F119-F202 HydrophobicContact CD1-CB 3.93Å; F119-F202 HydrophobicContact CD1-CD2 4.08Å; F119-F202 HydrophobicContact CD1-CG 4.45Å; F119-F202 HydrophobicContact CE1-CB 4.14Å; F119-F202 AromaticContact CE1-CD2 3.54Å; F119-F202 HydrophobicContact CE1-CD2 3.54Å; F119-F202 HydrophobicContact CE1-CE2 4.38Å; F119-F202 HydrophobicContact CE1-CG 4.19Å; F119-F202 HydrophobicContact CZ-CD2 4.18Å; T120-F202 PolarHBondContact N-O 3.02Å; T120-F202 VanDerWaalsContact N-O 3.1Å; D184-F202 HydrophobicContact CB-CD1 3.6Å; D184-F202 HydrophobicContact CB-CD2 3.78Å; D184-F202 HydrophobicContact CB-CE1 3.64Å; D184-F202 HydrophobicContact CB-CE2 3.74Å; D184-F202 HydrophobicContact CB-CG 3.72Å; D184-F202 HydrophobicContact CB-CZ 3.7Å; L187-F202 HydrophobicContact CD1-CE1 3.64Å; L187-F202 HydrophobicContact CD1-CZ 4.32Å; W188-F202 AromaticContact CD1-CE2 3.99Å; A200-F202 HydrophobicContact CB-CD2 4.26Å; A200-F202 HydrophobicContact CB-CE2 3.37Å; A200-F202 HydrophobicContact CB-CZ 3.6Å; F202-Y204 HydrophobicContact CB-CD2 4.03Å; F202-Y204 HydrophobicContact CB-CE2 3.8Å; F202-I235 HydrophobicContact CB-CD1 4.47Å; F202-I235 HydrophobicContact CB-CG2 4.22Å; F202-I235 HydrophobicContact CD1-CD1 4.15Å; F202-I235 HydrophobicContact CD1-CG2 4.23Å; F202-Y238 HydrophobicContact CD1-CD2 4.45Å; F202-Y238 AromaticContact CD1-CG 3.92Å; F202-Y238 HydrophobicContact CD1-CG 3.92Å; F202-Y238 HydrophobicContact CE1-CD2 4.04Å; F202-Y238 AromaticContact CE1-CG 3.96Å; F202-Y238 HydrophobicContact CE1-CG 3.96Å
203	H	93.8	Very high	87.8	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.019	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.1	170.3	-169.1	54.6	0	0	0	110.3	P10 T120 W201 L205 I235 P236 A237	P10-H203 HydrophobicContact CB-CB 3.86Å; P10-H203 WeakPolarHBondContact CB-CD2 3.26Å; T120-H203 CarbonylContact O-C 3.59Å; T120-H203 WeakPolarHBondContact O-CA 3.38Å; T120-H203 PolarHBondContact O-ND1 3.06Å; T120-H203 PolarHBondContact OG1-ND1 3.35Å; W201-H203 HydrophobicContact CH2-CB 4.06Å; W201-H203 HydrophobicContact CZ2-CB 3.64Å; H203-L205 WeakPolarHBondContact CD2-CD1 3.48Å; H203-L205 VanDerWaalsContact NE2-CD1 3.28Å; H203-L205 WeakPolarHBondContact NE2-CD1 3.38Å; H203-I235 VanDerWaalsContact O-CA 3.29Å; H203-I235 WeakPolarHBondContact O-CA 3.45Å; H203-I235 WeakPolarHBondContact O-CG2 3.44Å; H203-P236 VanDerWaalsContact O-CD 3.27Å; H203-P236 WeakPolarHBondContact O-CD 3.29Å; H203-A237 HydrophobicContact CB-CB 4.44Å; H203-A237 PolarHBondContact N-O 3.42Å
204	Y	93.5	Very high	86.8	Confident	1 Å²	1	42.8 Å²	42.8	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.9	-174.1	-92.6	-91.7	0	0	0	112	F119 T120 F121 A122 W182 P183 D184 F202 Y233 I235	F119-Y204 HydrophobicContact CD1-CD2 4.01Å; F119-Y204 AromaticContact CD1-CE2 3.72Å; F119-Y204 HydrophobicContact CD1-CE2 3.72Å; F119-Y204 HydrophobicContact CE1-CE2 4.02Å; T120-Y204 PolarHBondContact O-N 3.15Å; F121-Y204 WeakPolarHBondContact CA-O 3.27Å; F121-Y204 HydrophobicContact CD1-CG 4.17Å; F121-Y204 HydrophobicContact CE1-CD1 4.17Å; F121-Y204 HydrophobicContact CE1-CD2 4.22Å; F121-Y204 AromaticContact CE1-CG 3.69Å; F121-Y204 HydrophobicContact CE1-CG 3.69Å; F121-Y204 HydrophobicContact CZ-CD2 4.38Å; F121-Y204 HydrophobicContact CZ-CG 4.29Å; A122-Y204 PolarHBondContact N-O 2.78Å; W182-Y204 AromaticContact CE3-CE1 3.82Å; W182-Y204 HydrophobicContact CE3-CE1 3.82Å; W182-Y204 HydrophobicContact CZ3-CE1 4.04Å; P183-Y204 WeakPolarHBondContact CD-OH 3.29Å; D184-Y204 PolarHBondContact N-OH 2.96Å; D184-Y204 PolarHBondContact OD1-OH 2.87Å; F202-Y204 HydrophobicContact CB-CD2 4.03Å; F202-Y204 HydrophobicContact CB-CE2 3.8Å; Y204-Y233 AromaticContact CD1-CD1 3.74Å; Y204-Y233 HydrophobicContact CD1-CD1 3.74Å; Y204-Y233 AromaticContact CD1-CG 3.79Å; Y204-Y233 HydrophobicContact CD1-CG 3.79Å; Y204-Y233 HydrophobicContact CE1-CG 4.36Å; Y204-Y233 HydrophobicContact CG-CD1 4.43Å; Y204-I235 HydrophobicContact CD1-CG1 4.15Å; Y204-I235 HydrophobicContact CD2-CG1 4.26Å; Y204-I235 HydrophobicContact CE1-CD1 4.13Å; Y204-I235 HydrophobicContact CE1-CG1 3.76Å; Y204-I235 HydrophobicContact CE2-CD1 3.8Å; Y204-I235 HydrophobicContact CE2-CG1 3.9Å; Y204-I235 HydrophobicContact CG-CG1 4.38Å; Y204-I235 WeakPolarHBondContact OH-CD1 3.38Å
205	L	92.2	Very high	86	Confident	20 Å²	20	44.6 Å²	44.6	11%	0.105	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.8	172.8	-85.5	63.1	0	0	0	109.9	A122 H203 L207 L210 Y233 E234 P236	A122-L205 HydrophobicContact CB-CD1 3.84Å; A122-L205 HydrophobicContact CB-CG 3.78Å; H203-L205 WeakPolarHBondContact CD2-CD1 3.48Å; H203-L205 VanDerWaalsContact NE2-CD1 3.28Å; H203-L205 WeakPolarHBondContact NE2-CD1 3.38Å; L205-L207 PolarHBondContact O-N 2.79Å; L205-L210 HydrophobicContact CD2-CD2 4.14Å; L205-Y233 CarbonylContact O-C 3.56Å; L205-Y233 VanDerWaalsContact O-CA 3.32Å; L205-Y233 WeakPolarHBondContact O-CA 3.32Å; L205-E234 HydrophobicContact CB-CG 4.01Å; L205-E234 PolarHBondContact N-O 3.44Å; L205-E234 PolarHBondContact O-N 2.88Å; L205-P236 HydrophobicContact CD1-CG 3.41Å; L205-P236 VanDerWaalsContact CD1-CG 3.41Å; L205-P236 HydrophobicContact CD2-CG 4.04Å; L205-P236 HydrophobicContact CG-CG 4.21Å
206	R	92.6	Very high	85.5	Confident	77 Å²	77	48.4 Å²	48.4	29%	0.291	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127.6	175.6	-165.5	-176.9	-65.2	-138.9	-3.2	111.2	E123 S208 N209 Y233	E123-R206 IonicContact OE1-CZ 3.44Å; E123-R206 IonicContact OE1-NE 3.8Å; E123-R206 PolarHBondContact OE1-NE 2.89Å; E123-R206 VanDerWaalsContact OE1-NE 3.11Å; E123-R206 IonicContact OE1-NH2 2.79Å; E123-R206 PolarHBondContact OE1-NH2 2.8Å; R206-S208 VanDerWaalsContact C-N 3.25Å; R206-S208 WeakPolarHBondContact CD-OG 3.41Å; R206-S208 WeakPolarHBondContact CG-OG 3.21Å; R206-S208 PolarHBondContact O-N 3.17Å; R206-N209 WeakPolarHBondContact O-CB 3.49Å; R206-N209 PolarHBondContact O-N 2.56Å; R206-Y233 HydrophobicContact CB-CD1 4.11Å; R206-Y233 HydrophobicContact CB-CE1 3.7Å; R206-Y233 HydrophobicContact CG-CE1 4.17Å; R206-Y233 HydrophobicContact CG-CE2 4.48Å; R206-Y233 VanDerWaalsContact CZ-OH 3.32Å; R206-Y233 PolarHBondContact NE-OH 3.23Å; R206-Y233 PolarHBondContact NH2-OH 3Å
207	L	90.3	Very high	85.4	Confident	31 Å²	31	48 Å²	48	16%	0.162	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-63.6	-29.5	-176.7	-62.9	-168.5	0	0	0	113.4	L205 N209 L210 T213 I219 L232 E234	L205-L207 PolarHBondContact O-N 2.79Å; L207-N209 PolarHBondContact O-N 2.59Å; L207-N209 VanDerWaalsContact O-N 3.07Å; L207-L210 HydrophobicContact CD2-CD1 3.57Å; L207-L210 WeakPolarHBondContact O-CB 3.45Å; L207-L210 PolarHBondContact O-N 2.93Å; L207-T213 HydrophobicContact CD2-CG2 4Å; L207-I219 HydrophobicContact CD1-CD1 3.66Å; L207-I219 HydrophobicContact CD1-CG1 3.9Å; L207-I219 HydrophobicContact CD2-CD1 3.93Å; L207-I219 HydrophobicContact CD2-CG1 4.18Å; L207-I219 HydrophobicContact CG-CD1 4.44Å; L207-L232 HydrophobicContact CB-CB 4.05Å; L207-L232 HydrophobicContact CD1-CB 3.49Å; L207-L232 VanDerWaalsContact CD1-CB 3.49Å; L207-L232 HydrophobicContact CD1-CD1 4.06Å; L207-L232 HydrophobicContact CD1-CG 4.38Å; L207-L232 HydrophobicContact CG-CB 3.79Å; L207-L232 PolarHBondContact N-O 3.12Å; L207-E234 HydrophobicContact CD2-CB 3.8Å; L207-E234 HydrophobicContact CD2-CG 3.82Å
208	S	85	Confident	85.4	Confident	91 Å²	91	48.9 Å²	48.9	64%	0.636	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-59.9	-19.5	175.9	63.6	0	0	0	0	113.1	R206	R206-S208 VanDerWaalsContact C-N 3.25Å; R206-S208 WeakPolarHBondContact CD-OG 3.41Å; R206-S208 WeakPolarHBondContact CG-OG 3.21Å; R206-S208 PolarHBondContact O-N 3.17Å
209	N	79.6	Confident	85.3	Confident	107 Å²	107	51.6 Å²	51.6	57%	0.572	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-94.4	-3	-179.6	-59.6	-14.2	0	0	0	112.3	R206 L207	R206-N209 WeakPolarHBondContact O-CB 3.49Å; R206-N209 PolarHBondContact O-N 2.56Å; L207-N209 PolarHBondContact O-N 2.59Å; L207-N209 VanDerWaalsContact O-N 3.07Å
210	L	71.7	Confident	85.3	Confident	50 Å²	50	52.3 Å²	52.3	26%	0.262	30%	0.301	S	S	.	.			trans	-98.1	142.8	-176.4	-61.6	175.7	0	0	0	112	L205 L207 T213 E234	L205-L210 HydrophobicContact CD2-CD2 4.14Å; L207-L210 HydrophobicContact CD2-CD1 3.57Å; L207-L210 WeakPolarHBondContact O-CB 3.45Å; L207-L210 PolarHBondContact O-N 2.93Å; L210-T213 HydrophobicContact CD1-CG2 4.32Å; L210-E234 HydrophobicContact CD1-CG 3.8Å; L210-E234 WeakPolarHBondContact CD1-OE1 3.27Å
211	S	70	Confident	85.1	Confident	100 Å²	100	59.7 Å²	59.7	70%	0.699	33%	0.328	S	S	*	.	S	Bend	trans	-87.3	-25.4	169.4	-48.2	0	0	0	0	112.2
212	T	68.5	Low	85.1	Confident	120 Å²	120	60.2 Å²	60.2	74%	0.736	33%	0.333	S	S	*	.	S	Bend	trans	-153.5	140.2	-178.1	49	0	0	0	0	108.7
213	T	67.6	Low	85.2	Confident	82 Å²	82	69.1 Å²	69.1	50%	0.503	37%	0.366	S	S	.	.			trans	-94.6	142.8	174.1	54.5	0	0	0	0	110.5	L207 L210 I219	L207-T213 HydrophobicContact CD2-CG2 4Å; L210-T213 HydrophobicContact CD1-CG2 4.32Å; T213-I219 HydrophobicContact CG2-CD1 4.15Å
214	N	73.7	Confident	85.3	Confident	63 Å²	63	73.4 Å²	73.4	34%	0.337	39%	0.386	S	S	.	.			trans	-87.9	123.5	171.7	-174.7	-17.1	0	0	0	109.4	Q216 N217	N214-Q216 PolarHBondContact O-N 2.87Å; N214-Q216 PolarHBondContact OD1-N 2.65Å; N214-N217 PolarHBondContact O-N 2.65Å; N214-N217 VanDerWaalsContact O-N 3.13Å
215	S	74.2	Confident	85.6	Confident	120 Å²	120	73.5 Å²	73.5	84%	0.839	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-10.5	-177.5	60.3	0	0	0	0	114.5
216	Q	81.8	Confident	85.7	Confident	111 Å²	111	78.9 Å²	78.9	52%	0.519	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-15.8	177.7	-61.6	-176.6	-4.8	0	0	113.5	N214	N214-Q216 PolarHBondContact O-N 2.87Å; N214-Q216 PolarHBondContact OD1-N 2.65Å
217	N	88.8	Confident	85.8	Confident	16 Å²	16	77.7 Å²	77.7	9%	0.086	43%	0.428	C	S	.	.	S	Bend	trans	-75.2	151.8	179.4	-66.9	-13.1	0	0	0	110.6	N214 E234 H305	N214-N217 PolarHBondContact O-N 2.65Å; N214-N217 VanDerWaalsContact O-N 3.13Å; N217-E234 HydrophobicContact CB-CB 4.28Å; N217-E234 VanDerWaalsContact ND2-CD 3.32Å; N217-E234 PolarHBondContact ND2-OE2 3.09Å; N217-H305 PolarHBondContact OD1-NE2 2.88Å
218	L	92.3	Very high	86.2	Confident	28 Å²	28	77.4 Å²	77.4	15%	0.147	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	137.7	166.9	-51.6	176.7	0	0	0	108.1	P183 F186 L187 E234 I235 Y238	P183-L218 HydrophobicContact CB-CB 4.31Å; F186-L218 HydrophobicContact CE1-CB 4.27Å; F186-L218 HydrophobicContact CE1-CD1 3.63Å; F186-L218 HydrophobicContact CE1-CD2 3.63Å; F186-L218 HydrophobicContact CE1-CG 4.01Å; F186-L218 HydrophobicContact CZ-CD1 3.58Å; F186-L218 HydrophobicContact CZ-CD2 3.35Å; F186-L218 HydrophobicContact CZ-CG 4.01Å; L187-L218 HydrophobicContact CD1-CD1 3.52Å; L187-L218 HydrophobicContact CG-CD1 4.21Å; L218-E234 CarbonylContact O-C 3.58Å; L218-E234 WeakPolarHBondContact O-CA 3.49Å; L218-E234 WeakPolarHBondContact O-CB 3.43Å; L218-I235 HydrophobicContact CB-CB 4.11Å; L218-I235 HydrophobicContact CB-CD1 4.27Å; L218-I235 HydrophobicContact CB-CG1 4.4Å; L218-I235 HydrophobicContact CD1-CD1 4.39Å; L218-I235 PolarHBondContact O-N 2.96Å; L218-Y238 HydrophobicContact CD1-CD1 3.89Å; L218-Y238 HydrophobicContact CD1-CE1 3.45Å; L218-Y238 VanDerWaalsContact CD1-CE1 3.45Å; L218-Y238 HydrophobicContact CG-CE1 4.02Å
219	I	93	Very high	86.7	Confident	58 Å²	58	80.3 Å²	80.3	30%	0.297	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	151.1	-173.2	-167.1	170.9	0	0	0	109.2	L207 T213 R221 Y233 E234	L207-I219 HydrophobicContact CD1-CD1 3.66Å; L207-I219 HydrophobicContact CD1-CG1 3.9Å; L207-I219 HydrophobicContact CD2-CD1 3.93Å; L207-I219 HydrophobicContact CD2-CG1 4.18Å; L207-I219 HydrophobicContact CG-CD1 4.44Å; T213-I219 HydrophobicContact CG2-CD1 4.15Å; I219-R221 PolarHBondContact O-N 2.94Å; I219-Y233 WeakPolarHBondContact CA-O 3.38Å; I219-Y233 WeakPolarHBondContact CG1-O 3.28Å; I219-E234 HydrophobicContact CB-CB 4.36Å; I219-E234 HydrophobicContact CG1-CB 4.24Å
220	D	94.8	Very high	87.6	Confident	16 Å²	16	75.7 Å²	75.7	9%	0.086	40%	0.403	C	S	.	.			trans	-53.3	133	168.2	-77	-70.6	0	0	0	110.4	R75 P183 L232 Y233	R75-D220 IonicContact CZ-OD1 3.82Å; R75-D220 IonicContact CZ-OD2 2.89Å; R75-D220 IonicContact NE-OD1 3.48Å; R75-D220 PolarHBondContact NE-OD1 2.91Å; R75-D220 VanDerWaalsContact NE-OD1 3.11Å; R75-D220 IonicContact NH2-OD1 3.75Å; R75-D220 PolarHBondContact NH2-OD1 2.84Å; R75-D220 IonicContact NH2-OD2 2.9Å; R75-D220 PolarHBondContact NH2-OD2 2.99Å; P183-D220 HydrophobicContact CG-CB 4.39Å; D220-L232 HydrophobicContact CB-CD2 3.61Å; D220-L232 WeakPolarHBondContact OD2-CA 3.44Å; D220-Y233 PolarHBondContact N-O 3.07Å; D220-Y233 VanDerWaalsContact N-O 3.09Å; D220-Y233 PolarHBondContact OD2-N 2.63Å
221	R	93.4	Very high	88.7	Confident	154 Å²	154	78.1 Å²	78.1	58%	0.581	42%	0.416	S	S	*	.	S	Bend	trans	-97.7	-14.8	-176	-58.9	-177	-172.4	170.6	6.1	113	E179 I219	E179-R221 HydrophobicContact CB-CB 3.98Å; I219-R221 PolarHBondContact O-N 2.94Å
222	S	95.7	Very high	89.9	Confident	16 Å²	16	75 Å²	75	11%	0.112	39%	0.391	C	S	.	.			trans	-124.9	152	176	-68.1	0	0	0	0	111.8	E179 H180 L232	E179-S222 WeakPolarHBondContact O-CB 3.44Å; E179-S222 PolarHBondContact O-N 2.79Å; E179-S222 PolarHBondContact O-OG 3.18Å; H180-S222 PolarHBondContact CE1-OG 2.91Å; H180-S222 VanDerWaalsContact CE1-OG 3.28Å; H180-S222 WeakPolarHBondContact ND1-CB 3.26Å; H180-S222 PolarHBondContact ND1-OG 2.93Å; S222-L232 VanDerWaalsContact O-CD2 3.24Å; S222-L232 WeakPolarHBondContact O-CD2 3.4Å
223	R	96	Very high	91.2	Very high	186 Å²	186	69.4 Å²	69.4	70%	0.702	36%	0.357	S	S	*	.	S	Bend	trans	-99.4	-17.6	177	-61.5	-176.8	176.9	-97.5	-2.5	113.3	I230 L232	R223-I230 PolarHBondContact O-N 3.09Å; R223-L232 HydrophobicContact CG-CD1 4.24Å
224	E	97.3	Very high	92.4	Very high	94 Å²	94	65.9 Å²	65.9	44%	0.439	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	160	178.4	62.7	179.6	-145	0	0	110.6	H180 I228 F229	H180-E224 PolarHBondContact CE1-O 3.35Å; H180-E224 PolarHBondContact ND1-O 3.35Å; E224-I228 CarbonylContact C-O 3.53Å; E224-I228 WeakPolarHBondContact CA-O 3.23Å; E224-I228 WeakPolarHBondContact CB-O 3.48Å; E224-F229 HydrophobicContact CB-CD1 4.25Å; E224-F229 WeakPolarHBondContact OE2-CE1 3.5Å
225	T	98.1	Very high	93.4	Very high	4 Å²	4	62.9 Å²	62.9	3%	0.025	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	124.2	170.8	-49.6	0	0	0	0	107.6	L66 G74 H180 G227 I228 I230	L66-T225 HydrophobicContact CD1-CG2 3.79Å; L66-T225 HydrophobicContact CD2-CG2 4.45Å; G74-T225 WeakPolarHBondContact O-CB 3.27Å; G74-T225 PolarHBondContact O-OG1 3.29Å; H180-T225 HydrophobicContact CB-CG2 4.08Å; H180-T225 WeakPolarHBondContact CB-OG1 2.92Å; H180-T225 PolarHBondContact ND1-OG1 3.25Å; T225-G227 PolarHBondContact O-N 2.82Å; T225-G227 VanDerWaalsContact O-N 3.16Å; T225-I228 PolarHBondContact N-O 3.06Å; T225-I228 VanDerWaalsContact O-CB 3.32Å; T225-I228 WeakPolarHBondContact O-CB 3.36Å; T225-I228 PolarHBondContact O-N 3.38Å; T225-I230 WeakPolarHBondContact OG1-CD1 3.1Å
226	N	94.9	Very high	94.2	Very high	133 Å²	133	57.7 Å²	57.7	71%	0.711	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	38.9	-177.8	-62.9	-7.1	0	0	0	113.7	L66 I228	L66-N226 HydrophobicContact CD2-CB 4.13Å; N226-I228 VanDerWaalsContact C-N 3.25Å; N226-I228 PolarHBondContact O-N 3.48Å
227	G	95.6	Very high	94.7	Very high	52 Å²	52	52.4 Å²	52.4	54%	0.536	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	3	-177.9	0	0	0	0	0	115.2	T225	T225-G227 PolarHBondContact O-N 2.82Å; T225-G227 VanDerWaalsContact O-N 3.16Å
228	I	97.4	Very high	94.9	Very high	25 Å²	25	52.8 Å²	52.8	13%	0.128	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	116.2	174.9	-50.8	176	0	0	0	108.7	L66 K73 E224 T225 N226	L66-I228 HydrophobicContact CD2-CD1 4.08Å; L66-I228 HydrophobicContact CG-CD1 4.3Å; K73-I228 HydrophobicContact CD-CG2 4.14Å; K73-I228 HydrophobicContact CG-CG2 3.58Å; E224-I228 CarbonylContact C-O 3.53Å; E224-I228 WeakPolarHBondContact CA-O 3.23Å; E224-I228 WeakPolarHBondContact CB-O 3.48Å; T225-I228 PolarHBondContact N-O 3.06Å; T225-I228 VanDerWaalsContact O-CB 3.32Å; T225-I228 WeakPolarHBondContact O-CB 3.36Å; T225-I228 PolarHBondContact O-N 3.38Å; N226-I228 VanDerWaalsContact C-N 3.25Å; N226-I228 PolarHBondContact O-N 3.48Å
229	F	97.1	Very high	95	Very high	152 Å²	152	51.5 Å²	51.5	67%	0.667	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	139.9	177.8	-67.5	-70.8	0	0	0	112.5	E224	E224-F229 HydrophobicContact CB-CD1 4.25Å; E224-F229 WeakPolarHBondContact OE2-CE1 3.5Å
230	I	97.6	Very high	95.1	Very high	10 Å²	10	48.7 Å²	48.7	5%	0.051	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-99.9	126.2	177.3	-66.2	165.1	0	0	0	109.2	G74 R75 R223 T225 L232	G74-I230 WeakPolarHBondContact O-CD1 3.41Å; G74-I230 WeakPolarHBondContact O-CG1 3.45Å; R75-I230 HydrophobicContact CG-CD1 4.46Å; R75-I230 HydrophobicContact CG-CG1 4.38Å; R75-I230 HydrophobicContact CG-CG2 4.2Å; R75-I230 VanDerWaalsContact NH2-CG2 3.29Å; R223-I230 PolarHBondContact O-N 3.09Å; T225-I230 WeakPolarHBondContact OG1-CD1 3.1Å; I230-L232 HydrophobicContact CB-CD2 4.42Å; I230-L232 HydrophobicContact CG2-CD2 4.14Å; I230-L232 PolarHBondContact O-N 3.04Å
231	D	95	Very high	95	Very high	101 Å²	101	48 Å²	48	54%	0.54	23%	0.233	S	C	.	.			trans	-69.4	113.5	167	-83	-13.1	0	0	0	109.5	R75 Y233	R75-D231 PolarHBondContact NH1-O 2.93Å; R75-D231 PolarHBondContact NH2-O 3.39Å; D231-Y233 HydrophobicContact CB-CE2 4.4Å; D231-Y233 VanDerWaalsContact O-CD2 3.27Å; D231-Y233 WeakPolarHBondContact O-CD2 3.14Å
232	L	95.7	Very high	94.9	Very high	33 Å²	33	40.8 Å²	40.8	17%	0.173	21%	0.206	C	C	.	.			trans	-85.3	143.1	-166.9	-55.5	172.4	0	0	0	114.3	L207 D220 S222 R223 I230	L207-L232 HydrophobicContact CB-CB 4.05Å; L207-L232 HydrophobicContact CD1-CB 3.49Å; L207-L232 VanDerWaalsContact CD1-CB 3.49Å; L207-L232 HydrophobicContact CD1-CD1 4.06Å; L207-L232 HydrophobicContact CD1-CG 4.38Å; L207-L232 HydrophobicContact CG-CB 3.79Å; L207-L232 PolarHBondContact N-O 3.12Å; D220-L232 HydrophobicContact CB-CD2 3.61Å; D220-L232 WeakPolarHBondContact OD2-CA 3.44Å; S222-L232 VanDerWaalsContact O-CD2 3.24Å; S222-L232 WeakPolarHBondContact O-CD2 3.4Å; R223-L232 HydrophobicContact CG-CD1 4.24Å; I230-L232 HydrophobicContact CB-CD2 4.42Å; I230-L232 HydrophobicContact CG2-CD2 4.14Å; I230-L232 PolarHBondContact O-N 3.04Å
233	Y	95.2	Very high	94.6	Very high	3 Å²	3	40.4 Å²	40.4	1%	0.012	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	156.4	179.4	-74.8	-92.7	0	0	0	112.9	F121 E123 W182 Y204 L205 R206 I219 D220 D231	F121-Y233 HydrophobicContact CD1-CD1 4.47Å; F121-Y233 AromaticContact CD1-CE1 3.86Å; F121-Y233 HydrophobicContact CD1-CE1 3.86Å; F121-Y233 HydrophobicContact CE1-CE1 4.15Å; E123-Y233 VanDerWaalsContact OE1-CE1 3.32Å; E123-Y233 WeakPolarHBondContact OE1-CE1 3.17Å; E123-Y233 PolarHBondContact OE1-OH 3.01Å; W182-Y233 HydrophobicContact CH2-CD2 4.4Å; W182-Y233 HydrophobicContact CH2-CE2 4.38Å; W182-Y233 AromaticContact CZ3-CD2 3.87Å; W182-Y233 HydrophobicContact CZ3-CD2 3.87Å; W182-Y233 HydrophobicContact CZ3-CE2 4.28Å; W182-Y233 HydrophobicContact CZ3-CG 4.4Å; Y204-Y233 AromaticContact CD1-CD1 3.74Å; Y204-Y233 HydrophobicContact CD1-CD1 3.74Å; Y204-Y233 AromaticContact CD1-CG 3.79Å; Y204-Y233 HydrophobicContact CD1-CG 3.79Å; Y204-Y233 HydrophobicContact CE1-CG 4.36Å; Y204-Y233 HydrophobicContact CG-CD1 4.43Å; L205-Y233 CarbonylContact O-C 3.56Å; L205-Y233 VanDerWaalsContact O-CA 3.32Å; L205-Y233 WeakPolarHBondContact O-CA 3.32Å; R206-Y233 HydrophobicContact CB-CD1 4.11Å; R206-Y233 HydrophobicContact CB-CE1 3.7Å; R206-Y233 HydrophobicContact CG-CE1 4.17Å; R206-Y233 HydrophobicContact CG-CE2 4.48Å; R206-Y233 VanDerWaalsContact CZ-OH 3.32Å; R206-Y233 PolarHBondContact NE-OH 3.23Å; R206-Y233 PolarHBondContact NH2-OH 3Å; I219-Y233 WeakPolarHBondContact CA-O 3.38Å; I219-Y233 WeakPolarHBondContact CG1-O 3.28Å; D220-Y233 PolarHBondContact N-O 3.07Å; D220-Y233 VanDerWaalsContact N-O 3.09Å; D220-Y233 PolarHBondContact OD2-N 2.63Å; D231-Y233 HydrophobicContact CB-CE2 4.4Å; D231-Y233 VanDerWaalsContact O-CD2 3.27Å; D231-Y233 WeakPolarHBondContact O-CD2 3.14Å
234	E	93.2	Very high	94	Very high	8 Å²	8	34 Å²	34	4%	0.037	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	158.6	159	63.5	172	-170	0	0	111.5	L205 L207 L210 N217 L218 I219 P236	L205-E234 HydrophobicContact CB-CG 4.01Å; L205-E234 PolarHBondContact N-O 3.44Å; L205-E234 PolarHBondContact O-N 2.88Å; L207-E234 HydrophobicContact CD2-CB 3.8Å; L207-E234 HydrophobicContact CD2-CG 3.82Å; L210-E234 HydrophobicContact CD1-CG 3.8Å; L210-E234 WeakPolarHBondContact CD1-OE1 3.27Å; N217-E234 HydrophobicContact CB-CB 4.28Å; N217-E234 VanDerWaalsContact ND2-CD 3.32Å; N217-E234 PolarHBondContact ND2-OE2 3.09Å; L218-E234 CarbonylContact O-C 3.58Å; L218-E234 WeakPolarHBondContact O-CA 3.49Å; L218-E234 WeakPolarHBondContact O-CB 3.43Å; I219-E234 HydrophobicContact CB-CB 4.36Å; I219-E234 HydrophobicContact CG1-CB 4.24Å; E234-P236 WeakPolarHBondContact O-CD 3.37Å
235	I	94.1	Very high	92.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	93.7	173.8	-50.7	175.9	0	0	0	108.4	P183 D184 F202 H203 Y204 L218 A237 Y238	P183-I235 HydrophobicContact CB-CD1 3.91Å; P183-I235 HydrophobicContact CB-CG1 4.32Å; D184-I235 HydrophobicContact CB-CD1 3.77Å; F202-I235 HydrophobicContact CB-CD1 4.47Å; F202-I235 HydrophobicContact CB-CG2 4.22Å; F202-I235 HydrophobicContact CD1-CD1 4.15Å; F202-I235 HydrophobicContact CD1-CG2 4.23Å; H203-I235 VanDerWaalsContact O-CA 3.29Å; H203-I235 WeakPolarHBondContact O-CA 3.45Å; H203-I235 WeakPolarHBondContact O-CG2 3.44Å; Y204-I235 HydrophobicContact CD1-CG1 4.15Å; Y204-I235 HydrophobicContact CD2-CG1 4.26Å; Y204-I235 HydrophobicContact CE1-CD1 4.13Å; Y204-I235 HydrophobicContact CE1-CG1 3.76Å; Y204-I235 HydrophobicContact CE2-CD1 3.8Å; Y204-I235 HydrophobicContact CE2-CG1 3.9Å; Y204-I235 HydrophobicContact CG-CG1 4.38Å; Y204-I235 WeakPolarHBondContact OH-CD1 3.38Å; L218-I235 HydrophobicContact CB-CB 4.11Å; L218-I235 HydrophobicContact CB-CD1 4.27Å; L218-I235 HydrophobicContact CB-CG1 4.4Å; L218-I235 HydrophobicContact CD1-CD1 4.39Å; L218-I235 PolarHBondContact O-N 2.96Å; I235-A237 VanDerWaalsContact C-N 3.31Å; I235-A237 VanDerWaalsContact CG2-O 3.29Å; I235-A237 WeakPolarHBondContact CG2-O 3.38Å; I235-Y238 HydrophobicContact CG2-CD1 4Å
236	P	91.1	Very high	90.8	Very high	12 Å²	12	35.6 Å²	35.6	8%	0.078	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-15	177.3	30.3	-39.3	0	0	0	114.5	H203 L205 E234 H305	H203-P236 VanDerWaalsContact O-CD 3.27Å; H203-P236 WeakPolarHBondContact O-CD 3.29Å; L205-P236 HydrophobicContact CD1-CG 3.41Å; L205-P236 VanDerWaalsContact CD1-CG 3.41Å; L205-P236 HydrophobicContact CD2-CG 4.04Å; L205-P236 HydrophobicContact CG-CG 4.21Å; E234-P236 WeakPolarHBondContact O-CD 3.37Å; P236-H305 PolarHBondContact O-CD2 2.75Å; P236-H305 PolarHBondContact O-NE2 3.12Å
237	A	92	Very high	88.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	144.1	174.3	0	0	0	0	0	112.1	P10 W201 H203 I235 H305	P10-A237 HydrophobicContact CB-CB 3.65Å; P10-A237 HydrophobicContact CG-CB 3.4Å; W201-A237 HydrophobicContact CH2-CB 3.97Å; W201-A237 HydrophobicContact CZ3-CB 4.07Å; H203-A237 HydrophobicContact CB-CB 4.44Å; H203-A237 PolarHBondContact N-O 3.42Å; I235-A237 VanDerWaalsContact C-N 3.31Å; I235-A237 VanDerWaalsContact CG2-O 3.29Å; I235-A237 WeakPolarHBondContact CG2-O 3.38Å; A237-H305 CarbonylContact C-O 3.56Å; A237-H305 WeakPolarHBondContact CA-O 3.45Å; A237-H305 WeakPolarHBondContact CB-O 3.28Å
238	Y	94.2	Very high	86.3	Confident	24 Å²	24	35.1 Å²	35.1	9%	0.094	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	157.8	172.1	65	-93.1	0	0	0	111.5	L187 W201 F202 L218 I235 I303 H305	L187-Y238 HydrophobicContact CD1-CD1 4.5Å; L187-Y238 HydrophobicContact CD1-CD2 3.94Å; L187-Y238 HydrophobicContact CD1-CE1 4.23Å; L187-Y238 HydrophobicContact CD1-CE2 3.61Å; L187-Y238 HydrophobicContact CD1-CG 4.38Å; W201-Y238 CarbonylContact O-C 3.52Å; W201-Y238 WeakPolarHBondContact O-CA 3.29Å; W201-Y238 WeakPolarHBondContact O-CB 3.29Å; F202-Y238 HydrophobicContact CD1-CD2 4.45Å; F202-Y238 AromaticContact CD1-CG 3.92Å; F202-Y238 HydrophobicContact CD1-CG 3.92Å; F202-Y238 HydrophobicContact CE1-CD2 4.04Å; F202-Y238 AromaticContact CE1-CG 3.96Å; F202-Y238 HydrophobicContact CE1-CG 3.96Å; L218-Y238 HydrophobicContact CD1-CD1 3.89Å; L218-Y238 HydrophobicContact CD1-CE1 3.45Å; L218-Y238 VanDerWaalsContact CD1-CE1 3.45Å; L218-Y238 HydrophobicContact CG-CE1 4.02Å; I235-Y238 HydrophobicContact CG2-CD1 4Å; Y238-I303 HydrophobicContact CE2-CB 4.23Å; Y238-I303 HydrophobicContact CE2-CG2 3.56Å; Y238-H305 HydrophobicContact CD1-CB 3.44Å; Y238-H305 VanDerWaalsContact CD1-CB 3.44Å; Y238-H305 AromaticContact CD1-CD2 3.97Å; Y238-H305 AromaticContact CD1-CG 3.98Å; Y238-H305 HydrophobicContact CD2-CB 4.32Å; Y238-H305 HydrophobicContact CE1-CB 3.13Å; Y238-H305 AromaticContact CE1-CD2 3.88Å; Y238-H305 AromaticContact CE1-CG 3.58Å; Y238-H305 HydrophobicContact CE2-CB 4.09Å; Y238-H305 HydrophobicContact CG-CB 4Å; Y238-H305 VanDerWaalsContact CZ-CB 3.49Å; Y238-H305 PolarHBondContact N-O 2.82Å; Y238-H305 PolarHBondContact O-N 2.85Å
239	H	93.9	Very high	83.8	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.8	173	174.1	115.5	0	0	0	107.2	A200 W201 E241 W283 K302 L304	A200-H239 CarbonylContact C-O 3.6Å; A200-H239 VanDerWaalsContact CA-O 3.25Å; A200-H239 WeakPolarHBondContact CA-O 3.39Å; W201-H239 HydrophobicContact CE3-CB 4.16Å; W201-H239 PolarHBondContact N-O 3.32Å; W201-H239 PolarHBondContact O-N 2.72Å; H239-E241 IonicContact CE1-OE1 3.19Å; H239-E241 PolarHBondContact CE1-OE1 2.79Å; H239-E241 IonicContact NE2-OE1 2.94Å; H239-E241 PolarHBondContact NE2-OE1 2.89Å; H239-E241 IonicContact NE2-OE2 3.73Å; H239-W283 AromaticContact CD2-CE2 3.57Å; H239-W283 AromaticContact CD2-CH2 3.59Å; H239-W283 AromaticContact CD2-CZ2 3.3Å; H239-W283 WeakPolarHBondContact CD2-CZ2 3.06Å; H239-W283 PolarHBondContact CE1-O 2.91Å; H239-W283 PolarHBondContact ND1-O 3.19Å; H239-W283 AromaticContact NE2-CD2 3.9Å; H239-W283 AromaticContact NE2-CE2 3.25Å; H239-W283 VanDerWaalsContact NE2-CE2 3.25Å; H239-W283 AromaticContact NE2-CZ2 3.4Å; H239-W283 WeakPolarHBondContact NE2-CZ2 3.42Å; H239-W283 AromaticContact NE2-NE1 3.37Å; H239-W283 PolarHBondContact NE2-NE1 3.06Å; H239-K302 WeakPolarHBondContact CE1-CE 3.42Å; H239-K302 PolarHBondContact CE1-NZ 3.01Å; H239-L304 HydrophobicContact CB-CD2 4.11Å; H239-L304 WeakPolarHBondContact ND1-CD2 3.39Å
240	M	94.7	Very high	81	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	135.5	179.2	178.5	-177.1	164.4	0	0	110.6	L187 W188 D191 V198 L199 A200 S242 K302 I303	L187-M240 HydrophobicContact CB-SD 3.81Å; L187-M240 WeakPolarHBondContact O-CE 3.42Å; W188-M240 VanDerWaalsContact CA-CE 3.46Å; W188-M240 HydrophobicContact CB-CE 3.63Å; W188-M240 HydrophobicContact CB-SD 3.93Å; D191-M240 HydrophobicContact CB-CE 4.28Å; V198-M240 HydrophobicContact CG1-CE 3.82Å; V198-M240 HydrophobicContact CG1-CG 4.1Å; V198-M240 HydrophobicContact CG2-CE 3.98Å; L199-M240 WeakPolarHBondContact O-CA 3.06Å; A200-M240 HydrophobicContact CB-CB 3.96Å; A200-M240 HydrophobicContact CB-CG 3.88Å; M240-S242 VanDerWaalsContact CE-OG 3.27Å; M240-S242 WeakPolarHBondContact CE-OG 3.19Å; M240-K302 CarbonylContact O-C 3.54Å; M240-K302 WeakPolarHBondContact O-CA 3.27Å; M240-I303 PolarHBondContact N-O 3.19Å; M240-I303 PolarHBondContact O-N 2.93Å
241	E	92.5	Very high	78.1	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.3	177.5	-75.3	174.4	179.6	0	0	110	V198 L199 H239 F243 W283 Y289 L300 K301 K302	V198-E241 WeakPolarHBondContact CA-O 3.33Å; L199-E241 PolarHBondContact N-O 3.13Å; L199-E241 PolarHBondContact O-N 2.85Å; H239-E241 IonicContact CE1-OE1 3.19Å; H239-E241 PolarHBondContact CE1-OE1 2.79Å; H239-E241 IonicContact NE2-OE1 2.94Å; H239-E241 PolarHBondContact NE2-OE1 2.89Å; H239-E241 IonicContact NE2-OE2 3.73Å; E241-F243 HydrophobicContact CB-CE2 3.78Å; E241-F243 HydrophobicContact CB-CZ 3.9Å; E241-W283 PolarHBondContact OE2-NE1 2.9Å; E241-Y289 VanDerWaalsContact CD-OH 3.3Å; E241-Y289 WeakPolarHBondContact OE1-CE2 3.49Å; E241-Y289 WeakPolarHBondContact OE2-CE2 3.42Å; E241-Y289 PolarHBondContact OE2-OH 3.1Å; E241-L300 HydrophobicContact CB-CD1 3.87Å; E241-L300 HydrophobicContact CG-CD1 4.06Å; E241-K301 WeakPolarHBondContact CA-O 3.36Å; E241-K302 HydrophobicContact CG-CB 4.26Å; E241-K302 HydrophobicContact CG-CD 4.32Å; E241-K302 HydrophobicContact CG-CG 3.95Å; E241-K302 WeakPolarHBondContact OE1-CD 3.25Å; E241-K302 VanDerWaalsContact OE1-CE 3.27Å; E241-K302 WeakPolarHBondContact OE1-CE 3.37Å; E241-K302 IonicContact OE1-NZ 3.14Å; E241-K302 PolarHBondContact OE1-NZ 2.75Å
242	S	92	Very high	75.4	Confident	4 Å²	4	42.5 Å²	42.5	3%	0.028	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.8	177	-58.9	0	0	0	0	110.2	D191 I197 M240 K301	D191-S242 VanDerWaalsContact OD2-CB 3.29Å; D191-S242 WeakPolarHBondContact OD2-CB 2.84Å; D191-S242 PolarHBondContact OD2-OG 3.2Å; I197-S242 CarbonylContact O-C 3.51Å; I197-S242 WeakPolarHBondContact O-CA 3.43Å; M240-S242 VanDerWaalsContact CE-OG 3.27Å; M240-S242 WeakPolarHBondContact CE-OG 3.19Å; S242-K301 PolarHBondContact N-O 3.49Å; S242-K301 PolarHBondContact O-N 2.85Å
243	F	89.9	Confident	72.6	Confident	8 Å²	8	43.1 Å²	43.1	4%	0.035	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	117.3	-176.2	-56.4	-93.1	0	0	0	109.1	N196 I197 L199 E241 I267 L295 P297 L300	N196-F243 WeakPolarHBondContact CA-O 3.19Å; I197-F243 HydrophobicContact CB-CB 4.32Å; I197-F243 PolarHBondContact N-O 3.39Å; I197-F243 PolarHBondContact O-N 3.07Å; L199-F243 HydrophobicContact CB-CE2 4.23Å; L199-F243 HydrophobicContact CD1-CE2 3.96Å; L199-F243 HydrophobicContact CD1-CZ 4.28Å; L199-F243 HydrophobicContact CG-CE2 3.89Å; E241-F243 HydrophobicContact CB-CE2 3.78Å; E241-F243 HydrophobicContact CB-CZ 3.9Å; F243-I267 HydrophobicContact CB-CD1 4.11Å; F243-I267 HydrophobicContact CD1-CD1 4.04Å; F243-I267 HydrophobicContact CD2-CD1 4.1Å; F243-I267 HydrophobicContact CE1-CG2 4.14Å; F243-I267 HydrophobicContact CE2-CG2 4.19Å; F243-I267 HydrophobicContact CG-CD1 3.81Å; F243-I267 HydrophobicContact CZ-CG2 3.87Å; F243-L295 HydrophobicContact CD1-CD2 4.41Å; F243-L295 HydrophobicContact CE1-CD1 3.54Å; F243-L295 HydrophobicContact CE1-CD2 4.01Å; F243-L295 HydrophobicContact CE1-CG 4.41Å; F243-L295 HydrophobicContact CZ-CD1 4.06Å; F243-P297 HydrophobicContact CD1-CB 4.22Å; F243-P297 HydrophobicContact CD1-CG 4.28Å; F243-L300 HydrophobicContact CD1-CD1 4.02Å; F243-L300 HydrophobicContact CE1-CD1 3.62Å; F243-L300 HydrophobicContact CE2-CD1 4.44Å; F243-L300 HydrophobicContact CZ-CD1 3.85Å
244	T	83.6	Confident	69.8	Low	51 Å²	51	49.4 Å²	49.4	31%	0.313	28%	0.284	S	S	.	.			trans	-77.5	130.9	174.3	-52.4	0	0	0	0	109.7	D246 I299	T244-D246 PolarHBondContact O-N 2.93Å; T244-I299 PolarHBondContact N-O 3.18Å
245	M	70	Confident	67.1	Low	69 Å²	69	58.4 Å²	58.4	34%	0.34	32%	0.323	S	S	.	.			trans	-81.8	103.5	172.2	-77.2	-133.8	65.1	0	0	110.2	I197 G247 N263	I197-M245 HydrophobicContact CD1-CG 4.14Å; I197-M245 HydrophobicContact CD1-SD 4.12Å; I197-M245 HydrophobicContact CG1-CG 4.47Å; M245-G247 PolarHBondContact O-N 2.82Å; M245-N263 HydrophobicContact CE-CB 4.25Å; M245-N263 WeakPolarHBondContact CE-ND2 3.46Å; M245-N263 HydrophobicContact SD-CB 4.42Å; M245-N263 PolarHBondContact SD-ND2 3.5Å
246	D	57.9	Low	64.5	Low	63 Å²	63	64.8 Å²	64.8	34%	0.337	36%	0.357	S	S	.	.			trans	-70.9	127.4	167.2	-94.2	5.9	0	0	0	110.1	T244 N248 E249 S298	T244-D246 PolarHBondContact O-N 2.93Å; D246-N248 PolarHBondContact O-N 2.9Å; D246-E249 PolarHBondContact O-N 2.74Å; D246-E249 VanDerWaalsContact O-N 3.12Å; D246-S298 WeakPolarHBondContact OD2-CB 3.26Å; D246-S298 PolarHBondContact OD2-OG 3.01Å
247	G	49.8	Very low	62.2	Low	49 Å²	49	71.1 Å²	71.1	51%	0.505	39%	0.39	S	S	.	.	H	α-helix	trans	-57.2	-15.8	177	0	0	0	0	0	114.6	M245 L250	M245-G247 PolarHBondContact O-N 2.82Å; G247-L250 WeakPolarHBondContact O-CB 3.4Å; G247-L250 PolarHBondContact O-N 2.84Å
248	N	44.4	Very low	59.6	Low	125 Å²	125	79 Å²	79	67%	0.668	43%	0.432	S	S	*	.	H	α-helix	trans	-72.6	-28.2	177.6	-78	-20.3	0	0	0	113.5	D246 L250 L251 S252	D246-N248 PolarHBondContact O-N 2.9Å; N248-L250 VanDerWaalsContact C-N 3.29Å; N248-L250 PolarHBondContact O-N 2.83Å; N248-L251 PolarHBondContact O-N 2.79Å; N248-S252 PolarHBondContact O-N 2.88Å
249	E	45.5	Very low	57.2	Low	85 Å²	85	83.4 Å²	83.4	40%	0.397	47%	0.465	S	S	.	.	H	α-helix	trans	-74.1	-21.1	175.6	-73.4	-156.4	161	0	0	112.9	D246 L251 S252 A253 R266	D246-E249 PolarHBondContact O-N 2.74Å; D246-E249 VanDerWaalsContact O-N 3.12Å; E249-L251 VanDerWaalsContact C-N 3.27Å; E249-L251 PolarHBondContact O-N 2.9Å; E249-S252 PolarHBondContact O-OG 3.06Å; E249-A253 WeakPolarHBondContact O-CB 3.3Å; E249-A253 PolarHBondContact O-N 2.99Å; E249-R266 IonicContact OE2-NH1 3.69Å
250	L	39.4	Very low	55	Low	122 Å²	122	89.7 Å²	89.7	64%	0.639	49%	0.493	S	S	*	.	H	α-helix	trans	-64.1	-31.9	172.1	-91.7	143.3	0	0	0	112.4	G247 N248	G247-L250 WeakPolarHBondContact O-CB 3.4Å; G247-L250 PolarHBondContact O-N 2.84Å; N248-L250 VanDerWaalsContact C-N 3.29Å; N248-L250 PolarHBondContact O-N 2.83Å
251	L	36	Very low	53.1	Low	154 Å²	154	93.4 Å²	93.4	81%	0.806	51%	0.512	S	S	*	.	H	α-helix	trans	-90.3	-24.5	-177.4	-67.5	174	0	0	0	113.4	N248 E249	N248-L251 PolarHBondContact O-N 2.79Å; E249-L251 VanDerWaalsContact C-N 3.27Å; E249-L251 PolarHBondContact O-N 2.9Å
252	S	39.2	Very low	52.4	Low	82 Å²	82	95.6 Å²	95.6	57%	0.573	53%	0.527	S	S	*	.	H	α-helix	trans	-85.8	-14.1	174.3	64.1	0	0	0	0	113.2	N248 E249 N254	N248-S252 PolarHBondContact O-N 2.88Å; E249-S252 PolarHBondContact O-OG 3.06Å; S252-N254 VanDerWaalsContact C-N 3.31Å; S252-N254 PolarHBondContact O-N 3.15Å
253	A	35.2	Very low	51.9	Low	46 Å²	46	97.9 Å²	97.9	38%	0.38	54%	0.539	S	S	.	.	S	Bend	trans	-70.4	86.9	172.3	0	0	0	0	0	111.2	E249	E249-A253 WeakPolarHBondContact O-CB 3.3Å; E249-A253 PolarHBondContact O-N 2.99Å
254	N	36.7	Very low	51.8	Low	135 Å²	135	97.5 Å²	97.5	72%	0.722	54%	0.538	S	S	*	.			trans	-35.2	154.7	-179.3	-86.1	-47.9	0	0	0	117.4	S252 D256	S252-N254 VanDerWaalsContact C-N 3.31Å; S252-N254 PolarHBondContact O-N 3.15Å; N254-D256 PolarHBondContact O-N 3Å
255	K	37.9	Very low	51.9	Low	197 Å²	197	96.7 Å²	96.7	86%	0.857	53%	0.53	S	S	*	.	S	Bend	trans	-59.8	16.6	-174.7	-74.6	178	171.5	176.3	0	117.8	N257	K255-N257 PolarHBondContact O-N 3.09Å
256	D	39.2	Very low	52.6	Low	135 Å²	135	98.7 Å²	98.7	72%	0.722	53%	0.534	S	S	*	.			trans	-91.4	98.4	177.7	-77.1	-28.9	0	0	0	110.8	N254 N258	N254-D256 PolarHBondContact O-N 3Å; D256-N258 PolarHBondContact O-N 3.34Å; D256-N258 VanDerWaalsContact O-N 3.13Å
257	N	41.3	Very low	53.9	Low	145 Å²	145	96.5 Å²	96.5	78%	0.775	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	7.6	-174.7	-92	-7.6	0	0	0	115.7	K255	K255-N257 PolarHBondContact O-N 3.09Å
258	N	39.3	Very low	55.7	Low	164 Å²	164	94.2 Å²	94.2	88%	0.877	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-1.7	-163.8	-106	-3.6	0	0	0	118.1	D256	D256-N258 PolarHBondContact O-N 3.34Å; D256-N258 VanDerWaalsContact O-N 3.13Å
259	C	43.2	Very low	57.7	Low	118 Å²	118	91.3 Å²	91.3	80%	0.797	48%	0.483	S	S	*	.			trans	-167.4	68.8	166.6	-166.4	0	0	0	0	108.8	L261	C259-L261 VanDerWaalsContact C-N 3.33Å; C259-L261 PolarHBondContact O-N 3.16Å
260	K	46.9	Very low	59.4	Low	132 Å²	132	92.3 Å²	92.3	57%	0.574	49%	0.487	S	S	*	.			trans	-73.8	95.7	174	-75.6	-169.1	176	-170.5	0	107.8	S262	K260-S262 PolarHBondContact O-N 3.06Å
261	L	55.7	Low	61.5	Low	78 Å²	78	86.7 Å²	86.7	41%	0.408	46%	0.458	S	S	.	.			trans	-52.6	130.9	167.4	-167.6	64	0	0	0	108.5	C259 Q265 R266 D269	C259-L261 VanDerWaalsContact C-N 3.33Å; C259-L261 PolarHBondContact O-N 3.16Å; L261-Q265 HydrophobicContact CD1-CB 3.57Å; L261-Q265 HydrophobicContact CD1-CG 3.36Å; L261-Q265 HydrophobicContact CD2-CB 4.42Å; L261-Q265 HydrophobicContact CD2-CG 4.32Å; L261-Q265 HydrophobicContact CG-CB 3.81Å; L261-Q265 HydrophobicContact CG-CG 4.01Å; L261-R266 HydrophobicContact CB-CG 4.23Å; L261-R266 HydrophobicContact CD2-CB 4.45Å; L261-R266 HydrophobicContact CD2-CG 3.64Å; L261-R266 HydrophobicContact CG-CG 4.01Å; L261-D269 WeakPolarHBondContact CD2-OD2 3.36Å
262	S	77.8	Confident	63.8	Low	46 Å²	46	81.5 Å²	81.5	32%	0.322	43%	0.431	S	S	.	.			trans	-60.6	150.7	177	69.3	0	0	0	0	109.8	K260 L264 Q265 R266	K260-S262 PolarHBondContact O-N 3.06Å; S262-L264 PolarHBondContact O-N 2.86Å; S262-Q265 PolarHBondContact O-N 3.33Å; S262-Q265 VanDerWaalsContact O-N 3.1Å; S262-Q265 WeakPolarHBondContact OG-CB 3.36Å; S262-Q265 PolarHBondContact OG-N 2.96Å; S262-R266 PolarHBondContact O-N 3.02Å
263	N	81	Confident	66	Low	51 Å²	51	77.6 Å²	77.6	27%	0.273	40%	0.404	S	S	.	.	H	α-helix	trans	-60.3	-32.9	176.5	-64.6	-52.2	0	0	0	111.5	I197 M245 R266 I267	I197-N263 HydrophobicContact CD1-CB 3.72Å; M245-N263 HydrophobicContact CE-CB 4.25Å; M245-N263 WeakPolarHBondContact CE-ND2 3.46Å; M245-N263 HydrophobicContact SD-CB 4.42Å; M245-N263 PolarHBondContact SD-ND2 3.5Å; N263-R266 WeakPolarHBondContact O-CB 3.21Å; N263-R266 PolarHBondContact O-N 3.13Å; N263-R266 PolarHBondContact OD1-NH1 3.3Å; N263-I267 VanDerWaalsContact O-CG1 3.28Å; N263-I267 WeakPolarHBondContact O-CG1 3.44Å; N263-I267 PolarHBondContact O-N 3.17Å
264	L	88.1	Confident	68.2	Low	1 Å²	1	78 Å²	78	1%	0.005	40%	0.4	C	S	.	.	H	α-helix	trans	-59.1	-51.7	171.4	175.4	64.2	0	0	0	111.7	E113 I197 L199 S262 R266 I267 I268	E113-L264 HydrophobicContact CB-CD2 4.04Å; E113-L264 VanDerWaalsContact CD-CD2 3.45Å; E113-L264 HydrophobicContact CG-CD2 3.43Å; E113-L264 VanDerWaalsContact CG-CD2 3.43Å; E113-L264 WeakPolarHBondContact OE1-CD2 3.34Å; I197-L264 HydrophobicContact CG2-CB 4.12Å; I197-L264 HydrophobicContact CG2-CD1 3.6Å; I197-L264 HydrophobicContact CG2-CG 4.4Å; L199-L264 HydrophobicContact CD2-CD1 3.55Å; S262-L264 PolarHBondContact O-N 2.86Å; L264-R266 VanDerWaalsContact C-N 3.27Å; L264-R266 PolarHBondContact O-N 3.4Å; L264-I267 WeakPolarHBondContact O-CB 3.28Å; L264-I267 PolarHBondContact O-N 2.99Å; L264-I267 VanDerWaalsContact O-N 3.09Å; L264-I268 HydrophobicContact CD1-CD1 3.84Å; L264-I268 HydrophobicContact CD1-CG1 4.2Å; L264-I268 HydrophobicContact CG-CD1 3.84Å; L264-I268 WeakPolarHBondContact O-CG1 3.38Å; L264-I268 PolarHBondContact O-N 3.5Å
265	Q	86.5	Confident	69.7	Low	34 Å²	34	79.1 Å²	79.1	16%	0.159	40%	0.398	C	S	.	.	H	α-helix	trans	-66.6	-31.3	-179.1	-168.6	65.9	48	0	0	111.7	L261 S262 I268 D269 D274	L261-Q265 HydrophobicContact CD1-CB 3.57Å; L261-Q265 HydrophobicContact CD1-CG 3.36Å; L261-Q265 HydrophobicContact CD2-CB 4.42Å; L261-Q265 HydrophobicContact CD2-CG 4.32Å; L261-Q265 HydrophobicContact CG-CB 3.81Å; L261-Q265 HydrophobicContact CG-CG 4.01Å; S262-Q265 PolarHBondContact O-N 3.33Å; S262-Q265 VanDerWaalsContact O-N 3.1Å; S262-Q265 WeakPolarHBondContact OG-CB 3.36Å; S262-Q265 PolarHBondContact OG-N 2.96Å; Q265-I268 PolarHBondContact O-N 3.44Å; Q265-D269 PolarHBondContact NE2-OD1 3.05Å; Q265-D269 VanDerWaalsContact O-CB 3.26Å; Q265-D269 WeakPolarHBondContact O-CB 3.37Å; Q265-D269 PolarHBondContact O-N 3.43Å; Q265-D274 PolarHBondContact NE2-OD2 3.22Å
266	R	84.5	Confident	71.2	Confident	110 Å²	110	72.7 Å²	72.7	42%	0.415	37%	0.373	S	S	.	.	H	α-helix	trans	-59.3	-45.5	169.6	-72	173.9	61.9	-161.4	-3.7	112.1	E249 L261 S262 N263 L264 Q270	E249-R266 IonicContact OE2-NH1 3.69Å; L261-R266 HydrophobicContact CB-CG 4.23Å; L261-R266 HydrophobicContact CD2-CB 4.45Å; L261-R266 HydrophobicContact CD2-CG 3.64Å; L261-R266 HydrophobicContact CG-CG 4.01Å; S262-R266 PolarHBondContact O-N 3.02Å; N263-R266 WeakPolarHBondContact O-CB 3.21Å; N263-R266 PolarHBondContact O-N 3.13Å; N263-R266 PolarHBondContact OD1-NH1 3.3Å; L264-R266 VanDerWaalsContact C-N 3.27Å; L264-R266 PolarHBondContact O-N 3.4Å; R266-Q270 VanDerWaalsContact O-CB 3.23Å; R266-Q270 WeakPolarHBondContact O-CB 3.41Å; R266-Q270 PolarHBondContact O-N 3.29Å
267	I	85.4	Confident	73.1	Confident	18 Å²	18	69.6 Å²	69.6	9%	0.092	36%	0.356	C	S	.	.	H	α-helix	trans	-64.3	-45.8	177.8	-64.4	161.5	0	0	0	110	I197 L199 F243 N263 L264 Q270 L271	I197-I267 HydrophobicContact CG2-CD1 4.34Å; L199-I267 HydrophobicContact CD1-CG2 3.68Å; F243-I267 HydrophobicContact CB-CD1 4.11Å; F243-I267 HydrophobicContact CD1-CD1 4.04Å; F243-I267 HydrophobicContact CD2-CD1 4.1Å; F243-I267 HydrophobicContact CE1-CG2 4.14Å; F243-I267 HydrophobicContact CE2-CG2 4.19Å; F243-I267 HydrophobicContact CG-CD1 3.81Å; F243-I267 HydrophobicContact CZ-CG2 3.87Å; N263-I267 VanDerWaalsContact O-CG1 3.28Å; N263-I267 WeakPolarHBondContact O-CG1 3.44Å; N263-I267 PolarHBondContact O-N 3.17Å; L264-I267 WeakPolarHBondContact O-CB 3.28Å; L264-I267 PolarHBondContact O-N 2.99Å; L264-I267 VanDerWaalsContact O-N 3.09Å; I267-Q270 PolarHBondContact O-N 2.97Å; I267-L271 HydrophobicContact CG2-CD1 3.76Å; I267-L271 WeakPolarHBondContact O-CB 3.28Å; I267-L271 WeakPolarHBondContact O-CG 3.21Å; I267-L271 PolarHBondContact O-N 2.77Å
268	I	87	Confident	75.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.7	-44.2	179.4	-70.4	174.3	0	0	0	111.8	R116 L199 L264 Q265 Q270 L271 D272 L273 D274	R116-I268 HydrophobicContact CB-CD1 3.98Å; R116-I268 HydrophobicContact CG-CD1 4.29Å; L199-I268 HydrophobicContact CD2-CD1 4.34Å; L199-I268 HydrophobicContact CD2-CG1 4.07Å; L264-I268 HydrophobicContact CD1-CD1 3.84Å; L264-I268 HydrophobicContact CD1-CG1 4.2Å; L264-I268 HydrophobicContact CG-CD1 3.84Å; L264-I268 WeakPolarHBondContact O-CG1 3.38Å; L264-I268 PolarHBondContact O-N 3.5Å; Q265-I268 PolarHBondContact O-N 3.44Å; I268-Q270 VanDerWaalsContact C-N 3.32Å; I268-Q270 PolarHBondContact O-N 2.9Å; I268-L271 CarbonylContact O-C 3.51Å; I268-L271 PolarHBondContact O-N 3Å; I268-D272 WeakPolarHBondContact O-CA 3.39Å; I268-D272 PolarHBondContact O-N 3.23Å; I268-L273 HydrophobicContact CG2-CB 4.28Å; I268-L273 PolarHBondContact O-N 3.13Å; I268-L273 VanDerWaalsContact O-N 3.16Å; I268-D274 HydrophobicContact CG2-CB 4.14Å; I268-D274 WeakPolarHBondContact CG2-OD2 3.21Å
269	D	85.6	Confident	77.2	Confident	64 Å²	64	61.6 Å²	61.6	34%	0.342	31%	0.31	S	S	.	.	H	α-helix	trans	-66	-36.6	178.5	-74.9	-13.3	0	0	0	111.7	L261 Q265 D272	L261-D269 WeakPolarHBondContact CD2-OD2 3.36Å; Q265-D269 PolarHBondContact NE2-OD1 3.05Å; Q265-D269 VanDerWaalsContact O-CB 3.26Å; Q265-D269 WeakPolarHBondContact O-CB 3.37Å; Q265-D269 PolarHBondContact O-N 3.43Å; D269-D272 PolarHBondContact O-N 2.92Å
270	Q	81.9	Confident	79.3	Confident	106 Å²	106	56 Å²	56	50%	0.495	27%	0.272	S	S	.	.	H	α-helix	trans	-70.2	-36.8	178.3	-177.2	166	15.7	0	0	112.3	R266 I267 I268 D272 V294	R266-Q270 VanDerWaalsContact O-CB 3.23Å; R266-Q270 WeakPolarHBondContact O-CB 3.41Å; R266-Q270 PolarHBondContact O-N 3.29Å; I267-Q270 PolarHBondContact O-N 2.97Å; I268-Q270 VanDerWaalsContact C-N 3.32Å; I268-Q270 PolarHBondContact O-N 2.9Å; Q270-D272 VanDerWaalsContact C-N 3.31Å; Q270-V294 HydrophobicContact CG-CG1 3.83Å; Q270-V294 WeakPolarHBondContact CG-O 3.09Å; Q270-V294 PolarHBondContact NE2-O 3.19Å
271	L	82.8	Confident	81.1	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-82.7	-8.7	173.3	-66.2	170.1	0	0	0	112.9	L199 I267 I268 L273 L288 Y289 V294 L295	L199-L271 HydrophobicContact CD1-CD1 3.71Å; I267-L271 HydrophobicContact CG2-CD1 3.76Å; I267-L271 WeakPolarHBondContact O-CB 3.28Å; I267-L271 WeakPolarHBondContact O-CG 3.21Å; I267-L271 PolarHBondContact O-N 2.77Å; I268-L271 CarbonylContact O-C 3.51Å; I268-L271 PolarHBondContact O-N 3Å; L271-L273 VanDerWaalsContact C-N 3.29Å; L271-L273 HydrophobicContact CB-CD1 3.95Å; L271-L273 HydrophobicContact CB-CD2 3.93Å; L271-L273 HydrophobicContact CB-CG 3.58Å; L271-L273 HydrophobicContact CD1-CD1 3.93Å; L271-L273 HydrophobicContact CD1-CG 4.5Å; L271-L273 PolarHBondContact O-N 3.41Å; L271-L288 HydrophobicContact CB-CD2 4.12Å; L271-L288 HydrophobicContact CD2-CD2 3.55Å; L271-L288 HydrophobicContact CG-CD2 4.45Å; L271-Y289 HydrophobicContact CD2-CE1 4.2Å; L271-V294 HydrophobicContact CD2-CG1 3.57Å; L271-V294 HydrophobicContact CG-CG1 4.31Å; L271-L295 HydrophobicContact CD1-CD1 4.45Å; L271-L295 HydrophobicContact CD2-CD1 4.25Å
272	D	84.4	Confident	82.5	Confident	45 Å²	45	52.2 Å²	52.2	24%	0.241	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	41	-178	-163.4	47.4	0	0	0	113.6	I268 D269 Q270 K275 N279	I268-D272 WeakPolarHBondContact O-CA 3.39Å; I268-D272 PolarHBondContact O-N 3.23Å; D269-D272 PolarHBondContact O-N 2.92Å; Q270-D272 VanDerWaalsContact C-N 3.31Å; D272-K275 WeakPolarHBondContact OD1-CB 3.17Å; D272-K275 VanDerWaalsContact OD1-CD 3.28Å; D272-K275 WeakPolarHBondContact OD1-CD 3.45Å; D272-K275 WeakPolarHBondContact OD1-CG 3.11Å; D272-K275 IonicContact OD1-NZ 2.81Å; D272-N279 PolarHBondContact OD2-ND2 3.43Å
273	L	85.9	Confident	83	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-22.1	-174.5	-54.7	177.3	0	0	0	113.7	R18 W118 L199 I268 L271 L280 W283	R18-L273 PolarHBondContact NH1-O 2.97Å; W118-L273 HydrophobicContact CH2-CB 4.32Å; W118-L273 HydrophobicContact CH2-CD1 3.67Å; W118-L273 HydrophobicContact CZ2-CB 4.22Å; W118-L273 HydrophobicContact CZ2-CD1 4.39Å; W118-L273 HydrophobicContact CZ3-CD1 4.27Å; L199-L273 HydrophobicContact CD1-CD1 4.02Å; I268-L273 HydrophobicContact CG2-CB 4.28Å; I268-L273 PolarHBondContact O-N 3.13Å; I268-L273 VanDerWaalsContact O-N 3.16Å; L271-L273 VanDerWaalsContact C-N 3.29Å; L271-L273 HydrophobicContact CB-CD1 3.95Å; L271-L273 HydrophobicContact CB-CD2 3.93Å; L271-L273 HydrophobicContact CB-CG 3.58Å; L271-L273 HydrophobicContact CD1-CD1 3.93Å; L271-L273 HydrophobicContact CD1-CG 4.5Å; L271-L273 PolarHBondContact O-N 3.41Å; L273-L280 HydrophobicContact CB-CD1 4.37Å; L273-L280 HydrophobicContact CD2-CD1 4.23Å; L273-W283 HydrophobicContact CD1-CD2 4.38Å; L273-W283 HydrophobicContact CD2-CB 3.74Å; L273-W283 HydrophobicContact CD2-CD2 4.4Å; L273-W283 HydrophobicContact CD2-CG 3.95Å
274	D	80.7	Confident	83.3	Confident	55 Å²	55	48 Å²	48	29%	0.294	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-31.7	-180	-77.7	-15.1	0	0	0	113.1	R18 R116 Q265 I268	R18-D274 IonicContact NH2-OD1 3.94Å; R18-D274 PolarHBondContact NH2-OD1 3.39Å; R116-D274 IonicContact NH1-OD1 3.75Å; R116-D274 PolarHBondContact NH1-OD1 3.1Å; R116-D274 VanDerWaalsContact NH1-OD1 3.14Å; R116-D274 IonicContact NH1-OD2 3.71Å; Q265-D274 PolarHBondContact NE2-OD2 3.22Å; I268-D274 HydrophobicContact CG2-CB 4.14Å; I268-D274 WeakPolarHBondContact CG2-OD2 3.21Å
275	K	68	Low	83	Confident	158 Å²	158	49.6 Å²	49.6	69%	0.687	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-21.9	-171.7	-55.9	-173.6	-164.4	137.3	0	113.5	D272	D272-K275 WeakPolarHBondContact OD1-CB 3.17Å; D272-K275 VanDerWaalsContact OD1-CD 3.28Å; D272-K275 WeakPolarHBondContact OD1-CD 3.45Å; D272-K275 WeakPolarHBondContact OD1-CG 3.11Å; D272-K275 IonicContact OD1-NZ 2.81Å
276	N	69.1	Low	82.5	Confident	62 Å²	62	49.1 Å²	49.1	33%	0.332	24%	0.238	S	C	.	.			trans	-143.8	107.7	-167.5	-168	-7.1	0	0	0	112.6	H278 N279 L280	N276-H278 PolarHBondContact O-N 3.01Å; N276-H278 VanDerWaalsContact O-N 3.09Å; N276-H278 WeakPolarHBondContact OD1-CB 2.99Å; N276-H278 PolarHBondContact OD1-N 3.26Å; N276-N279 HydrophobicContact CB-CB 4.3Å; N276-N279 PolarHBondContact O-N 2.93Å; N276-L280 PolarHBondContact O-N 3.32Å; N276-L280 VanDerWaalsContact O-N 3.15Å
277	D	80.2	Confident	81.6	Confident	70 Å²	70	46.3 Å²	46.3	37%	0.374	24%	0.235	S	C	.	.	H	α-helix	trans	-55.2	-27.1	173.2	-68.1	-11.6	0	0	0	112.7	W15 R281	W15-D277 HydrophobicContact CH2-CB 3.37Å; W15-D277 VanDerWaalsContact CH2-OD1 3.26Å; W15-D277 WeakPolarHBondContact CH2-OD1 3.44Å; W15-D277 HydrophobicContact CZ2-CB 4.22Å; W15-D277 HydrophobicContact CZ3-CB 3.89Å; W15-D277 WeakPolarHBondContact CZ3-OD2 3.45Å; D277-R281 WeakPolarHBondContact O-CB 3.46Å; D277-R281 WeakPolarHBondContact O-CD 3.27Å; D277-R281 WeakPolarHBondContact O-CG 3.35Å; D277-R281 PolarHBondContact O-N 3.16Å
278	H	83.1	Confident	80.6	Confident	109 Å²	109	46.3 Å²	46.3	51%	0.505	24%	0.235	S	C	.	.	H	α-helix	trans	-65.6	-46.7	174.2	-177.4	66	0	0	0	112.2	N276 L280 R281 L282	N276-H278 PolarHBondContact O-N 3.01Å; N276-H278 VanDerWaalsContact O-N 3.09Å; N276-H278 WeakPolarHBondContact OD1-CB 2.99Å; N276-H278 PolarHBondContact OD1-N 3.26Å; H278-L280 VanDerWaalsContact C-N 3.34Å; H278-R281 PolarHBondContact O-N 3.28Å; H278-L282 WeakPolarHBondContact NE2-CD1 3.18Å; H278-L282 WeakPolarHBondContact O-CG 3.47Å; H278-L282 PolarHBondContact O-N 2.79Å
279	N	84.3	Confident	79.5	Confident	33 Å²	33	48.6 Å²	48.6	18%	0.176	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-40.2	179.1	-71.8	-13.6	0	0	0	110.6	D272 N276 R281 L282 W283 L288	D272-N279 PolarHBondContact OD2-ND2 3.43Å; N276-N279 HydrophobicContact CB-CB 4.3Å; N276-N279 PolarHBondContact O-N 2.93Å; N279-R281 VanDerWaalsContact C-N 3.31Å; N279-R281 PolarHBondContact O-N 2.82Å; N279-L282 PolarHBondContact O-N 3.37Å; N279-W283 WeakPolarHBondContact O-CB 3.21Å; N279-W283 PolarHBondContact O-N 2.94Å; N279-L288 HydrophobicContact CB-CD1 4.04Å
280	L	86.6	Confident	78.3	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.9	-44.3	173	-178.2	60.8	0	0	0	111.7	W15 W118 L273 N276 H278 W283 M284	W15-L280 HydrophobicContact CH2-CD2 4.2Å; W15-L280 HydrophobicContact CZ2-CD2 4.09Å; W118-L280 HydrophobicContact CD2-CD1 3.7Å; W118-L280 HydrophobicContact CD2-CD2 4.39Å; W118-L280 HydrophobicContact CE3-CD1 4.05Å; W118-L280 HydrophobicContact CG-CD1 4.14Å; W118-L280 HydrophobicContact CG-CD2 4.13Å; W118-L280 HydrophobicContact CH2-CD1 4.26Å; W118-L280 HydrophobicContact CZ2-CD1 3.91Å; W118-L280 HydrophobicContact CZ3-CD1 4.33Å; L273-L280 HydrophobicContact CB-CD1 4.37Å; L273-L280 HydrophobicContact CD2-CD1 4.23Å; N276-L280 PolarHBondContact O-N 3.32Å; N276-L280 VanDerWaalsContact O-N 3.15Å; H278-L280 VanDerWaalsContact C-N 3.34Å; L280-W283 HydrophobicContact CD1-CE3 3.98Å; L280-W283 HydrophobicContact CD1-CZ3 4.39Å; L280-W283 PolarHBondContact O-N 3.39Å; L280-M284 HydrophobicContact CD1-CE 3.74Å; L280-M284 HydrophobicContact CD2-CE 3.78Å; L280-M284 HydrophobicContact CG-CE 3.48Å; L280-M284 VanDerWaalsContact CG-CE 3.48Å; L280-M284 HydrophobicContact CG-SD 4.3Å; L280-M284 WeakPolarHBondContact O-CG 2.92Å; L280-M284 PolarHBondContact O-N 2.85Å
281	R	84.5	Confident	76.8	Confident	77 Å²	77	52.4 Å²	52.4	29%	0.291	27%	0.268	S	S	.	.	H	α-helix	trans	-64.4	-41.4	175.7	-72.6	168.8	-171.8	-78.8	1.2	113.1	S13 W15 D277 H278 N279 W283 M284 S285	S13-R281 PolarHBondContact O-NH1 2.84Å; W15-R281 VanDerWaalsContact CE2-CZ 3.43Å; W15-R281 HydrophobicContact CZ2-CG 4.1Å; W15-R281 PolarHBondContact O-NH2 2.9Å; D277-R281 WeakPolarHBondContact O-CB 3.46Å; D277-R281 WeakPolarHBondContact O-CD 3.27Å; D277-R281 WeakPolarHBondContact O-CG 3.35Å; D277-R281 PolarHBondContact O-N 3.16Å; H278-R281 PolarHBondContact O-N 3.28Å; N279-R281 VanDerWaalsContact C-N 3.31Å; N279-R281 PolarHBondContact O-N 2.82Å; R281-W283 VanDerWaalsContact C-N 3.32Å; R281-M284 PolarHBondContact O-N 2.81Å; R281-S285 PolarHBondContact O-N 3.37Å; R281-S285 VanDerWaalsContact O-N 3.13Å; R281-S285 PolarHBondContact O-OG 2.78Å
282	L	85.4	Confident	75.3	Confident	54 Å²	54	61.9 Å²	61.9	28%	0.283	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-36.9	175.4	-71.6	178.7	0	0	0	111.9	H278 N279 S285 S286 S287 L288	H278-L282 WeakPolarHBondContact NE2-CD1 3.18Å; H278-L282 WeakPolarHBondContact O-CG 3.47Å; H278-L282 PolarHBondContact O-N 2.79Å; N279-L282 PolarHBondContact O-N 3.37Å; L282-S285 CarbonylContact O-C 3.56Å; L282-S285 PolarHBondContact O-N 2.64Å; L282-S285 PolarHBondContact O-OG 2.74Å; L282-S285 VanDerWaalsContact O-OG 3.09Å; L282-S286 PolarHBondContact O-N 3.44Å; L282-S287 PolarHBondContact O-N 3Å; L282-L288 HydrophobicContact CB-CD1 3.76Å; L282-L288 HydrophobicContact CD1-CD1 4.32Å; L282-L288 PolarHBondContact O-N 2.54Å
283	W	87.5	Confident	73.8	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.9	-44.1	175.3	175.2	82.9	0	0	0	111.4	W118 L199 W201 H239 E241 L273 N279 L280 R281 S285 S286 L288 Y289	W118-W283 HydrophobicContact CE3-CH2 4.07Å; W118-W283 AromaticContact CE3-CZ3 3.69Å; W118-W283 HydrophobicContact CE3-CZ3 3.69Å; W118-W283 AromaticContact CZ3-CH2 3.85Å; W118-W283 HydrophobicContact CZ3-CH2 3.85Å; W118-W283 AromaticContact CZ3-CZ3 3.76Å; W118-W283 HydrophobicContact CZ3-CZ3 3.76Å; L199-W283 HydrophobicContact CB-CH2 3.89Å; L199-W283 HydrophobicContact CB-CZ2 3.55Å; L199-W283 HydrophobicContact CD1-CZ2 4.5Å; W201-W283 HydrophobicContact CB-CZ3 3.97Å; H239-W283 AromaticContact CD2-CE2 3.57Å; H239-W283 AromaticContact CD2-CH2 3.59Å; H239-W283 AromaticContact CD2-CZ2 3.3Å; H239-W283 WeakPolarHBondContact CD2-CZ2 3.06Å; H239-W283 PolarHBondContact CE1-O 2.91Å; H239-W283 PolarHBondContact ND1-O 3.19Å; H239-W283 AromaticContact NE2-CD2 3.9Å; H239-W283 AromaticContact NE2-CE2 3.25Å; H239-W283 VanDerWaalsContact NE2-CE2 3.25Å; H239-W283 AromaticContact NE2-CZ2 3.4Å; H239-W283 WeakPolarHBondContact NE2-CZ2 3.42Å; H239-W283 AromaticContact NE2-NE1 3.37Å; H239-W283 PolarHBondContact NE2-NE1 3.06Å; E241-W283 PolarHBondContact OE2-NE1 2.9Å; L273-W283 HydrophobicContact CD1-CD2 4.38Å; L273-W283 HydrophobicContact CD2-CB 3.74Å; L273-W283 HydrophobicContact CD2-CD2 4.4Å; L273-W283 HydrophobicContact CD2-CG 3.95Å; N279-W283 WeakPolarHBondContact O-CB 3.21Å; N279-W283 PolarHBondContact O-N 2.94Å; L280-W283 HydrophobicContact CD1-CE3 3.98Å; L280-W283 HydrophobicContact CD1-CZ3 4.39Å; L280-W283 PolarHBondContact O-N 3.39Å; R281-W283 VanDerWaalsContact C-N 3.32Å; W283-S285 PolarHBondContact O-N 2.61Å; W283-S286 WeakPolarHBondContact O-CA 3.35Å; W283-S286 PolarHBondContact O-N 2.68Å; W283-L288 HydrophobicContact CB-CB 4.24Å; W283-L288 HydrophobicContact CB-CD2 4.34Å; W283-Y289 AromaticContact CD1-CE2 3.76Å; W283-Y289 AromaticContact NE1-CE2 3.94Å
284	M	86.9	Confident	72.2	Confident	9 Å²	9	65.9 Å²	65.9	4%	0.044	34%	0.342	C	S	.	.	H	α-helix	trans	-58.4	-32	173.9	-69.2	167.3	177	0	0	112.8	W118 W201 L280 R281 S286	W118-M284 HydrophobicContact CB-CE 3.67Å; W118-M284 HydrophobicContact CG-CE 4.03Å; W201-M284 HydrophobicContact CB-CE 4.13Å; W201-M284 HydrophobicContact CB-CG 3.76Å; W201-M284 VanDerWaalsContact CD1-CE 3.45Å; W201-M284 HydrophobicContact CD2-CB 4Å; W201-M284 HydrophobicContact CD2-CG 3.76Å; W201-M284 HydrophobicContact CD2-SD 4.11Å; W201-M284 HydrophobicContact CE3-CB 3.96Å; W201-M284 HydrophobicContact CE3-CG 4.19Å; W201-M284 HydrophobicContact CG-CB 4.32Å; W201-M284 HydrophobicContact CG-CE 3.8Å; W201-M284 HydrophobicContact CG-CG 3.56Å; W201-M284 HydrophobicContact CG-SD 3.87Å; W201-M284 HydrophobicContact CZ3-CB 4.43Å; L280-M284 HydrophobicContact CD1-CE 3.74Å; L280-M284 HydrophobicContact CD2-CE 3.78Å; L280-M284 HydrophobicContact CG-CE 3.48Å; L280-M284 VanDerWaalsContact CG-CE 3.48Å; L280-M284 HydrophobicContact CG-SD 4.3Å; L280-M284 WeakPolarHBondContact O-CG 2.92Å; L280-M284 PolarHBondContact O-N 2.85Å; R281-M284 PolarHBondContact O-N 2.81Å; M284-S286 VanDerWaalsContact C-N 3.31Å
285	S	81.4	Confident	71	Confident	33 Å²	33	65.3 Å²	65.3	23%	0.231	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	10.2	173.2	70.4	0	0	0	0	113.9	R281 L282 W283 S287 Y306	R281-S285 PolarHBondContact O-N 3.37Å; R281-S285 VanDerWaalsContact O-N 3.13Å; R281-S285 PolarHBondContact O-OG 2.78Å; L282-S285 CarbonylContact O-C 3.56Å; L282-S285 PolarHBondContact O-N 2.64Å; L282-S285 PolarHBondContact O-OG 2.74Å; L282-S285 VanDerWaalsContact O-OG 3.09Å; W283-S285 PolarHBondContact O-N 2.61Å; S285-S287 PolarHBondContact O-N 3.09Å; S285-S287 PolarHBondContact O-OG 3.28Å; S285-S287 PolarHBondContact OG-OG 3.07Å; S285-Y306 PolarHBondContact O-OH 2.83Å; S285-Y306 VanDerWaalsContact O-OH 3.11Å
286	S	76.5	Confident	70.2	Confident	24 Å²	24	63.4 Å²	63.4	17%	0.168	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	13.9	-177	-174.2	0	0	0	0	115.7	L282 W283 M284 L288 K302 Y306	L282-S286 PolarHBondContact O-N 3.44Å; W283-S286 WeakPolarHBondContact O-CA 3.35Å; W283-S286 PolarHBondContact O-N 2.68Å; M284-S286 VanDerWaalsContact C-N 3.31Å; S286-L288 VanDerWaalsContact C-N 3.32Å; S286-L288 PolarHBondContact O-N 3.11Å; S286-K302 WeakPolarHBondContact OG-CE 3.29Å; S286-K302 PolarHBondContact OG-NZ 2.99Å; S286-Y306 VanDerWaalsContact CB-OH 3.28Å; S286-Y306 WeakPolarHBondContact CB-OH 3.44Å; S286-Y306 PolarHBondContact N-OH 3.29Å
287	S	66.8	Low	69.5	Low	51 Å²	51	62.2 Å²	62.2	36%	0.357	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.3	-177.3	-47.2	0	0	0	0	113.4	L282 S285	L282-S287 PolarHBondContact O-N 3Å; S285-S287 PolarHBondContact O-N 3.09Å; S285-S287 PolarHBondContact O-OG 3.28Å; S285-S287 PolarHBondContact OG-OG 3.07Å
288	L	64.5	Low	68.3	Low	19 Å²	19	62 Å²	62	10%	0.099	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-30.4	-177.5	-151.6	90.2	0	0	0	113.2	L271 N279 L282 W283 S286	L271-L288 HydrophobicContact CB-CD2 4.12Å; L271-L288 HydrophobicContact CD2-CD2 3.55Å; L271-L288 HydrophobicContact CG-CD2 4.45Å; N279-L288 HydrophobicContact CB-CD1 4.04Å; L282-L288 HydrophobicContact CB-CD1 3.76Å; L282-L288 HydrophobicContact CD1-CD1 4.32Å; L282-L288 PolarHBondContact O-N 2.54Å; W283-L288 HydrophobicContact CB-CB 4.24Å; W283-L288 HydrophobicContact CB-CD2 4.34Å; S286-L288 VanDerWaalsContact C-N 3.32Å; S286-L288 PolarHBondContact O-N 3.11Å
289	Y	63.5	Low	67.6	Low	48 Å²	48	61.5 Å²	61.5	19%	0.188	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-10.4	-174.2	-71.6	-82.4	0	0	0	114.5	E241 L271 W283 N291 L295	E241-Y289 VanDerWaalsContact CD-OH 3.3Å; E241-Y289 WeakPolarHBondContact OE1-CE2 3.49Å; E241-Y289 WeakPolarHBondContact OE2-CE2 3.42Å; E241-Y289 PolarHBondContact OE2-OH 3.1Å; L271-Y289 HydrophobicContact CD2-CE1 4.2Å; W283-Y289 AromaticContact CD1-CE2 3.76Å; W283-Y289 AromaticContact NE1-CE2 3.94Å; Y289-N291 CarbonylContact O-C 3.48Å; Y289-N291 PolarHBondContact O-N 3.06Å; Y289-L295 HydrophobicContact CE1-CB 4.24Å; Y289-L295 HydrophobicContact CE1-CD1 3.59Å; Y289-L295 HydrophobicContact CE1-CG 4.48Å; Y289-L295 WeakPolarHBondContact OH-CD1 3.47Å
290	D	59.3	Low	67.2	Low	130 Å²	130	62.9 Å²	62.9	70%	0.695	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-10.4	176.9	-68.5	-27.4	0	0	0	112.1
291	N	51.7	Low	67	Low	119 Å²	119	67.9 Å²	67.9	64%	0.636	37%	0.374	S	S	*	.	S	Bend	trans	-96.5	97.7	167.3	-63	-38	0	0	0	109.6	Y289 S293	Y289-N291 CarbonylContact O-C 3.48Å; Y289-N291 PolarHBondContact O-N 3.06Å; N291-S293 PolarHBondContact O-N 2.83Å
292	E	51	Low	66.9	Low	204 Å²	204	67.5 Å²	67.5	95%	0.953	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	10.8	-165.7	-66.7	-160.1	152.5	0	0	119.9
293	S	52.6	Low	66.9	Low	104 Å²	104	67 Å²	67	73%	0.727	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-3.8	-172.2	60.5	0	0	0	0	115.9	N291	N291-S293 PolarHBondContact O-N 2.83Å
294	V	53.2	Low	66.7	Low	24 Å²	24	70.4 Å²	70.4	15%	0.145	39%	0.39	C	S	.	.	S	Bend	trans	-87.7	-20.4	-158.4	-167.8	0	0	0	0	113.9	Q270 L271	Q270-V294 HydrophobicContact CG-CG1 3.83Å; Q270-V294 WeakPolarHBondContact CG-O 3.09Å; Q270-V294 PolarHBondContact NE2-O 3.19Å; L271-V294 HydrophobicContact CD2-CG1 3.57Å; L271-V294 HydrophobicContact CG-CG1 4.31Å
295	L	54.4	Low	66.7	Low	44 Å²	44	71.5 Å²	71.5	23%	0.23	39%	0.394	C	S	.	.			trans	-154.7	120.2	-176.4	-98.8	163.5	0	0	0	111.8	F243 L271 Y289 P297	F243-L295 HydrophobicContact CD1-CD2 4.41Å; F243-L295 HydrophobicContact CE1-CD1 3.54Å; F243-L295 HydrophobicContact CE1-CD2 4.01Å; F243-L295 HydrophobicContact CE1-CG 4.41Å; F243-L295 HydrophobicContact CZ-CD1 4.06Å; L271-L295 HydrophobicContact CD1-CD1 4.45Å; L271-L295 HydrophobicContact CD2-CD1 4.25Å; Y289-L295 HydrophobicContact CE1-CB 4.24Å; Y289-L295 HydrophobicContact CE1-CD1 3.59Å; Y289-L295 HydrophobicContact CE1-CG 4.48Å; Y289-L295 WeakPolarHBondContact OH-CD1 3.47Å; L295-P297 VanDerWaalsContact CB-CD 3.48Å; L295-P297 HydrophobicContact CB-CG 4.22Å; L295-P297 HydrophobicContact CD2-CB 4.24Å; L295-P297 HydrophobicContact CD2-CG 3.9Å; L295-P297 WeakPolarHBondContact O-CD 3.08Å
296	S	52.1	Low	66.5	Low	117 Å²	117	73.4 Å²	73.4	82%	0.818	40%	0.397	S	S	*	.			trans	-112.2	55.4	159.4	58.3	0	0	0	0	110.8
297	P	54.1	Low	66.1	Low	37 Å²	37	75 Å²	75	24%	0.24	41%	0.407	C	S	.	.			trans	-67.8	142.6	171.6	30.3	-33.1	0	0	0	107.5	F243 L295 I299 L300	F243-P297 HydrophobicContact CD1-CB 4.22Å; F243-P297 HydrophobicContact CD1-CG 4.28Å; L295-P297 VanDerWaalsContact CB-CD 3.48Å; L295-P297 HydrophobicContact CB-CG 4.22Å; L295-P297 HydrophobicContact CD2-CB 4.24Å; L295-P297 HydrophobicContact CD2-CG 3.9Å; L295-P297 WeakPolarHBondContact O-CD 3.08Å; P297-I299 PolarHBondContact O-N 3.46Å; P297-L300 HydrophobicContact CG-CB 3.72Å
298	S	54.8	Low	65.7	Low	65 Å²	65	81.4 Å²	81.4	46%	0.455	44%	0.435	S	S	.	.	S	Bend	trans	-51.7	-35.4	-179.9	-54.6	0	0	0	0	112.4	D246	D246-S298 WeakPolarHBondContact OD2-CB 3.26Å; D246-S298 PolarHBondContact OD2-OG 3.01Å
299	I	67.4	Low	65.7	Low	100 Å²	100	84.5 Å²	84.5	51%	0.513	45%	0.452	S	S	.	.			trans	-150.9	116.7	173.1	-53.9	175.4	0	0	0	109.1	T244 P297	T244-I299 PolarHBondContact N-O 3.18Å; P297-I299 PolarHBondContact O-N 3.46Å
300	L	77.3	Confident	65.8	Low	62 Å²	62	86.4 Å²	86.4	33%	0.325	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.7	167	169.6	61.6	0	0	0	108.8	E241 F243 P297	E241-L300 HydrophobicContact CB-CD1 3.87Å; E241-L300 HydrophobicContact CG-CD1 4.06Å; F243-L300 HydrophobicContact CD1-CD1 4.02Å; F243-L300 HydrophobicContact CE1-CD1 3.62Å; F243-L300 HydrophobicContact CE2-CD1 4.44Å; F243-L300 HydrophobicContact CZ-CD1 3.85Å; P297-L300 HydrophobicContact CG-CB 3.72Å
301	K	82	Confident	66.2	Low	105 Å²	105	84 Å²	84	46%	0.457	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.9	167.5	179.4	-173.5	169.7	-159.5	0	108.8	D191 E241 S242	D191-K301 IonicContact OD1-NZ 2.59Å; D191-K301 IonicContact OD2-NZ 3.85Å; E241-K301 WeakPolarHBondContact CA-O 3.36Å; S242-K301 PolarHBondContact N-O 3.49Å; S242-K301 PolarHBondContact O-N 2.85Å
302	K	83.3	Confident	67.1	Low	68 Å²	68	81.9 Å²	81.9	30%	0.296	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.4	-177.7	-175.1	169.9	-175	144.9	0	111	H239 M240 E241 S286 L304	H239-K302 WeakPolarHBondContact CE1-CE 3.42Å; H239-K302 PolarHBondContact CE1-NZ 3.01Å; M240-K302 CarbonylContact O-C 3.54Å; M240-K302 WeakPolarHBondContact O-CA 3.27Å; E241-K302 HydrophobicContact CG-CB 4.26Å; E241-K302 HydrophobicContact CG-CD 4.32Å; E241-K302 HydrophobicContact CG-CG 3.95Å; E241-K302 WeakPolarHBondContact OE1-CD 3.25Å; E241-K302 VanDerWaalsContact OE1-CE 3.27Å; E241-K302 WeakPolarHBondContact OE1-CE 3.37Å; E241-K302 IonicContact OE1-NZ 3.14Å; E241-K302 PolarHBondContact OE1-NZ 2.75Å; S286-K302 WeakPolarHBondContact OG-CE 3.29Å; S286-K302 PolarHBondContact OG-NZ 2.99Å; K302-L304 HydrophobicContact CG-CD2 4.39Å; K302-L304 HydrophobicContact CG-CG 4.22Å
303	I	84.1	Confident	68.1	Low	43 Å²	43	74.3 Å²	74.3	22%	0.221	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.4	175.3	-48.5	174.2	0	0	0	107.7	Y238 M240	Y238-I303 HydrophobicContact CE2-CB 4.23Å; Y238-I303 HydrophobicContact CE2-CG2 3.56Å; M240-I303 PolarHBondContact N-O 3.19Å; M240-I303 PolarHBondContact O-N 2.93Å
304	L	84.5	Confident	69.1	Low	73 Å²	73	72.3 Å²	72.3	38%	0.382	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.6	178.8	-63.6	176.8	0	0	0	109	H239 K302 Y306	H239-L304 HydrophobicContact CB-CD2 4.11Å; H239-L304 WeakPolarHBondContact ND1-CD2 3.39Å; K302-L304 HydrophobicContact CG-CD2 4.39Å; K302-L304 HydrophobicContact CG-CG 4.22Å; L304-Y306 HydrophobicContact CB-CE2 4.19Å; L304-Y306 HydrophobicContact CD1-CE2 4.21Å
305	H	85.3	Confident	70.2	Confident	32 Å²	32	75.8 Å²	75.8	15%	0.148	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	120.8	168.8	-176.4	69	0	0	0	108.8	N217 P236 A237 Y238	N217-H305 PolarHBondContact OD1-NE2 2.88Å; P236-H305 PolarHBondContact O-CD2 2.75Å; P236-H305 PolarHBondContact O-NE2 3.12Å; A237-H305 CarbonylContact C-O 3.56Å; A237-H305 WeakPolarHBondContact CA-O 3.45Å; A237-H305 WeakPolarHBondContact CB-O 3.28Å; Y238-H305 HydrophobicContact CD1-CB 3.44Å; Y238-H305 VanDerWaalsContact CD1-CB 3.44Å; Y238-H305 AromaticContact CD1-CD2 3.97Å; Y238-H305 AromaticContact CD1-CG 3.98Å; Y238-H305 HydrophobicContact CD2-CB 4.32Å; Y238-H305 HydrophobicContact CE1-CB 3.13Å; Y238-H305 AromaticContact CE1-CD2 3.88Å; Y238-H305 AromaticContact CE1-CG 3.58Å; Y238-H305 HydrophobicContact CE2-CB 4.09Å; Y238-H305 HydrophobicContact CG-CB 4Å; Y238-H305 VanDerWaalsContact CZ-CB 3.49Å; Y238-H305 PolarHBondContact N-O 2.82Å; Y238-H305 PolarHBondContact O-N 2.85Å
306	Y	78.6	Confident	71.4	Confident	72 Å²	72	78.2 Å²	78.2	28%	0.282	42%	0.42	S	S	.	.			trans	-121.2	150.5	177.1	-62.1	-50.5	0	0	0	108.9	F11 S285 S286 L304 I308	F11-Y306 HydrophobicContact CE1-CD1 4.04Å; F11-Y306 AromaticContact CE1-CE1 3.71Å; F11-Y306 HydrophobicContact CE1-CE1 3.71Å; F11-Y306 HydrophobicContact CE2-CD1 4.09Å; F11-Y306 HydrophobicContact CE2-CE1 4.5Å; F11-Y306 AromaticContact CZ-CD1 3.26Å; F11-Y306 HydrophobicContact CZ-CD1 3.26Å; F11-Y306 AromaticContact CZ-CE1 3.32Å; F11-Y306 HydrophobicContact CZ-CE1 3.32Å; F11-Y306 HydrophobicContact CZ-CG 4.13Å; S285-Y306 PolarHBondContact O-OH 2.83Å; S285-Y306 VanDerWaalsContact O-OH 3.11Å; S286-Y306 VanDerWaalsContact CB-OH 3.28Å; S286-Y306 WeakPolarHBondContact CB-OH 3.44Å; S286-Y306 PolarHBondContact N-OH 3.29Å; L304-Y306 HydrophobicContact CB-CE2 4.19Å; L304-Y306 HydrophobicContact CD1-CE2 4.21Å; Y306-I308 PolarHBondContact O-N 3.18Å
307	P	68	Low	73.1	Confident	58 Å²	58	75 Å²	75	38%	0.377	39%	0.387	S	S	.	.			trans	-61.8	130.2	176.9	28.4	-35.4	0	0	0	108.9	P10	P10-P307 HydrophobicContact CG-CG 3.84Å
308	I	57.3	Low	74.8	Confident	185 Å²	185	78.5 Å²	78.5	95%	0.949	40%	0.4	S	S	*	.			trans	-77.2	0	167.9	-53.4	-170.5	0	0	0	109.3	Y306	Y306-I308 PolarHBondContact O-N 3.18Å

Retrieved 308 of 308 residues in 156.9 ms (Link to these results)

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