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AT-rich interactive domain-containing protein 4B

Acts as a transcriptional repressor. May function in the assembly and/or enzymatic activity of the Sin3A corepressor complex or in mediating interactions between the complex and other regulatory complexes. Plays a role in the regulation of epigenetic modifications at the PWS/AS imprinting center near the SNRPN promoter, where it might function as part of a complex with RB1 and ARID4A. Involved in spermatogenesis, together with ARID4A, where it functions as a transcriptional coactivator for AR (androgen receptor) and enhances expression of genes required for sperm maturation. Regulates expression of the tight junction protein CLDN3 in the testis, which is important for integrity of the blood-testis barrier. Plays a role in myeloid homeostasis where it regulates the histone methylation state of bone marrow cells and expression of various genes involved in hematopoiesis. May function as a leukemia suppressor.

AlphaFold DB , UniProt , Accession X6RCR8, Species HUMAN (Homo sapiens, Human), Gene ARID4B, Length 483 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	59	Low	243 Å²	243	109.1 Å²	109.1	100%	1.197	58%	0.581	S	S	*	*				0	146.3	0	-75.7	161.3	171.2	0	0	107.6	A3	M1-A3 PolarHBondContact O-N 2.76Å
2	K	28	Very low	61.7	Low	198 Å²	198	107.4 Å²	107.4	86%	0.861	58%	0.578	S	S	*	*			trans	-65.9	116.8	178.4	-72.2	179.9	176	-179.9	0	108.5	L4	K2-L4 VanDerWaalsContact C-N 3.35Å; K2-L4 PolarHBondContact O-N 3.02Å; K2-L4 VanDerWaalsContact O-N 3.11Å
3	A	37.6	Very low	63.6	Low	100 Å²	100	101.8 Å²	101.8	83%	0.826	56%	0.561	S	S	*	*			trans	-64.2	105.8	152.5	0	0	0	0	0	105.4	M1	M1-A3 PolarHBondContact O-N 2.76Å
4	L	42.8	Very low	65.4	Low	142 Å²	142	96.9 Å²	96.9	74%	0.743	54%	0.536	S	S	*	.			trans	-63.6	143.7	161.9	-77.2	163.5	0	0	0	106.7	K2 E6	K2-L4 VanDerWaalsContact C-N 3.35Å; K2-L4 PolarHBondContact O-N 3.02Å; K2-L4 VanDerWaalsContact O-N 3.11Å; L4-E6 PolarHBondContact O-N 2.99Å
5	D	52.3	Low	67.1	Low	136 Å²	136	94.8 Å²	94.8	73%	0.727	52%	0.523	S	S	*	.			trans	-70.2	74.3	-166.6	-154.7	16	0	0	0	109.7	P7 K61	D5-P7 WeakPolarHBondContact O-CD 3.38Å; D5-K61 IonicContact OD2-NZ 3.82Å
6	E	59.2	Low	68.5	Low	118 Å²	118	88.9 Å²	88.9	55%	0.551	49%	0.49	S	S	*	.			trans	-64.7	118.7	177.1	-167.8	-175.1	169.8	0	0	107.6	L4 R103	L4-E6 PolarHBondContact O-N 2.99Å; E6-R103 IonicContact OE1-CZ 2.73Å; E6-R103 IonicContact OE1-NE 3.74Å; E6-R103 IonicContact OE1-NH2 3.91Å; E6-R103 PolarHBondContact OE1-NH2 3.04Å
7	P	68.6	Low	69.7	Low	59 Å²	59	85 Å²	85	38%	0.383	47%	0.471	S	S	.	.			trans	-67.1	148.6	-171.5	29.1	-36.3	0	0	0	110.2	D5 Y9 L10	D5-P7 WeakPolarHBondContact O-CD 3.38Å; P7-Y9 WeakPolarHBondContact CB-O 3.49Å; P7-Y9 PolarHBondContact O-N 3.45Å; P7-L10 HydrophobicContact CG-CD2 4.24Å
8	P	70.1	Confident	70.6	Confident	45 Å²	45	80.3 Å²	80.3	29%	0.292	45%	0.445	S	S	.	.	S	Bend	trans	-63.6	-11.3	-176.2	25.8	-34.8	0	0	0	114.1	L83 D85	P8-L83 HydrophobicContact CB-CD1 4.36Å; P8-D85 WeakPolarHBondContact O-CB 3.47Å
9	Y	81.4	Confident	71.1	Confident	72 Å²	72	82.7 Å²	82.7	28%	0.282	45%	0.45	S	S	.	.	S	Bend	trans	-159.6	159.8	169.7	57.5	-83.9	0	0	0	108.4	P7 R34 V36 Y89	P7-Y9 WeakPolarHBondContact CB-O 3.49Å; P7-Y9 PolarHBondContact O-N 3.45Å; Y9-R34 HydrophobicContact CD1-CG 4.06Å; Y9-R34 HydrophobicContact CD2-CG 4.09Å; Y9-R34 HydrophobicContact CE1-CG 4.36Å; Y9-R34 HydrophobicContact CE2-CG 4.36Å; Y9-R34 HydrophobicContact CG-CG 3.93Å; Y9-V36 HydrophobicContact CD1-CG2 3.92Å; Y9-V36 HydrophobicContact CG-CG2 4.47Å; Y9-Y89 WeakPolarHBondContact CA-OH 3.26Å; Y9-Y89 WeakPolarHBondContact CB-OH 3.27Å
10	L	86.6	Confident	71.2	Confident	2 Å²	2	80.5 Å²	80.5	1%	0.01	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-86.3	154.5	176.5	-54.6	-176	0	0	0	111.2	P7 V16 I29 Y89 L106 L108	P7-L10 HydrophobicContact CG-CD2 4.24Å; L10-V16 HydrophobicContact CD1-CG1 3.84Å; L10-I29 HydrophobicContact CB-CD1 3.45Å; L10-I29 VanDerWaalsContact CB-CD1 3.45Å; L10-I29 HydrophobicContact CD1-CD1 3.78Å; L10-I29 HydrophobicContact CG-CD1 4.27Å; L10-Y89 HydrophobicContact CB-CD1 4.38Å; L10-Y89 HydrophobicContact CB-CE1 3.72Å; L10-Y89 PolarHBondContact N-OH 2.91Å; L10-Y89 WeakPolarHBondContact O-CE1 3.41Å; L10-L106 HydrophobicContact CD1-CD1 4.29Å; L10-L108 HydrophobicContact CD1-CD2 4.43Å; L10-L108 HydrophobicContact CD2-CD2 3.83Å; L10-L108 HydrophobicContact CD2-CG 4.47Å
11	T	87.6	Confident	71.2	Confident	85 Å²	85	86.1 Å²	86.1	52%	0.521	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-103.1	157.6	-179	53	0	0	0	0	112.4	G13 T14	T11-G13 PolarHBondContact O-N 3.41Å; T11-T14 WeakPolarHBondContact O-CB 3.34Å; T11-T14 PolarHBondContact O-N 2.91Å; T11-T14 PolarHBondContact O-OG1 3Å; T11-T14 PolarHBondContact OG1-OG1 3.4Å
12	V	90.6	Very high	73	Confident	89 Å²	89	77.1 Å²	77.1	54%	0.539	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	136.8	172	176.5	0	0	0	0	109.5	I29 K30 A32	V12-I29 HydrophobicContact CG2-CG2 4.49Å; V12-K30 VanDerWaalsContact CG1-O 3.23Å; V12-K30 WeakPolarHBondContact CG1-O 3.14Å; V12-A32 HydrophobicContact CG2-CB 4.15Å
13	G	87.1	Confident	75.3	Confident	35 Å²	35	70.4 Å²	70.4	36%	0.361	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.2	-15.5	-175.2	0	0	0	0	0	114.9	T11 D15 K28 I29	T11-G13 PolarHBondContact O-N 3.41Å; G13-D15 PolarHBondContact O-N 3.14Å; G13-K28 PolarHBondContact O-NZ 3.01Å; G13-I29 PolarHBondContact N-O 3.31Å
14	T	89.3	Confident	77.5	Confident	33 Å²	33	71.2 Å²	71.2	20%	0.202	39%	0.387	C	S	.	.			trans	-59.9	132.6	176.1	-56.9	0	0	0	0	110.9	T11 V16 I29 L108	T11-T14 WeakPolarHBondContact O-CB 3.34Å; T11-T14 PolarHBondContact O-N 2.91Å; T11-T14 PolarHBondContact O-OG1 3Å; T11-T14 PolarHBondContact OG1-OG1 3.4Å; T14-V16 HydrophobicContact CG2-CG1 4.16Å; T14-I29 PolarHBondContact O-N 2.98Å; T14-L108 HydrophobicContact CG2-CD2 3.67Å
15	D	90.3	Very high	79.5	Confident	65 Å²	65	66.4 Å²	66.4	35%	0.348	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	127.6	172.1	-66.9	-68.6	0	0	0	110.8	G13 K28 K109	G13-D15 PolarHBondContact O-N 3.14Å; D15-K28 VanDerWaalsContact OD1-CE 3.26Å; D15-K28 WeakPolarHBondContact OD1-CE 3.1Å; D15-K28 IonicContact OD1-NZ 2.93Å; D15-K28 PolarHBondContact OD1-NZ 3.41Å; D15-K28 IonicContact OD2-NZ 3.46Å; D15-K28 PolarHBondContact OD2-NZ 2.88Å; D15-K109 HydrophobicContact CB-CB 3.75Å; D15-K109 HydrophobicContact CB-CD 3.59Å; D15-K109 HydrophobicContact CB-CG 4.29Å; D15-K109 WeakPolarHBondContact O-CB 3.29Å; D15-K109 PolarHBondContact O-N 3.42Å; D15-K109 VanDerWaalsContact O-N 3.1Å
16	V	90.3	Very high	81.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	164.6	-176.5	-68	0	0	0	0	110.3	L10 T14 A27 I29 V91 L106 C107	L10-V16 HydrophobicContact CD1-CG1 3.84Å; T14-V16 HydrophobicContact CG2-CG1 4.16Å; V16-A27 HydrophobicContact CG2-CB 4.29Å; V16-A27 WeakPolarHBondContact CG2-O 3.45Å; V16-A27 PolarHBondContact N-O 2.81Å; V16-A27 PolarHBondContact O-N 3.07Å; V16-I29 HydrophobicContact CG1-CD1 4.03Å; V16-I29 HydrophobicContact CG1-CG1 4.16Å; V16-I29 HydrophobicContact CG2-CG1 4Å; V16-V91 HydrophobicContact CG2-CG1 3.91Å; V16-L106 HydrophobicContact CB-CB 4.48Å; V16-L106 HydrophobicContact CG2-CD1 4.37Å; V16-L106 HydrophobicContact CG2-CD2 4.13Å; V16-C107 CarbonylContact C-O 3.5Å; V16-C107 WeakPolarHBondContact CA-O 3.11Å; V16-C107 WeakPolarHBondContact CB-O 3.3Å
17	S	87.5	Confident	82.9	Confident	23 Å²	23	58.7 Å²	58.7	16%	0.161	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.5	164.7	61.2	0	0	0	0	110.3	C25 L106 C107	S17-C25 WeakPolarHBondContact CA-O 3.32Å; S17-L106 WeakPolarHBondContact O-CA 3.33Å; S17-C107 PolarHBondContact N-O 3.21Å; S17-C107 PolarHBondContact O-N 3.32Å
18	A	86.1	Confident	84	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	149.1	-178.2	0	0	0	0	0	111.4	Y20 C25 F93 L101 L106	A18-Y20 PolarHBondContact O-N 2.76Å; A18-C25 PolarHBondContact N-O 3.25Å; A18-C25 PolarHBondContact O-N 2.81Å; A18-F93 HydrophobicContact CB-CE1 3.9Å; A18-F93 HydrophobicContact CB-CZ 3.9Å; A18-L101 HydrophobicContact CB-CD1 3.53Å; A18-L106 HydrophobicContact CB-CD2 3.77Å
19	K	80.8	Confident	85.1	Confident	126 Å²	126	58.2 Å²	58.2	55%	0.548	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.2	178.4	-165.9	173.6	-175.2	174.3	0	110.8	G22 A23 F24	K19-G22 WeakPolarHBondContact CE-O 3.5Å; K19-A23 CarbonylContact C-O 3.47Å; K19-A23 VanDerWaalsContact CA-O 3.27Å; K19-A23 WeakPolarHBondContact CA-O 3.43Å; K19-A23 WeakPolarHBondContact CG-O 3.45Å; K19-F24 HydrophobicContact CB-CD1 4.27Å; K19-F24 HydrophobicContact CB-CE1 4.03Å; K19-F24 HydrophobicContact CB-CZ 4.37Å
20	Y	72.1	Confident	85.6	Confident	39 Å²	39	59.5 Å²	59.5	15%	0.153	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132.7	179.2	-168.8	-130.1	0	0	0	110.9	A18 G22 A23 F93 D97 K99	A18-Y20 PolarHBondContact O-N 2.76Å; Y20-G22 PolarHBondContact O-N 3.12Å; Y20-A23 PolarHBondContact N-O 3.13Å; Y20-A23 PolarHBondContact O-N 2.63Å; Y20-A23 VanDerWaalsContact O-O 3.05Å; Y20-F93 HydrophobicContact CD2-CE2 4.48Å; Y20-F93 HydrophobicContact CG-CE2 4.29Å; Y20-F93 HydrophobicContact CG-CZ 4.27Å; Y20-D97 HydrophobicContact CE1-CB 4.24Å; Y20-D97 WeakPolarHBondContact CE1-OD2 3.4Å; Y20-D97 VanDerWaalsContact CZ-OD2 3.24Å; Y20-D97 PolarHBondContact OH-OD2 3.04Å; Y20-K99 HydrophobicContact CD2-CD 4.15Å; Y20-K99 HydrophobicContact CE2-CD 4.27Å
21	R	71.4	Confident	85.7	Confident	198 Å²	198	62.7 Å²	62.7	75%	0.747	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.2	31.2	-176.1	-63.9	-176.6	171.7	111.9	2.1	115.2	D97	R21-D97 IonicContact CZ-OD2 2.67Å; R21-D97 IonicContact NH1-OD2 2.69Å; R21-D97 PolarHBondContact NH1-OD2 2.96Å; R21-D97 IonicContact NH2-OD2 3.69Å
22	G	73	Confident	85.8	Confident	55 Å²	55	60.3 Å²	60.3	57%	0.567	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.3	-27.6	-179.6	0	0	0	0	0	115	K19 Y20	K19-G22 WeakPolarHBondContact CE-O 3.5Å; Y20-G22 PolarHBondContact O-N 3.12Å
23	A	77.6	Confident	85.8	Confident	56 Å²	56	63.8 Å²	63.8	46%	0.463	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	166.8	177.3	0	0	0	0	0	112.4	K19 Y20	K19-A23 CarbonylContact C-O 3.47Å; K19-A23 VanDerWaalsContact CA-O 3.27Å; K19-A23 WeakPolarHBondContact CA-O 3.43Å; K19-A23 WeakPolarHBondContact CG-O 3.45Å; Y20-A23 PolarHBondContact N-O 3.13Å; Y20-A23 PolarHBondContact O-N 2.63Å; Y20-A23 VanDerWaalsContact O-O 3.05Å
24	F	82.1	Confident	85.7	Confident	118 Å²	118	67.5 Å²	67.5	52%	0.518	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120	164.6	-76.1	-86.7	0	0	0	109	K19 F114	K19-F24 HydrophobicContact CB-CD1 4.27Å; K19-F24 HydrophobicContact CB-CE1 4.03Å; K19-F24 HydrophobicContact CB-CZ 4.37Å; F24-F114 HydrophobicContact CB-CE2 4.25Å
25	C	86.6	Confident	85.5	Confident	41 Å²	41	68.2 Å²	68.2	28%	0.277	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	147.2	176.9	-59.7	0	0	0	0	109.4	S17 A18 F93	S17-C25 WeakPolarHBondContact CA-O 3.32Å; A18-C25 PolarHBondContact N-O 3.25Å; A18-C25 PolarHBondContact O-N 2.81Å; C25-F93 HydrophobicContact CB-CD1 3.51Å; C25-F93 HydrophobicContact CB-CE1 3.79Å
26	E	89.6	Confident	85.5	Confident	88 Å²	88	65.1 Å²	65.1	41%	0.411	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	145.3	169.4	-50.5	-161.9	131.8	0	0	109.3	F93 K109	E26-F93 WeakPolarHBondContact O-CD1 3.25Å; E26-K109 VanDerWaalsContact CD-CE 3.44Å; E26-K109 WeakPolarHBondContact OE1-CE 3.31Å; E26-K109 IonicContact OE1-NZ 2.69Å; E26-K109 PolarHBondContact OE1-NZ 2.99Å; E26-K109 WeakPolarHBondContact OE2-CE 3.01Å; E26-K109 IonicContact OE2-NZ 3.34Å; E26-K109 PolarHBondContact OE2-NZ 3.28Å
27	A	91.6	Very high	85.5	Confident	4 Å²	4	69.3 Å²	69.3	3%	0.033	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	156.7	-177.5	0	0	0	0	0	111.2	V16 V91 V92 F93	V16-A27 HydrophobicContact CG2-CB 4.29Å; V16-A27 WeakPolarHBondContact CG2-O 3.45Å; V16-A27 PolarHBondContact N-O 2.81Å; V16-A27 PolarHBondContact O-N 3.07Å; A27-V91 HydrophobicContact CB-CB 3.85Å; A27-V91 HydrophobicContact CB-CG2 3.83Å; A27-V92 CarbonylContact C-O 3.52Å; A27-V92 WeakPolarHBondContact CA-O 3.39Å; A27-V92 WeakPolarHBondContact CB-O 3.33Å; A27-F93 HydrophobicContact CB-CD1 3.64Å; A27-F93 HydrophobicContact CB-CE1 3.86Å; A27-F93 HydrophobicContact CB-CG 4.22Å
28	K	92.5	Very high	85.7	Confident	91 Å²	91	68.2 Å²	68.2	40%	0.396	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.9	176	-172.7	169.6	-69.6	-69.9	0	110.4	G13 D15 K30 V91 V92	G13-K28 PolarHBondContact O-NZ 3.01Å; D15-K28 VanDerWaalsContact OD1-CE 3.26Å; D15-K28 WeakPolarHBondContact OD1-CE 3.1Å; D15-K28 IonicContact OD1-NZ 2.93Å; D15-K28 PolarHBondContact OD1-NZ 3.41Å; D15-K28 IonicContact OD2-NZ 3.46Å; D15-K28 PolarHBondContact OD2-NZ 2.88Å; K28-K30 PolarHBondContact O-N 2.97Å; K28-K30 VanDerWaalsContact O-N 3.14Å; K28-V91 CarbonylContact O-C 3.5Å; K28-V91 VanDerWaalsContact O-CA 3.31Å; K28-V91 WeakPolarHBondContact O-CA 3.47Å; K28-V92 PolarHBondContact N-O 3.45Å; K28-V92 PolarHBondContact O-N 3.45Å
29	I	93	Very high	86	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.01	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	114.5	176	-57.6	-177.2	0	0	0	109.1	L10 V12 G13 T14 V16 T31 A32 Y89 V91 L106	L10-I29 HydrophobicContact CB-CD1 3.45Å; L10-I29 VanDerWaalsContact CB-CD1 3.45Å; L10-I29 HydrophobicContact CD1-CD1 3.78Å; L10-I29 HydrophobicContact CG-CD1 4.27Å; V12-I29 HydrophobicContact CG2-CG2 4.49Å; G13-I29 PolarHBondContact N-O 3.31Å; T14-I29 PolarHBondContact O-N 2.98Å; V16-I29 HydrophobicContact CG1-CD1 4.03Å; V16-I29 HydrophobicContact CG1-CG1 4.16Å; V16-I29 HydrophobicContact CG2-CG1 4Å; I29-T31 WeakPolarHBondContact CG2-O 3.45Å; I29-A32 HydrophobicContact CG2-CB 4.41Å; I29-Y89 HydrophobicContact CD1-CD1 3.91Å; I29-Y89 HydrophobicContact CD1-CE1 4.41Å; I29-Y89 HydrophobicContact CD1-CG 4.37Å; I29-Y89 HydrophobicContact CG2-CD1 4.05Å; I29-V91 HydrophobicContact CG1-CG1 4.09Å; I29-L106 HydrophobicContact CD1-CD1 4.4Å
30	K	92	Very high	86.5	Confident	99 Å²	99	66.4 Å²	66.4	43%	0.43	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-39.9	177.2	-179.8	-174	173	-173.6	0	112	V12 K28 T90 V92 E98	V12-K30 VanDerWaalsContact CG1-O 3.23Å; V12-K30 WeakPolarHBondContact CG1-O 3.14Å; K28-K30 PolarHBondContact O-N 2.97Å; K28-K30 VanDerWaalsContact O-N 3.14Å; K30-T90 PolarHBondContact N-O 3.17Å; K30-V92 HydrophobicContact CB-CG2 3.7Å; K30-V92 HydrophobicContact CD-CG2 3.58Å; K30-V92 HydrophobicContact CG-CG2 4.11Å; K30-E98 WeakPolarHBondContact CD-OE2 3.23Å; K30-E98 IonicContact NZ-OE1 3.14Å; K30-E98 PolarHBondContact NZ-OE1 3.44Å; K30-E98 IonicContact NZ-OE2 3.51Å; K30-E98 PolarHBondContact NZ-OE2 3.37Å
31	T	89.1	Confident	87.5	Confident	69 Å²	69	66.3 Å²	66.3	42%	0.423	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	152.1	172.6	68.2	0	0	0	0	110.7	I29 Y89 T90	I29-T31 WeakPolarHBondContact CG2-O 3.45Å; T31-Y89 CarbonylContact O-C 3.43Å; T31-Y89 WeakPolarHBondContact O-CA 3.36Å; T31-T90 PolarHBondContact N-O 2.79Å; T31-T90 PolarHBondContact O-N 3.23Å; T31-T90 VanDerWaalsContact OG1-CB 3.24Å; T31-T90 WeakPolarHBondContact OG1-CB 3.48Å; T31-T90 PolarHBondContact OG1-OG1 2.65Å
32	A	90.3	Very high	88.4	Confident	36 Å²	36	57 Å²	57	30%	0.298	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	115.4	176.4	0	0	0	0	0	109.3	V12 I29 R34 Y89	V12-A32 HydrophobicContact CG2-CB 4.15Å; I29-A32 HydrophobicContact CG2-CB 4.41Å; A32-R34 PolarHBondContact O-N 3.33Å; A32-Y89 HydrophobicContact CB-CD1 3.65Å; A32-Y89 HydrophobicContact CB-CE1 3.78Å
33	K	89.1	Confident	89.1	Confident	161 Å²	161	61.1 Å²	61.1	70%	0.7	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	93.3	166.4	-175.2	174.7	-177.7	175.2	0	107.3	S87 W88	K33-S87 WeakPolarHBondContact O-CA 3.49Å; K33-S87 WeakPolarHBondContact O-CB 3.37Å; K33-W88 HydrophobicContact CB-CB 4.41Å; K33-W88 PolarHBondContact N-O 3.5Å; K33-W88 PolarHBondContact O-N 2.93Å
34	R	85.6	Confident	89.2	Confident	114 Å²	114	65.1 Å²	65.1	43%	0.43	30%	0.303	S	S	.	.			trans	-58.8	134.9	179.6	-165.3	-179.1	79.3	-149.5	1.6	110.3	Y9 A32 V36 D53 D54 S87	Y9-R34 HydrophobicContact CD1-CG 4.06Å; Y9-R34 HydrophobicContact CD2-CG 4.09Å; Y9-R34 HydrophobicContact CE1-CG 4.36Å; Y9-R34 HydrophobicContact CE2-CG 4.36Å; Y9-R34 HydrophobicContact CG-CG 3.93Å; A32-R34 PolarHBondContact O-N 3.33Å; R34-V36 HydrophobicContact CG-CG2 4.23Å; R34-D53 IonicContact CZ-OD2 3.59Å; R34-D53 IonicContact NE-OD2 3.39Å; R34-D53 PolarHBondContact NE-OD2 3.47Å; R34-D53 IonicContact NH2-OD2 2.65Å; R34-D53 PolarHBondContact NH2-OD2 3.06Å; R34-D54 IonicContact NH2-OD1 2.82Å; R34-S87 WeakPolarHBondContact CA-OG 3.35Å
35	L	86	Confident	89.2	Confident	48 Å²	48	63.7 Å²	63.7	25%	0.251	30%	0.301	S	S	.	.			trans	-157.1	98.2	170	-178.8	70.1	0	0	0	107.7	Q52 A86 S87	L35-Q52 HydrophobicContact CD1-CG 4.25Å; L35-A86 HydrophobicContact CD2-CB 4.06Å; L35-A86 HydrophobicContact CG-CB 4.22Å; L35-A86 CarbonylContact O-C 3.47Å; L35-A86 VanDerWaalsContact O-CA 3.27Å; L35-A86 WeakPolarHBondContact O-CA 3.31Å; L35-A86 WeakPolarHBondContact O-CB 3.47Å; L35-A86 PolarHBondContact O-N 3.07Å; L35-S87 PolarHBondContact N-OG 3.28Å; L35-S87 PolarHBondContact O-N 3Å; L35-S87 VanDerWaalsContact O-N 3.08Å
36	V	88.9	Confident	89.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	120.7	178.3	-174.5	0	0	0	0	108.5	Y9 R34 V38 D53 L83	Y9-V36 HydrophobicContact CD1-CG2 3.92Å; Y9-V36 HydrophobicContact CG-CG2 4.47Å; R34-V36 HydrophobicContact CG-CG2 4.23Å; V36-V38 HydrophobicContact CG1-CG2 4.15Å; V36-D53 HydrophobicContact CB-CB 4.08Å; V36-D53 PolarHBondContact N-OD1 2.89Å; V36-D53 PolarHBondContact O-N 3.26Å; V36-L83 HydrophobicContact CG1-CB 4.48Å; V36-L83 HydrophobicContact CG1-CD2 4.12Å
37	K	89.8	Confident	89	Confident	88 Å²	88	64.1 Å²	64.1	38%	0.383	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	130.1	172.4	-63	-157.3	-176.2	-170.2	0	109.9	E50 T84 A86	K37-E50 HydrophobicContact CB-CG 4.31Å; K37-E50 WeakPolarHBondContact CD-OE1 3.37Å; K37-E50 IonicContact NZ-OE1 3.76Å; K37-T84 PolarHBondContact N-O 2.99Å; K37-T84 PolarHBondContact O-N 3.4Å; K37-A86 HydrophobicContact CG-CB 4.09Å
38	V	91.9	Very high	88.9	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	115.6	-171.9	-168	0	0	0	0	109.1	V36 V40 E50 V51 I56 L60 I80 K82 L83	V36-V38 HydrophobicContact CG1-CG2 4.15Å; V38-V40 HydrophobicContact CG1-CG1 3.9Å; V38-E50 WeakPolarHBondContact O-CA 3.42Å; V38-V51 HydrophobicContact CB-CG2 4.47Å; V38-V51 PolarHBondContact N-O 3.06Å; V38-V51 PolarHBondContact O-N 3.46Å; V38-I56 HydrophobicContact CB-CD1 3.42Å; V38-I56 VanDerWaalsContact CB-CD1 3.42Å; V38-I56 HydrophobicContact CG1-CD1 3.42Å; V38-I56 VanDerWaalsContact CG1-CD1 3.42Å; V38-I56 HydrophobicContact CG2-CD1 3.74Å; V38-L60 HydrophobicContact CG2-CD2 4.14Å; V38-I80 HydrophobicContact CG1-CB 4.31Å; V38-I80 HydrophobicContact CG1-CD1 3.99Å; V38-I80 HydrophobicContact CG1-CG1 3.85Å; V38-I80 HydrophobicContact CG1-CG2 3.68Å; V38-K82 WeakPolarHBondContact CA-O 3.31Å; V38-L83 HydrophobicContact CB-CD2 4.29Å; V38-L83 HydrophobicContact CG1-CD2 3.79Å; V38-L83 HydrophobicContact CG2-CD2 3.73Å
39	K	92.2	Very high	88.8	Confident	88 Å²	88	66.1 Å²	66.1	38%	0.383	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.9	172.7	-172.4	171.7	-177.4	170.7	0	109.2	V49 N81 K82	K39-V49 WeakPolarHBondContact CA-O 3.38Å; K39-N81 WeakPolarHBondContact O-CB 3.33Å; K39-N81 PolarHBondContact O-N 3.42Å; K39-K82 HydrophobicContact CB-CB 4.19Å; K39-K82 PolarHBondContact N-O 2.88Å; K39-K82 PolarHBondContact O-N 2.9Å
40	V	92.6	Very high	88.7	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	152.2	-175.2	-65	0	0	0	0	110.9	V38 F42 T48 V49 I56 V68 A78 V79 I80	V38-V40 HydrophobicContact CG1-CG1 3.9Å; V40-F42 HydrophobicContact CG2-CE2 4.37Å; V40-T48 VanDerWaalsContact O-CA 3.23Å; V40-T48 WeakPolarHBondContact O-CA 3.5Å; V40-V49 HydrophobicContact CG2-CB 4.41Å; V40-V49 WeakPolarHBondContact CG2-O 3.21Å; V40-V49 PolarHBondContact N-O 3.01Å; V40-V49 PolarHBondContact O-N 3.34Å; V40-V49 VanDerWaalsContact O-N 3.13Å; V40-I56 HydrophobicContact CG1-CD1 4.05Å; V40-V68 HydrophobicContact CB-CG2 4.25Å; V40-V68 HydrophobicContact CG1-CG2 3.94Å; V40-V68 HydrophobicContact CG2-CG1 4.46Å; V40-V68 HydrophobicContact CG2-CG2 4.03Å; V40-A78 HydrophobicContact CB-CB 3.82Å; V40-A78 HydrophobicContact CG1-CB 4.47Å; V40-A78 HydrophobicContact CG2-CB 4.25Å; V40-V79 CarbonylContact C-O 3.51Å; V40-V79 VanDerWaalsContact CA-O 3.29Å; V40-V79 WeakPolarHBondContact CA-O 3.49Å; V40-I80 HydrophobicContact CG1-CG1 4.27Å
41	T	91.7	Very high	88.7	Confident	36 Å²	36	67.4 Å²	67.4	22%	0.221	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.8	164	-58.6	0	0	0	0	108.6	S47 T48 A78 V79 N81	T41-S47 CarbonylContact C-O 3.6Å; T41-S47 VanDerWaalsContact CA-O 3.31Å; T41-S47 WeakPolarHBondContact CA-O 3.34Å; T41-T48 HydrophobicContact CG2-CG2 4.25Å; T41-T48 WeakPolarHBondContact OG1-CG2 3.15Å; T41-A78 CarbonylContact O-C 3.58Å; T41-A78 WeakPolarHBondContact O-CA 3.28Å; T41-A78 WeakPolarHBondContact O-CB 3.5Å; T41-V79 PolarHBondContact N-O 3.17Å; T41-V79 PolarHBondContact O-N 2.77Å; T41-N81 PolarHBondContact N-ND2 2.79Å; T41-N81 VanDerWaalsContact N-ND2 3.15Å; T41-N81 PolarHBondContact OG1-ND2 3.16Å; T41-N81 PolarHBondContact OG1-OD1 2.82Å
42	F	91.1	Very high	88.7	Confident	4 Å²	4	68.4 Å²	68.4	2%	0.018	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	140.7	175.7	-73.6	-78.6	0	0	0	111.4	V40 D45 S46 S47 V49 V68 N70 Q76 A78	V40-F42 HydrophobicContact CG2-CE2 4.37Å; F42-D45 WeakPolarHBondContact CB-OD1 3.35Å; F42-S46 WeakPolarHBondContact O-CA 3.49Å; F42-S46 PolarHBondContact O-N 2.98Å; F42-S47 WeakPolarHBondContact CD2-OG 3.26Å; F42-S47 PolarHBondContact N-O 2.94Å; F42-V49 HydrophobicContact CD2-CG2 4.31Å; F42-V49 HydrophobicContact CE2-CB 4Å; F42-V49 HydrophobicContact CE2-CG2 3.74Å; F42-V68 HydrophobicContact CE1-CB 3.74Å; F42-V68 HydrophobicContact CE1-CG1 4.19Å; F42-V68 HydrophobicContact CE1-CG2 4.4Å; F42-V68 HydrophobicContact CZ-CB 3.85Å; F42-V68 HydrophobicContact CZ-CG1 3.76Å; F42-N70 WeakPolarHBondContact CZ-OD1 3.37Å; F42-Q76 HydrophobicContact CD1-CB 3.94Å; F42-Q76 HydrophobicContact CD1-CG 3.92Å; F42-Q76 HydrophobicContact CE1-CB 3.86Å; F42-Q76 HydrophobicContact CE1-CG 4.35Å; F42-A78 HydrophobicContact CD1-CB 3.76Å; F42-A78 HydrophobicContact CE1-CB 4.14Å; F42-A78 HydrophobicContact CG-CB 4.14Å
43	R	86.8	Confident	88.5	Confident	141 Å²	141	67.1 Å²	67.1	53%	0.532	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-20.1	-171.3	-67.3	-174.9	69.1	-159.8	1	114.6	E77 V79	R43-E77 WeakPolarHBondContact CD-OE2 3.43Å; R43-E77 HydrophobicContact CG-CB 4.39Å; R43-E77 IonicContact CZ-OE2 3.86Å; R43-E77 PolarHBondContact N-O 2.88Å; R43-E77 IonicContact NE-OE2 2.67Å; R43-E77 IonicContact NH1-OE2 2.58Å; R43-E77 PolarHBondContact NH1-OE2 2.83Å; R43-V79 HydrophobicContact CG-CG2 4.2Å
44	H	80.9	Confident	88.5	Confident	139 Å²	139	65 Å²	65	64%	0.644	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-32.7	-169.1	-67.8	-75.9	0	0	0	114.1
45	D	82.1	Confident	88.6	Confident	89 Å²	89	63.5 Å²	63.5	48%	0.476	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-7.6	-176.8	64.5	-14.9	0	0	0	112.5	F42 S47	F42-D45 WeakPolarHBondContact CB-OD1 3.35Å; D45-S47 VanDerWaalsContact CG-OG 3.25Å; D45-S47 PolarHBondContact O-N 3.47Å; D45-S47 PolarHBondContact OD1-N 3.41Å; D45-S47 VanDerWaalsContact OD1-N 3.13Å; D45-S47 PolarHBondContact OD1-OG 3.37Å; D45-S47 WeakPolarHBondContact OD2-CB 3.4Å; D45-S47 PolarHBondContact OD2-OG 2.96Å
46	S	84.3	Confident	88.8	Confident	94 Å²	94	62 Å²	62	66%	0.657	32%	0.316	S	S	*	.			trans	58.9	18	-173.6	-54	0	0	0	0	114.8	F42	F42-S46 WeakPolarHBondContact O-CA 3.49Å; F42-S46 PolarHBondContact O-N 2.98Å
47	S	87.3	Confident	88.8	Confident	43 Å²	43	66.9 Å²	66.9	30%	0.301	34%	0.337	S	S	.	.			trans	-73.9	150	178.2	73.5	0	0	0	0	110.9	T41 F42 D45	T41-S47 CarbonylContact C-O 3.6Å; T41-S47 VanDerWaalsContact CA-O 3.31Å; T41-S47 WeakPolarHBondContact CA-O 3.34Å; F42-S47 WeakPolarHBondContact CD2-OG 3.26Å; F42-S47 PolarHBondContact N-O 2.94Å; D45-S47 VanDerWaalsContact CG-OG 3.25Å; D45-S47 PolarHBondContact O-N 3.47Å; D45-S47 PolarHBondContact OD1-N 3.41Å; D45-S47 VanDerWaalsContact OD1-N 3.13Å; D45-S47 PolarHBondContact OD1-OG 3.37Å; D45-S47 WeakPolarHBondContact OD2-CB 3.4Å; D45-S47 PolarHBondContact OD2-OG 2.96Å
48	T	89.5	Confident	88.7	Confident	75 Å²	75	64.9 Å²	64.9	46%	0.46	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.5	177.1	72.4	0	0	0	0	111.5	V40 T41	V40-T48 VanDerWaalsContact O-CA 3.23Å; V40-T48 WeakPolarHBondContact O-CA 3.5Å; T41-T48 HydrophobicContact CG2-CG2 4.25Å; T41-T48 WeakPolarHBondContact OG1-CG2 3.15Å
49	V	90.3	Very high	88.3	Confident	62 Å²	62	68.8 Å²	68.8	38%	0.376	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	152.5	-179.9	-177.9	0	0	0	0	109.5	K39 V40 F42 V51	K39-V49 WeakPolarHBondContact CA-O 3.38Å; V40-V49 HydrophobicContact CG2-CB 4.41Å; V40-V49 WeakPolarHBondContact CG2-O 3.21Å; V40-V49 PolarHBondContact N-O 3.01Å; V40-V49 PolarHBondContact O-N 3.34Å; V40-V49 VanDerWaalsContact O-N 3.13Å; F42-V49 HydrophobicContact CD2-CG2 4.31Å; F42-V49 HydrophobicContact CE2-CB 4Å; F42-V49 HydrophobicContact CE2-CG2 3.74Å; V49-V51 HydrophobicContact CG1-CG1 3.82Å
50	E	91.4	Very high	88.1	Confident	111 Å²	111	66.6 Å²	66.6	52%	0.519	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.3	171.4	-171.5	174.9	142.3	0	0	108.8	K37 V38	K37-E50 HydrophobicContact CB-CG 4.31Å; K37-E50 WeakPolarHBondContact CD-OE1 3.37Å; K37-E50 IonicContact NZ-OE1 3.76Å; V38-E50 WeakPolarHBondContact O-CA 3.42Å
51	V	91	Very high	87.8	Confident	18 Å²	18	72.4 Å²	72.4	11%	0.109	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	166.4	-178	-61.7	0	0	0	0	111	V38 V49 H55 I56 V68	V38-V51 HydrophobicContact CB-CG2 4.47Å; V38-V51 PolarHBondContact N-O 3.06Å; V38-V51 PolarHBondContact O-N 3.46Å; V49-V51 HydrophobicContact CG1-CG1 3.82Å; V51-H55 HydrophobicContact CB-CB 4.38Å; V51-I56 HydrophobicContact CG2-CD1 3.57Å; V51-I56 HydrophobicContact CG2-CG1 3.66Å; V51-V68 HydrophobicContact CB-CG1 4.39Å; V51-V68 HydrophobicContact CG1-CG1 3.81Å; V51-V68 HydrophobicContact CG2-CG1 3.92Å
52	Q	90.1	Very high	87.5	Confident	89 Å²	89	75 Å²	75	42%	0.416	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	158.3	171.7	-59.5	-175.6	20	0	0	110.5	L35 D54 H55	L35-Q52 HydrophobicContact CD1-CG 4.25Å; Q52-D54 PolarHBondContact O-N 2.95Å; Q52-H55 PolarHBondContact O-N 3.27Å
53	D	86.8	Confident	87.3	Confident	9 Å²	9	77.5 Å²	77.5	5%	0.048	43%	0.427	C	S	.	.	G	3₁₀ helix	trans	-61	-30.1	179.8	54.4	-64.5	0	0	0	113.8	R34 V36 H55 I56 L60	R34-D53 IonicContact CZ-OD2 3.59Å; R34-D53 IonicContact NE-OD2 3.39Å; R34-D53 PolarHBondContact NE-OD2 3.47Å; R34-D53 IonicContact NH2-OD2 2.65Å; R34-D53 PolarHBondContact NH2-OD2 3.06Å; V36-D53 HydrophobicContact CB-CB 4.08Å; V36-D53 PolarHBondContact N-OD1 2.89Å; V36-D53 PolarHBondContact O-N 3.26Å; D53-H55 PolarHBondContact O-N 2.91Å; D53-I56 PolarHBondContact O-N 2.88Å; D53-L60 HydrophobicContact CB-CD1 3.93Å; D53-L60 HydrophobicContact CB-CD2 4.27Å
54	D	88.1	Confident	87.4	Confident	116 Å²	116	71.6 Å²	71.6	62%	0.62	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-65.4	-16.8	175.8	-65.3	-23.7	0	0	0	113.5	R34 Q52	R34-D54 IonicContact NH2-OD1 2.82Å; Q52-D54 PolarHBondContact O-N 2.95Å
55	H	88.5	Confident	87.8	Confident	83 Å²	83	69.4 Å²	69.4	38%	0.384	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-96.4	6.4	175.8	-62	166.6	0	0	0	113.4	V51 Q52 D53 K69	V51-H55 HydrophobicContact CB-CB 4.38Å; Q52-H55 PolarHBondContact O-N 3.27Å; D53-H55 PolarHBondContact O-N 2.91Å; H55-K69 HydrophobicContact CB-CB 4.32Å; H55-K69 PolarHBondContact O-N 3.38Å
56	I	89.4	Confident	88.4	Confident	18 Å²	18	65.4 Å²	65.4	9%	0.092	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.2	-177.8	-66.5	-171	0	0	0	111.2	V38 V40 V51 D53 L60 V66 V68	V38-I56 HydrophobicContact CB-CD1 3.42Å; V38-I56 VanDerWaalsContact CB-CD1 3.42Å; V38-I56 HydrophobicContact CG1-CD1 3.42Å; V38-I56 VanDerWaalsContact CG1-CD1 3.42Å; V38-I56 HydrophobicContact CG2-CD1 3.74Å; V40-I56 HydrophobicContact CG1-CD1 4.05Å; V51-I56 HydrophobicContact CG2-CD1 3.57Å; V51-I56 HydrophobicContact CG2-CG1 3.66Å; D53-I56 PolarHBondContact O-N 2.88Å; I56-L60 HydrophobicContact CB-CD2 4.42Å; I56-L60 HydrophobicContact CG2-CD2 4.08Å; I56-V66 HydrophobicContact CG2-CB 3.76Å; I56-V66 HydrophobicContact CG2-CG1 4.08Å; I56-V66 HydrophobicContact CG2-CG2 3.81Å; I56-V68 HydrophobicContact CD1-CG2 4.5Å; I56-V68 HydrophobicContact CG1-CG2 4.23Å
57	K	89	Confident	88.7	Confident	102 Å²	102	65.3 Å²	65.3	44%	0.443	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.4	166.2	-68.5	174.2	-179.9	165.9	0	109.9	V66 E67 Y75	K57-V66 WeakPolarHBondContact O-CB 3.42Å; K57-E67 HydrophobicContact CB-CB 4.23Å; K57-E67 PolarHBondContact N-O 3.12Å; K57-E67 PolarHBondContact O-N 2.96Å; K57-Y75 HydrophobicContact CD-CD1 3.88Å; K57-Y75 HydrophobicContact CD-CE1 3.53Å; K57-Y75 WeakPolarHBondContact CE-OH 3.32Å; K57-Y75 HydrophobicContact CG-CD1 4.41Å; K57-Y75 HydrophobicContact CG-CE1 3.9Å; K57-Y75 VanDerWaalsContact NZ-CE2 3.31Å
58	G	86.9	Confident	89	Confident	46 Å²	46	63.3 Å²	63.3	47%	0.474	35%	0.354	S	S	.	.	S	Bend	trans	138	-178.4	177	0	0	0	0	0	112.6	L60	G58-L60 PolarHBondContact O-N 3.36Å
59	P	85	Confident	89	Confident	81 Å²	81	64 Å²	64	53%	0.526	35%	0.35	S	S	.	.			trans	-71.8	121.7	-179.7	27.4	-31.6	0	0	0	111	K61 A64	P59-K61 PolarHBondContact O-N 3.33Å; P59-A64 HydrophobicContact CG-CB 4.01Å; P59-A64 WeakPolarHBondContact O-CB 3.35Å
60	L	86.4	Confident	88.6	Confident	42 Å²	42	63.2 Å²	63.2	22%	0.22	34%	0.344	C	S	.	.			trans	-71	73.4	173.3	-63.5	174	0	0	0	110.9	V38 D53 I56 G58 I80 L83	V38-L60 HydrophobicContact CG2-CD2 4.14Å; D53-L60 HydrophobicContact CB-CD1 3.93Å; D53-L60 HydrophobicContact CB-CD2 4.27Å; I56-L60 HydrophobicContact CB-CD2 4.42Å; I56-L60 HydrophobicContact CG2-CD2 4.08Å; G58-L60 PolarHBondContact O-N 3.36Å; L60-I80 HydrophobicContact CD2-CD1 4.47Å; L60-L83 HydrophobicContact CB-CD2 4.27Å; L60-L83 HydrophobicContact CD2-CD2 4.35Å; L60-L83 VanDerWaalsContact O-CD1 3.29Å; L60-L83 WeakPolarHBondContact O-CD1 3.34Å
61	K	86.3	Confident	87.9	Confident	122 Å²	122	66.6 Å²	66.6	53%	0.53	37%	0.365	S	S	.	.			trans	-134	138.6	174.4	-64.4	-162.8	174.9	-148.6	0	110.1	D5 P59 G63 A64	D5-K61 IonicContact OD2-NZ 3.82Å; P59-K61 PolarHBondContact O-N 3.33Å; K61-G63 PolarHBondContact O-N 3.3Å; K61-A64 HydrophobicContact CB-CB 4.37Å; K61-A64 WeakPolarHBondContact O-CB 3.46Å; K61-A64 PolarHBondContact O-N 3.18Å
62	V	87.3	Confident	87.3	Confident	92 Å²	92	72.9 Å²	72.9	56%	0.558	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	133.1	175.1	177.4	0	0	0	0	109.7	A64 I80 N81 L83	V62-A64 VanDerWaalsContact C-N 3.34Å; V62-I80 HydrophobicContact CG2-CG2 4.36Å; V62-N81 WeakPolarHBondContact CG1-O 3.4Å; V62-L83 HydrophobicContact CG2-CB 4.44Å; V62-L83 HydrophobicContact CG2-CD1 4.09Å; V62-L83 HydrophobicContact CG2-CG 4.08Å
63	G	85.4	Confident	86.6	Confident	56 Å²	56	70.2 Å²	70.2	58%	0.577	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-3.6	-173	0	0	0	0	0	115.1	K61 I80	K61-G63 PolarHBondContact O-N 3.3Å; G63-I80 PolarHBondContact N-O 2.89Å
64	A	88.5	Confident	86.6	Confident	17 Å²	17	72.5 Å²	72.5	14%	0.14	41%	0.414	C	S	.	.			trans	-74.4	145.1	173.8	0	0	0	0	0	112.1	P59 K61 V62 V66 V79 I80	P59-A64 HydrophobicContact CG-CB 4.01Å; P59-A64 WeakPolarHBondContact O-CB 3.35Å; K61-A64 HydrophobicContact CB-CB 4.37Å; K61-A64 WeakPolarHBondContact O-CB 3.46Å; K61-A64 PolarHBondContact O-N 3.18Å; V62-A64 VanDerWaalsContact C-N 3.34Å; A64-V66 HydrophobicContact CB-CG1 4.33Å; A64-V79 WeakPolarHBondContact O-CA 3.16Å; A64-I80 PolarHBondContact O-N 3.11Å
65	I	90.9	Very high	86.6	Confident	93 Å²	93	71.4 Å²	71.4	48%	0.477	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	129.4	165.3	-54.8	172.4	0	0	0	107.4	A78 V79	I65-A78 WeakPolarHBondContact CA-O 3.15Å; I65-V79 HydrophobicContact CG1-CG2 4.34Å
66	V	93.3	Very high	86.7	Confident	4 Å²	4	70.3 Å²	70.3	2%	0.024	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	158.1	-178.8	-62.1	0	0	0	0	110.3	I56 K57 A64 V68 A78 I80	I56-V66 HydrophobicContact CG2-CB 3.76Å; I56-V66 HydrophobicContact CG2-CG1 4.08Å; I56-V66 HydrophobicContact CG2-CG2 3.81Å; K57-V66 WeakPolarHBondContact O-CB 3.42Å; A64-V66 HydrophobicContact CB-CG1 4.33Å; V66-V68 HydrophobicContact CG2-CG2 4.12Å; V66-A78 PolarHBondContact N-O 3.13Å; V66-A78 PolarHBondContact O-N 2.82Å; V66-A78 VanDerWaalsContact O-O 3.11Å; V66-I80 HydrophobicContact CG1-CD1 3.7Å; V66-I80 HydrophobicContact CG1-CG1 4.1Å; V66-I80 HydrophobicContact CG2-CD1 4.06Å; V66-I80 HydrophobicContact CG2-CG1 3.68Å
67	E	91.9	Very high	86.9	Confident	93 Å²	93	73.1 Å²	73.1	44%	0.435	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	127.6	171.8	-62.1	-179.2	133.5	0	0	109.7	K57 Y75	K57-E67 HydrophobicContact CB-CB 4.23Å; K57-E67 PolarHBondContact N-O 3.12Å; K57-E67 PolarHBondContact O-N 2.96Å; E67-Y75 HydrophobicContact CB-CD1 4.12Å
68	V	92.3	Very high	87	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.9	-177.8	179.9	0	0	0	0	109.2	V40 F42 V51 I56 V66 Y75 Q76 A78	V40-V68 HydrophobicContact CB-CG2 4.25Å; V40-V68 HydrophobicContact CG1-CG2 3.94Å; V40-V68 HydrophobicContact CG2-CG1 4.46Å; V40-V68 HydrophobicContact CG2-CG2 4.03Å; F42-V68 HydrophobicContact CE1-CB 3.74Å; F42-V68 HydrophobicContact CE1-CG1 4.19Å; F42-V68 HydrophobicContact CE1-CG2 4.4Å; F42-V68 HydrophobicContact CZ-CB 3.85Å; F42-V68 HydrophobicContact CZ-CG1 3.76Å; V51-V68 HydrophobicContact CB-CG1 4.39Å; V51-V68 HydrophobicContact CG1-CG1 3.81Å; V51-V68 HydrophobicContact CG2-CG1 3.92Å; I56-V68 HydrophobicContact CD1-CG2 4.5Å; I56-V68 HydrophobicContact CG1-CG2 4.23Å; V66-V68 HydrophobicContact CG2-CG2 4.12Å; V68-Y75 WeakPolarHBondContact O-CA 3.13Å; V68-Q76 PolarHBondContact N-O 3.14Å; V68-Q76 PolarHBondContact O-N 3.06Å; V68-A78 HydrophobicContact CG2-CB 3.72Å
69	K	90.3	Very high	87.3	Confident	89 Å²	89	68.2 Å²	68.2	39%	0.387	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.3	176	-167.5	-171.4	174.3	-167.9	0	110.4	H55 A74 Y75	H55-K69 HydrophobicContact CB-CB 4.32Å; H55-K69 PolarHBondContact O-N 3.38Å; K69-A74 WeakPolarHBondContact CA-O 3.18Å; K69-Y75 HydrophobicContact CB-CD1 4.22Å; K69-Y75 HydrophobicContact CB-CE1 3.78Å; K69-Y75 HydrophobicContact CG-CE1 4.35Å; K69-Y75 HydrophobicContact CG-CE2 4.32Å
70	N	82.1	Confident	87.7	Confident	46 Å²	46	64.4 Å²	64.4	25%	0.246	35%	0.354	C	S	.	.			trans	-79.5	170.7	172.4	-72.8	-13.3	0	0	0	111.5	F42 D72 G73 A74 Q76	F42-N70 WeakPolarHBondContact CZ-OD1 3.37Å; N70-D72 VanDerWaalsContact C-N 3.25Å; N70-D72 PolarHBondContact O-N 3.11Å; N70-G73 PolarHBondContact O-N 3.43Å; N70-A74 PolarHBondContact N-O 2.92Å; N70-Q76 PolarHBondContact ND2-OE1 2.77Å
71	L	76.9	Confident	87.9	Confident	183 Å²	183	65.9 Å²	65.9	96%	0.958	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-40	177.4	-64.1	174.8	0	0	0	111.6	G73	L71-G73 PolarHBondContact O-N 3.09Å
72	D	77.4	Confident	88	Confident	150 Å²	150	65.8 Å²	65.8	80%	0.802	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	8.3	175.6	-40.4	-42.7	0	0	0	114.1	N70 A74	N70-D72 VanDerWaalsContact C-N 3.25Å; N70-D72 PolarHBondContact O-N 3.11Å; D72-A74 PolarHBondContact O-N 3.18Å
73	G	76.9	Confident	88.1	Confident	33 Å²	33	63.2 Å²	63.2	34%	0.34	35%	0.345	S	S	.	.	S	Bend	trans	74.8	-13.9	-179.7	0	0	0	0	0	115.8	N70 L71	N70-G73 PolarHBondContact O-N 3.43Å; L71-G73 PolarHBondContact O-N 3.09Å
74	A	85.8	Confident	88.3	Confident	56 Å²	56	63 Å²	63	46%	0.463	33%	0.332	S	S	.	.			trans	-65.6	147.2	175.6	0	0	0	0	0	112.4	K69 N70 D72	K69-A74 WeakPolarHBondContact CA-O 3.18Å; N70-A74 PolarHBondContact N-O 2.92Å; D72-A74 PolarHBondContact O-N 3.18Å
75	Y	88.6	Confident	88.2	Confident	94 Å²	94	63.6 Å²	63.6	37%	0.369	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.7	173.6	-73.9	-92.6	0	0	0	109.9	K57 E67 V68 K69	K57-Y75 HydrophobicContact CD-CD1 3.88Å; K57-Y75 HydrophobicContact CD-CE1 3.53Å; K57-Y75 WeakPolarHBondContact CE-OH 3.32Å; K57-Y75 HydrophobicContact CG-CD1 4.41Å; K57-Y75 HydrophobicContact CG-CE1 3.9Å; K57-Y75 VanDerWaalsContact NZ-CE2 3.31Å; E67-Y75 HydrophobicContact CB-CD1 4.12Å; V68-Y75 WeakPolarHBondContact O-CA 3.13Å; K69-Y75 HydrophobicContact CB-CD1 4.22Å; K69-Y75 HydrophobicContact CB-CE1 3.78Å; K69-Y75 HydrophobicContact CG-CE1 4.35Å; K69-Y75 HydrophobicContact CG-CE2 4.32Å
76	Q	90.3	Very high	88	Confident	60 Å²	60	60.1 Å²	60.1	28%	0.28	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	143.2	179.8	-169.4	170.7	40.8	0	0	111.8	F42 V68 N70 A78	F42-Q76 HydrophobicContact CD1-CB 3.94Å; F42-Q76 HydrophobicContact CD1-CG 3.92Å; F42-Q76 HydrophobicContact CE1-CB 3.86Å; F42-Q76 HydrophobicContact CE1-CG 4.35Å; V68-Q76 PolarHBondContact N-O 3.14Å; V68-Q76 PolarHBondContact O-N 3.06Å; N70-Q76 PolarHBondContact ND2-OE1 2.77Å; Q76-A78 PolarHBondContact O-N 3.13Å
77	E	92.6	Very high	87.8	Confident	76 Å²	76	59.9 Å²	59.9	36%	0.355	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	127.1	-179.3	-71.4	-164.7	166.6	0	0	112.2	R43	R43-E77 WeakPolarHBondContact CD-OE2 3.43Å; R43-E77 HydrophobicContact CG-CB 4.39Å; R43-E77 IonicContact CZ-OE2 3.86Å; R43-E77 PolarHBondContact N-O 2.88Å; R43-E77 IonicContact NE-OE2 2.67Å; R43-E77 IonicContact NH1-OE2 2.58Å; R43-E77 PolarHBondContact NH1-OE2 2.83Å
78	A	92.6	Very high	87.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	160.2	175.3	0	0	0	0	0	111.5	V40 T41 F42 I65 V66 V68 Q76	V40-A78 HydrophobicContact CB-CB 3.82Å; V40-A78 HydrophobicContact CG1-CB 4.47Å; V40-A78 HydrophobicContact CG2-CB 4.25Å; T41-A78 CarbonylContact O-C 3.58Å; T41-A78 WeakPolarHBondContact O-CA 3.28Å; T41-A78 WeakPolarHBondContact O-CB 3.5Å; F42-A78 HydrophobicContact CD1-CB 3.76Å; F42-A78 HydrophobicContact CE1-CB 4.14Å; F42-A78 HydrophobicContact CG-CB 4.14Å; I65-A78 WeakPolarHBondContact CA-O 3.15Å; V66-A78 PolarHBondContact N-O 3.13Å; V66-A78 PolarHBondContact O-N 2.82Å; V66-A78 VanDerWaalsContact O-O 3.11Å; V68-A78 HydrophobicContact CG2-CB 3.72Å; Q76-A78 PolarHBondContact O-N 3.13Å
79	V	92.8	Very high	87.8	Confident	45 Å²	45	60.3 Å²	60.3	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.6	174.6	-175.9	0	0	0	0	109.2	V40 T41 R43 A64 I65 N81	V40-V79 CarbonylContact C-O 3.51Å; V40-V79 VanDerWaalsContact CA-O 3.29Å; V40-V79 WeakPolarHBondContact CA-O 3.49Å; T41-V79 PolarHBondContact N-O 3.17Å; T41-V79 PolarHBondContact O-N 2.77Å; R43-V79 HydrophobicContact CG-CG2 4.2Å; A64-V79 WeakPolarHBondContact O-CA 3.16Å; I65-V79 HydrophobicContact CG1-CG2 4.34Å; V79-N81 PolarHBondContact O-N 2.86Å
80	I	92.8	Very high	87.9	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	115.7	176.1	-61.1	179.7	0	0	0	109.9	V38 V40 L60 V62 G63 A64 V66 L83	V38-I80 HydrophobicContact CG1-CB 4.31Å; V38-I80 HydrophobicContact CG1-CD1 3.99Å; V38-I80 HydrophobicContact CG1-CG1 3.85Å; V38-I80 HydrophobicContact CG1-CG2 3.68Å; V40-I80 HydrophobicContact CG1-CG1 4.27Å; L60-I80 HydrophobicContact CD2-CD1 4.47Å; V62-I80 HydrophobicContact CG2-CG2 4.36Å; G63-I80 PolarHBondContact N-O 2.89Å; A64-I80 PolarHBondContact O-N 3.11Å; V66-I80 HydrophobicContact CG1-CD1 3.7Å; V66-I80 HydrophobicContact CG1-CG1 4.1Å; V66-I80 HydrophobicContact CG2-CD1 4.06Å; V66-I80 HydrophobicContact CG2-CG1 3.68Å; I80-L83 HydrophobicContact CD1-CD2 4.47Å; I80-L83 HydrophobicContact CG2-CD2 4.06Å; I80-L83 HydrophobicContact CG2-CG 3.96Å
81	N	90.8	Very high	88.4	Confident	73 Å²	73	55 Å²	55	39%	0.39	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-36.3	174.5	-56.3	-61.4	0	0	0	112.7	K39 T41 V62 V79	K39-N81 WeakPolarHBondContact O-CB 3.33Å; K39-N81 PolarHBondContact O-N 3.42Å; T41-N81 PolarHBondContact N-ND2 2.79Å; T41-N81 VanDerWaalsContact N-ND2 3.15Å; T41-N81 PolarHBondContact OG1-ND2 3.16Å; T41-N81 PolarHBondContact OG1-OD1 2.82Å; V62-N81 WeakPolarHBondContact CG1-O 3.4Å; V79-N81 PolarHBondContact O-N 2.86Å
82	K	88.8	Confident	89.1	Confident	121 Å²	121	48.3 Å²	48.3	53%	0.526	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	131.4	-175.1	-171	-175.8	178.6	-166.9	0	110.8	V38 K39 T84	V38-K82 WeakPolarHBondContact CA-O 3.31Å; K39-K82 HydrophobicContact CB-CB 4.19Å; K39-K82 PolarHBondContact N-O 2.88Å; K39-K82 PolarHBondContact O-N 2.9Å; K82-T84 WeakPolarHBondContact CE-OG1 3.2Å
83	L	89.3	Confident	89.7	Confident	38 Å²	38	41.3 Å²	41.3	20%	0.199	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135	164.1	-64.2	163.4	0	0	0	107.8	P8 V36 V38 L60 V62 I80	P8-L83 HydrophobicContact CB-CD1 4.36Å; V36-L83 HydrophobicContact CG1-CB 4.48Å; V36-L83 HydrophobicContact CG1-CD2 4.12Å; V38-L83 HydrophobicContact CB-CD2 4.29Å; V38-L83 HydrophobicContact CG1-CD2 3.79Å; V38-L83 HydrophobicContact CG2-CD2 3.73Å; L60-L83 HydrophobicContact CB-CD2 4.27Å; L60-L83 HydrophobicContact CD2-CD2 4.35Å; L60-L83 VanDerWaalsContact O-CD1 3.29Å; L60-L83 WeakPolarHBondContact O-CD1 3.34Å; V62-L83 HydrophobicContact CG2-CB 4.44Å; V62-L83 HydrophobicContact CG2-CD1 4.09Å; V62-L83 HydrophobicContact CG2-CG 4.08Å; I80-L83 HydrophobicContact CD1-CD2 4.47Å; I80-L83 HydrophobicContact CG2-CD2 4.06Å; I80-L83 HydrophobicContact CG2-CG 3.96Å
84	T	88.6	Confident	90	Very high	50 Å²	50	46 Å²	46	31%	0.307	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	112.9	175.7	-53.1	0	0	0	0	108.4	K37 K82 A86	K37-T84 PolarHBondContact N-O 2.99Å; K37-T84 PolarHBondContact O-N 3.4Å; K82-T84 WeakPolarHBondContact CE-OG1 3.2Å; T84-A86 PolarHBondContact O-N 3.14Å
85	D	88.3	Confident	90	Very high	31 Å²	31	48.1 Å²	48.1	17%	0.166	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	112.3	175.4	-173.4	12.8	0	0	0	110.4	P8 S87 Y89 R103	P8-D85 WeakPolarHBondContact O-CB 3.47Å; D85-S87 WeakPolarHBondContact OD1-CB 3.35Å; D85-S87 PolarHBondContact OD1-N 3Å; D85-S87 PolarHBondContact OD1-OG 3.15Å; D85-Y89 PolarHBondContact OD1-OH 3.39Å; D85-Y89 PolarHBondContact OD2-OH 2.83Å; D85-R103 HydrophobicContact CB-CB 4.13Å; D85-R103 HydrophobicContact CB-CG 3.96Å; D85-R103 VanDerWaalsContact OD2-CB 3.28Å; D85-R103 WeakPolarHBondContact OD2-CB 3.43Å; D85-R103 WeakPolarHBondContact OD2-CD 3.42Å; D85-R103 VanDerWaalsContact OD2-CG 3.22Å; D85-R103 WeakPolarHBondContact OD2-CG 3.32Å
86	A	85.6	Confident	89.7	Confident	19 Å²	19	46 Å²	46	16%	0.157	25%	0.247	C	C	.	.			trans	-109.3	13.2	174	0	0	0	0	0	111.9	L35 K37 T84	L35-A86 HydrophobicContact CD2-CB 4.06Å; L35-A86 HydrophobicContact CG-CB 4.22Å; L35-A86 CarbonylContact O-C 3.47Å; L35-A86 VanDerWaalsContact O-CA 3.27Å; L35-A86 WeakPolarHBondContact O-CA 3.31Å; L35-A86 WeakPolarHBondContact O-CB 3.47Å; L35-A86 PolarHBondContact O-N 3.07Å; K37-A86 HydrophobicContact CG-CB 4.09Å; T84-A86 PolarHBondContact O-N 3.14Å
87	S	89.8	Confident	89.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.248	C	C	.	.			trans	-64	153.8	-178.2	-51.9	0	0	0	0	112.3	K33 R34 L35 D85 Y89	K33-S87 WeakPolarHBondContact O-CA 3.49Å; K33-S87 WeakPolarHBondContact O-CB 3.37Å; R34-S87 WeakPolarHBondContact CA-OG 3.35Å; L35-S87 PolarHBondContact N-OG 3.28Å; L35-S87 PolarHBondContact O-N 3Å; L35-S87 VanDerWaalsContact O-N 3.08Å; D85-S87 WeakPolarHBondContact OD1-CB 3.35Å; D85-S87 PolarHBondContact OD1-N 3Å; D85-S87 PolarHBondContact OD1-OG 3.15Å; S87-Y89 WeakPolarHBondContact CB-OH 3.45Å
88	W	89.9	Confident	89.5	Confident	101 Å²	101	47.1 Å²	47.1	38%	0.383	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134	172.3	-66.4	86	0	0	0	110	K33 T100 R102	K33-W88 HydrophobicContact CB-CB 4.41Å; K33-W88 PolarHBondContact N-O 3.5Å; K33-W88 PolarHBondContact O-N 2.93Å; W88-T100 HydrophobicContact CB-CG2 4.02Å; W88-T100 HydrophobicContact CE3-CG2 4.04Å; W88-R102 HydrophobicContact CD2-CG 4.07Å; W88-R102 HydrophobicContact CE3-CG 3.82Å; W88-R102 HydrophobicContact CH2-CG 4.14Å; W88-R102 HydrophobicContact CZ2-CG 4.34Å; W88-R102 VanDerWaalsContact CZ2-NE 3.31Å; W88-R102 HydrophobicContact CZ3-CG 3.85Å
89	Y	93	Very high	89.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.3	-175.2	-59.9	-76.3	0	0	0	109.2	Y9 L10 I29 T31 A32 D85 S87 T100 L101 R103 L106	Y9-Y89 WeakPolarHBondContact CA-OH 3.26Å; Y9-Y89 WeakPolarHBondContact CB-OH 3.27Å; L10-Y89 HydrophobicContact CB-CD1 4.38Å; L10-Y89 HydrophobicContact CB-CE1 3.72Å; L10-Y89 PolarHBondContact N-OH 2.91Å; L10-Y89 WeakPolarHBondContact O-CE1 3.41Å; I29-Y89 HydrophobicContact CD1-CD1 3.91Å; I29-Y89 HydrophobicContact CD1-CE1 4.41Å; I29-Y89 HydrophobicContact CD1-CG 4.37Å; I29-Y89 HydrophobicContact CG2-CD1 4.05Å; T31-Y89 CarbonylContact O-C 3.43Å; T31-Y89 WeakPolarHBondContact O-CA 3.36Å; A32-Y89 HydrophobicContact CB-CD1 3.65Å; A32-Y89 HydrophobicContact CB-CE1 3.78Å; D85-Y89 PolarHBondContact OD1-OH 3.39Å; D85-Y89 PolarHBondContact OD2-OH 2.83Å; S87-Y89 WeakPolarHBondContact CB-OH 3.45Å; Y89-T100 CarbonylContact O-C 3.53Å; Y89-T100 WeakPolarHBondContact O-CA 3.49Å; Y89-L101 PolarHBondContact N-O 3.03Å; Y89-L101 PolarHBondContact O-N 3.35Å; Y89-R103 HydrophobicContact CE2-CB 3.98Å; Y89-L106 HydrophobicContact CD2-CD1 3.72Å; Y89-L106 HydrophobicContact CG-CD1 3.79Å
90	T	92.3	Very high	89.3	Confident	23 Å²	23	52.3 Å²	52.3	14%	0.141	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	115.5	166.4	-52.6	0	0	0	0	107.7	K30 T31 E98 K99 T100	K30-T90 PolarHBondContact N-O 3.17Å; T31-T90 PolarHBondContact N-O 2.79Å; T31-T90 PolarHBondContact O-N 3.23Å; T31-T90 VanDerWaalsContact OG1-CB 3.24Å; T31-T90 WeakPolarHBondContact OG1-CB 3.48Å; T31-T90 PolarHBondContact OG1-OG1 2.65Å; T90-E98 HydrophobicContact CG2-CB 4.45Å; T90-K99 WeakPolarHBondContact CA-O 3.29Å; T90-T100 PolarHBondContact OG1-OG1 2.98Å
91	V	93.1	Very high	89.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	146.2	176.2	-53.1	0	0	0	0	110.1	V16 A27 K28 I29 F93 E98 K99 L101 L106	V16-V91 HydrophobicContact CG2-CG1 3.91Å; A27-V91 HydrophobicContact CB-CB 3.85Å; A27-V91 HydrophobicContact CB-CG2 3.83Å; K28-V91 CarbonylContact O-C 3.5Å; K28-V91 VanDerWaalsContact O-CA 3.31Å; K28-V91 WeakPolarHBondContact O-CA 3.47Å; I29-V91 HydrophobicContact CG1-CG1 4.09Å; V91-F93 HydrophobicContact CG2-CE2 4.01Å; V91-F93 HydrophobicContact CG2-CZ 4.01Å; V91-E98 WeakPolarHBondContact O-CA 3.41Å; V91-K99 PolarHBondContact N-O 2.78Å; V91-K99 PolarHBondContact O-N 3.49Å; V91-L101 HydrophobicContact CG2-CD1 4.06Å; V91-L106 HydrophobicContact CG1-CD1 4.05Å; V91-L106 HydrophobicContact CG1-CD2 3.88Å
92	V	92.8	Very high	89.1	Confident	43 Å²	43	55.9 Å²	55.9	26%	0.261	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125	169.2	178	0	0	0	0	107.1	A27 K28 K30 E98	A27-V92 CarbonylContact C-O 3.52Å; A27-V92 WeakPolarHBondContact CA-O 3.39Å; A27-V92 WeakPolarHBondContact CB-O 3.33Å; K28-V92 PolarHBondContact N-O 3.45Å; K28-V92 PolarHBondContact O-N 3.45Å; K30-V92 HydrophobicContact CB-CG2 3.7Å; K30-V92 HydrophobicContact CD-CG2 3.58Å; K30-V92 HydrophobicContact CG-CG2 4.11Å; V92-E98 HydrophobicContact CG2-CG 3.76Å
93	F	90.3	Very high	89	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.018	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	162.8	172.1	-67.5	-78.8	0	0	0	111.2	A18 Y20 C25 E26 A27 V91 D95 G96 D97 K99 L101	A18-F93 HydrophobicContact CB-CE1 3.9Å; A18-F93 HydrophobicContact CB-CZ 3.9Å; Y20-F93 HydrophobicContact CD2-CE2 4.48Å; Y20-F93 HydrophobicContact CG-CE2 4.29Å; Y20-F93 HydrophobicContact CG-CZ 4.27Å; C25-F93 HydrophobicContact CB-CD1 3.51Å; C25-F93 HydrophobicContact CB-CE1 3.79Å; E26-F93 WeakPolarHBondContact O-CD1 3.25Å; A27-F93 HydrophobicContact CB-CD1 3.64Å; A27-F93 HydrophobicContact CB-CE1 3.86Å; A27-F93 HydrophobicContact CB-CG 4.22Å; V91-F93 HydrophobicContact CG2-CE2 4.01Å; V91-F93 HydrophobicContact CG2-CZ 4.01Å; F93-D95 WeakPolarHBondContact CB-OD1 3Å; F93-D95 PolarHBondContact O-N 3.34Å; F93-G96 WeakPolarHBondContact O-CA 3.22Å; F93-G96 PolarHBondContact O-N 3.36Å; F93-D97 HydrophobicContact CD2-CB 4.24Å; F93-D97 WeakPolarHBondContact CD2-O 3.38Å; F93-D97 PolarHBondContact N-O 3.47Å; F93-K99 HydrophobicContact CE2-CB 3.78Å; F93-K99 HydrophobicContact CE2-CD 4.27Å; F93-L101 HydrophobicContact CZ-CD1 4.46Å
94	D	82.4	Confident	88.7	Confident	131 Å²	131	55 Å²	55	70%	0.701	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.6	-177.6	-63.5	-32.1	0	0	0	114.2	G96	D94-G96 VanDerWaalsContact C-N 3.27Å
95	D	84.7	Confident	88.5	Confident	101 Å²	101	55.4 Å²	55.4	54%	0.54	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-6.1	172.1	60.9	3.7	0	0	0	113.5	F93 D97	F93-D95 WeakPolarHBondContact CB-OD1 3Å; F93-D95 PolarHBondContact O-N 3.34Å; D95-D97 WeakPolarHBondContact OD1-CB 3.45Å; D95-D97 PolarHBondContact OD1-N 2.97Å
96	G	83	Confident	88.4	Confident	48 Å²	48	54.1 Å²	54.1	50%	0.495	30%	0.295	S	S	.	.	S	Bend	trans	90.1	-1.3	-176.4	0	0	0	0	0	114.8	F93 D94	F93-G96 WeakPolarHBondContact O-CA 3.22Å; F93-G96 PolarHBondContact O-N 3.36Å; D94-G96 VanDerWaalsContact C-N 3.27Å
97	D	86.1	Confident	88.4	Confident	55 Å²	55	56 Å²	56	29%	0.294	31%	0.306	S	S	.	.			trans	-66.8	135.4	175.8	-84.6	-13.4	0	0	0	110.3	Y20 R21 F93 D95	Y20-D97 HydrophobicContact CE1-CB 4.24Å; Y20-D97 WeakPolarHBondContact CE1-OD2 3.4Å; Y20-D97 VanDerWaalsContact CZ-OD2 3.24Å; Y20-D97 PolarHBondContact OH-OD2 3.04Å; R21-D97 IonicContact CZ-OD2 2.67Å; R21-D97 IonicContact NH1-OD2 2.69Å; R21-D97 PolarHBondContact NH1-OD2 2.96Å; R21-D97 IonicContact NH2-OD2 3.69Å; F93-D97 HydrophobicContact CD2-CB 4.24Å; F93-D97 WeakPolarHBondContact CD2-O 3.38Å; F93-D97 PolarHBondContact N-O 3.47Å; D95-D97 WeakPolarHBondContact OD1-CB 3.45Å; D95-D97 PolarHBondContact OD1-N 2.97Å
98	E	91.9	Very high	88.2	Confident	106 Å²	106	58 Å²	58	50%	0.495	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.9	175.8	-71.4	-170.4	-153.8	0	0	111.5	K30 T90 V91 V92	K30-E98 WeakPolarHBondContact CD-OE2 3.23Å; K30-E98 IonicContact NZ-OE1 3.14Å; K30-E98 PolarHBondContact NZ-OE1 3.44Å; K30-E98 IonicContact NZ-OE2 3.51Å; K30-E98 PolarHBondContact NZ-OE2 3.37Å; T90-E98 HydrophobicContact CG2-CB 4.45Å; V91-E98 WeakPolarHBondContact O-CA 3.41Å; V92-E98 HydrophobicContact CG2-CG 3.76Å
99	K	89.8	Confident	87.5	Confident	78 Å²	78	57.9 Å²	57.9	34%	0.339	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	129.3	-179.3	-162.3	173	-176.9	179.9	0	113	Y20 T90 V91 F93 L101	Y20-K99 HydrophobicContact CD2-CD 4.15Å; Y20-K99 HydrophobicContact CE2-CD 4.27Å; T90-K99 WeakPolarHBondContact CA-O 3.29Å; V91-K99 PolarHBondContact N-O 2.78Å; V91-K99 PolarHBondContact O-N 3.49Å; F93-K99 HydrophobicContact CE2-CB 3.78Å; F93-K99 HydrophobicContact CE2-CD 4.27Å; K99-L101 HydrophobicContact CB-CG 4.48Å; K99-L101 HydrophobicContact CD-CD1 4.48Å; K99-L101 HydrophobicContact CD-CD2 3.9Å; K99-L101 HydrophobicContact CD-CG 4.28Å; K99-L101 HydrophobicContact CG-CD2 4Å; K99-L101 HydrophobicContact CG-CG 4.08Å
100	T	92.7	Very high	86.1	Confident	76 Å²	76	61.6 Å²	61.6	47%	0.466	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	118.9	172.1	-46.6	0	0	0	0	110.3	W88 Y89 T90	W88-T100 HydrophobicContact CB-CG2 4.02Å; W88-T100 HydrophobicContact CE3-CG2 4.04Å; Y89-T100 CarbonylContact O-C 3.53Å; Y89-T100 WeakPolarHBondContact O-CA 3.49Å; T90-T100 PolarHBondContact OG1-OG1 2.98Å
101	L	89.9	Confident	84.4	Confident	20 Å²	20	66 Å²	66	11%	0.105	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	158.6	-174.5	-67.3	177.3	0	0	0	110.9	A18 Y89 V91 F93 K99 L106	A18-L101 HydrophobicContact CB-CD1 3.53Å; Y89-L101 PolarHBondContact N-O 3.03Å; Y89-L101 PolarHBondContact O-N 3.35Å; V91-L101 HydrophobicContact CG2-CD1 4.06Å; F93-L101 HydrophobicContact CZ-CD1 4.46Å; K99-L101 HydrophobicContact CB-CG 4.48Å; K99-L101 HydrophobicContact CD-CD1 4.48Å; K99-L101 HydrophobicContact CD-CD2 3.9Å; K99-L101 HydrophobicContact CD-CG 4.28Å; K99-L101 HydrophobicContact CG-CD2 4Å; K99-L101 HydrophobicContact CG-CG 4.08Å; L101-L106 HydrophobicContact CB-CD2 4.06Å; L101-L106 HydrophobicContact CB-CG 4.4Å; L101-L106 HydrophobicContact CD1-CD2 3.71Å
102	R	89.4	Confident	82.2	Confident	128 Å²	128	77.5 Å²	77.5	48%	0.483	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	160.3	172.2	-68.2	-173.1	174.9	-146.4	5.3	110.7	W88 S104 S105	W88-R102 HydrophobicContact CD2-CG 4.07Å; W88-R102 HydrophobicContact CE3-CG 3.82Å; W88-R102 HydrophobicContact CH2-CG 4.14Å; W88-R102 HydrophobicContact CZ2-CG 4.34Å; W88-R102 VanDerWaalsContact CZ2-NE 3.31Å; W88-R102 HydrophobicContact CZ3-CG 3.85Å; R102-S104 PolarHBondContact O-N 3.15Å; R102-S104 VanDerWaalsContact O-N 3.09Å; R102-S105 PolarHBondContact O-N 3Å
103	R	86.8	Confident	80.2	Confident	32 Å²	32	83.6 Å²	83.6	12%	0.121	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-47.1	-41.4	176	-176.1	63.2	-168.8	99.8	-5.9	113.7	E6 D85 Y89 S105 L106	E6-R103 IonicContact OE1-CZ 2.73Å; E6-R103 IonicContact OE1-NE 3.74Å; E6-R103 IonicContact OE1-NH2 3.91Å; E6-R103 PolarHBondContact OE1-NH2 3.04Å; D85-R103 HydrophobicContact CB-CB 4.13Å; D85-R103 HydrophobicContact CB-CG 3.96Å; D85-R103 VanDerWaalsContact OD2-CB 3.28Å; D85-R103 WeakPolarHBondContact OD2-CB 3.43Å; D85-R103 WeakPolarHBondContact OD2-CD 3.42Å; D85-R103 VanDerWaalsContact OD2-CG 3.22Å; D85-R103 WeakPolarHBondContact OD2-CG 3.32Å; Y89-R103 HydrophobicContact CE2-CB 3.98Å; R103-S105 PolarHBondContact O-N 2.88Å; R103-L106 PolarHBondContact NH1-O 2.98Å; R103-L106 PolarHBondContact O-N 2.77Å; R103-L106 VanDerWaalsContact O-N 3.15Å; R103-L106 VanDerWaalsContact O-O 3.12Å
104	S	82.5	Confident	78.2	Confident	110 Å²	110	90.4 Å²	90.4	77%	0.769	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-68.3	-10.1	-179.7	57.4	0	0	0	0	115	R102	R102-S104 PolarHBondContact O-N 3.15Å; R102-S104 VanDerWaalsContact O-N 3.09Å
105	S	85	Confident	76.2	Confident	57 Å²	57	87.6 Å²	87.6	40%	0.399	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-105.4	4.2	175.8	-53.4	0	0	0	0	112.9	R102 R103	R102-S105 PolarHBondContact O-N 3Å; R103-S105 PolarHBondContact O-N 2.88Å
106	L	85.3	Confident	74.3	Confident	5 Å²	5	92 Å²	92	3%	0.026	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	139.8	178.1	-60.7	-174	0	0	0	110.6	L10 V16 S17 A18 I29 Y89 V91 L101 R103	L10-L106 HydrophobicContact CD1-CD1 4.29Å; V16-L106 HydrophobicContact CB-CB 4.48Å; V16-L106 HydrophobicContact CG2-CD1 4.37Å; V16-L106 HydrophobicContact CG2-CD2 4.13Å; S17-L106 WeakPolarHBondContact O-CA 3.33Å; A18-L106 HydrophobicContact CB-CD2 3.77Å; I29-L106 HydrophobicContact CD1-CD1 4.4Å; Y89-L106 HydrophobicContact CD2-CD1 3.72Å; Y89-L106 HydrophobicContact CG-CD1 3.79Å; V91-L106 HydrophobicContact CG1-CD1 4.05Å; V91-L106 HydrophobicContact CG1-CD2 3.88Å; L101-L106 HydrophobicContact CB-CD2 4.06Å; L101-L106 HydrophobicContact CB-CG 4.4Å; L101-L106 HydrophobicContact CD1-CD2 3.71Å; R103-L106 PolarHBondContact NH1-O 2.98Å; R103-L106 PolarHBondContact O-N 2.77Å; R103-L106 VanDerWaalsContact O-N 3.15Å; R103-L106 VanDerWaalsContact O-O 3.12Å
107	C	85.3	Confident	72.4	Confident	57 Å²	57	94.3 Å²	94.3	39%	0.385	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	150.9	168.1	-62.8	0	0	0	0	109.4	V16 S17	V16-C107 CarbonylContact C-O 3.5Å; V16-C107 WeakPolarHBondContact CA-O 3.11Å; V16-C107 WeakPolarHBondContact CB-O 3.3Å; S17-C107 PolarHBondContact N-O 3.21Å; S17-C107 PolarHBondContact O-N 3.32Å
108	L	86.4	Confident	70.6	Confident	42 Å²	42	100.4 Å²	100.4	22%	0.22	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	135.8	175.2	-74.5	171.7	0	0	0	110.2	L10 T14 G110 E111	L10-L108 HydrophobicContact CD1-CD2 4.43Å; L10-L108 HydrophobicContact CD2-CD2 3.83Å; L10-L108 HydrophobicContact CD2-CG 4.47Å; T14-L108 HydrophobicContact CG2-CD2 3.67Å; L108-G110 PolarHBondContact O-N 3.02Å; L108-E111 PolarHBondContact O-N 3.41Å
109	K	75.5	Confident	68.8	Low	100 Å²	100	99.1 Å²	99.1	44%	0.435	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	118.6	177.5	-173.3	173	-176.3	159.3	0	109.9	D15 E26	D15-K109 HydrophobicContact CB-CB 3.75Å; D15-K109 HydrophobicContact CB-CD 3.59Å; D15-K109 HydrophobicContact CB-CG 4.29Å; D15-K109 WeakPolarHBondContact O-CB 3.29Å; D15-K109 PolarHBondContact O-N 3.42Å; D15-K109 VanDerWaalsContact O-N 3.1Å; E26-K109 VanDerWaalsContact CD-CE 3.44Å; E26-K109 WeakPolarHBondContact OE1-CE 3.31Å; E26-K109 IonicContact OE1-NZ 2.69Å; E26-K109 PolarHBondContact OE1-NZ 2.99Å; E26-K109 WeakPolarHBondContact OE2-CE 3.01Å; E26-K109 IonicContact OE2-NZ 3.34Å; E26-K109 PolarHBondContact OE2-NZ 3.28Å
110	G	63.5	Low	66.9	Low	77 Å²	77	102.5 Å²	102.5	79%	0.794	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	105	-5.4	177.2	0	0	0	0	0	116.4	L108	L108-G110 PolarHBondContact O-N 3.02Å
111	E	55.8	Low	65.1	Low	115 Å²	115	106.5 Å²	106.5	54%	0.537	56%	0.56	S	S	.	*	S	Bend	trans	-77	141.1	166.1	-73.8	-166.3	124	0	0	111.3	L108 H113	L108-E111 PolarHBondContact O-N 3.41Å; E111-H113 PolarHBondContact O-N 2.91Å
112	R	47.6	Very low	63.3	Low	242 Å²	242	113.5 Å²	113.5	91%	0.913	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	60.4	-166.9	-68.4	-179.6	-70.4	-174.5	-4.4	114
113	H	50.4	Low	61.5	Low	171 Å²	171	112 Å²	112	79%	0.792	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.9	-3.1	169.2	-73.9	-110.5	0	0	0	112.2	E111	E111-H113 PolarHBondContact O-N 2.91Å
114	F	47.5	Very low	59.7	Low	148 Å²	148	115.5 Å²	115.5	65%	0.649	62%	0.62	S	S	*	*	S	Bend	trans	-86.4	118.8	163	-131.6	-102.2	0	0	0	108.5	F24 E116	F24-F114 HydrophobicContact CB-CE2 4.25Å; F114-E116 PolarHBondContact O-N 3.18Å
115	A	40.4	Very low	58.2	Low	71 Å²	71	117.6 Å²	117.6	59%	0.587	62%	0.622	S	S	*	*			trans	-74.3	115.7	161.7	0	0	0	0	0	107.3	S117	A115-S117 PolarHBondContact O-N 2.95Å
116	E	44.8	Very low	56.4	Low	194 Å²	194	120.5 Å²	120.5	91%	0.907	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	34.7	-178.1	-158.8	-179.8	177.5	0	0	112.3	F114	F114-E116 PolarHBondContact O-N 3.18Å
117	S	44.9	Very low	54.7	Low	96 Å²	96	125.5 Å²	125.5	67%	0.671	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.8	9.2	-167.2	63.3	0	0	0	0	114.8	A115	A115-S117 PolarHBondContact O-N 2.95Å
118	E	47.3	Very low	53.1	Low	183 Å²	183	128.2 Å²	128.2	86%	0.855	68%	0.682	S	S	*	*			trans	-135.6	46.1	175.8	-67	-172	152.8	0	0	111.8
119	T	53.2	Low	51.9	Low	80 Å²	80	135.2 Å²	135.2	49%	0.491	71%	0.713	S	S	.	*			trans	-72	126.7	160.5	48.1	0	0	0	0	109	D121 Q122	T119-D121 PolarHBondContact O-N 3.12Å; T119-Q122 PolarHBondContact O-N 2.86Å; T119-Q122 VanDerWaalsContact O-N 3.16Å
120	L	51	Low	50.7	Low	148 Å²	148	137.8 Å²	137.8	78%	0.775	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-58.1	-21.1	-172.1	-148.8	85.3	0	0	0	113.6	Q122 L123	L120-Q122 VanDerWaalsContact C-N 3.28Å; L120-Q122 PolarHBondContact O-N 3.15Å; L120-L123 HydrophobicContact CD1-CD1 4.49Å; L120-L123 HydrophobicContact CG-CD1 4.22Å
121	D	54.3	Low	50	Low	160 Å²	160	143.5 Å²	143.5	86%	0.856	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-72	-9.7	179.9	-71.8	-28.6	0	0	0	115.1	T119	T119-D121 PolarHBondContact O-N 3.12Å
122	Q	53.5	Low	49.6	Very low	167 Å²	167	141 Å²	141	78%	0.78	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-100.7	13.9	178	-62.8	-167.3	22.3	0	0	114.2	T119 L120	T119-Q122 PolarHBondContact O-N 2.86Å; T119-Q122 VanDerWaalsContact O-N 3.16Å; L120-Q122 VanDerWaalsContact C-N 3.28Å; L120-Q122 PolarHBondContact O-N 3.15Å
123	L	50.4	Low	49.6	Very low	97 Å²	97	135 Å²	135	51%	0.508	73%	0.725	S	S	.	*			trans	-66	133.6	169.1	-74.8	166.2	0	0	0	110.7	L120 L125	L120-L123 HydrophobicContact CD1-CD1 4.49Å; L120-L123 HydrophobicContact CG-CD1 4.22Å; L123-L125 PolarHBondContact O-N 3.38Å
124	P	48.8	Very low	49.5	Very low	105 Å²	105	132.6 Å²	132.6	68%	0.682	73%	0.725	S	S	*	*	S	Bend	trans	-77.6	41	179.3	34.9	-37.5	0	0	0	112.4
125	L	50.7	Low	49	Very low	155 Å²	155	132 Å²	132	81%	0.812	73%	0.733	S	S	*	*			trans	-97	3.9	-178.7	-114.4	76.2	0	0	0	113.9	L123	L123-L125 PolarHBondContact O-N 3.38Å
126	T	48.7	Very low	49.1	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.724	75%	0.745	S	S	*	*	S	Bend	trans	-107.4	-7.6	-178.6	50.6	0	0	0	0	114.7
127	N	48.1	Very low	48.8	Very low	110 Å²	110	130.2 Å²	130.2	59%	0.588	73%	0.733	S	S	*	*			trans	-131.1	104.7	-177.8	-82.1	-34.4	0	0	0	112.7	E129	N127-E129 VanDerWaalsContact C-N 3.26Å; N127-E129 PolarHBondContact O-N 2.84Å
128	P	53.2	Low	48.5	Very low	114 Å²	114	135.9 Å²	135.9	74%	0.74	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-63.1	-18.9	-179.3	-26.2	35.9	0	0	0	116.5	H130	P128-H130 PolarHBondContact O-N 2.85Å
129	E	59.6	Low	48.5	Very low	188 Å²	188	136.8 Å²	136.8	88%	0.879	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-78.9	-8.8	-170.2	-64.3	-155.8	130.9	0	0	115.5	N127 F131	N127-E129 VanDerWaalsContact C-N 3.26Å; N127-E129 PolarHBondContact O-N 2.84Å; E129-F131 PolarHBondContact O-N 3.16Å
130	H	50.2	Low	47.8	Very low	154 Å²	154	139.8 Å²	139.8	71%	0.713	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-87.8	5.1	-174.8	-90.5	-69.3	0	0	0	116.2	P128 G132	P128-H130 PolarHBondContact O-N 2.85Å; H130-G132 PolarHBondContact O-N 2.86Å
131	F	48.8	Very low	47.4	Very low	197 Å²	197	140.3 Å²	140.3	86%	0.864	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-75.6	2.1	176.5	-90.3	-90.4	0	0	0	115.1	E129	E129-F131 PolarHBondContact O-N 3.16Å
132	G	48.7	Very low	46.8	Very low	63 Å²	63	144.7 Å²	144.7	65%	0.649	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-91.5	-6.2	-162.5	0	0	0	0	0	119.2	H130	H130-G132 PolarHBondContact O-N 2.86Å
133	T	46.7	Very low	45.9	Very low	115 Å²	115	140.4 Å²	140.4	71%	0.706	77%	0.774	S	S	*	*			trans	-132.8	104	-168.4	15.2	0	0	0	0	114.5
134	P	48	Very low	45.5	Very low	121 Å²	121	146.3 Å²	146.3	79%	0.786	79%	0.789	S	S	*	*			trans	-80.4	121.1	171.9	31.5	-31.4	0	0	0	110.7
135	V	38.6	Very low	45.2	Very low	136 Å²	136	152.1 Å²	152.1	82%	0.824	80%	0.798	S	S	*	*			trans	-107.1	102.8	179	-165.2	0	0	0	0	110.7
136	I	40.6	Very low	44.5	Very low	165 Å²	165	150.3 Å²	150.3	85%	0.846	80%	0.798	S	S	*	*			trans	-77.2	130.3	178	-116.5	71.6	0	0	0	111.4
137	G	40.2	Very low	43.8	Very low	63 Å²	63	152.6 Å²	152.6	65%	0.649	81%	0.805	S	S	*	*			trans	80.2	136.5	163.4	0	0	0	0	0	116.2
138	K	38.4	Very low	42.9	Very low	215 Å²	215	155.3 Å²	155.3	94%	0.935	81%	0.814	S	S	*	*			cis	-163.2	161.3	44.7	-101.4	170.5	173.8	168.6	0	112.8
139	K	47.7	Very low	42.2	Very low	202 Å²	202	156.7 Å²	156.7	88%	0.878	81%	0.814	S	S	*	*			trans	-60.5	141.2	174.8	-58	172	174.3	177.1	0	113.6
140	T	37.2	Very low	41.1	Very low	143 Å²	143	152.2 Å²	152.2	88%	0.877	80%	0.801	S	S	*	*			trans	-138.3	145.6	135.4	59	0	0	0	0	110.9
141	N	43.8	Very low	40.4	Very low	159 Å²	159	153.4 Å²	153.4	85%	0.85	81%	0.807	S	S	*	*			trans	-81.8	138.2	178.5	-85.9	-16.8	0	0	0	111.5
142	R	40.5	Very low	39.7	Very low	252 Å²	252	152.1 Å²	152.1	95%	0.951	80%	0.804	S	S	*	*			trans	-170.6	96.6	136.6	-105.1	161.1	-170	178.1	4	113.7
143	G	36	Very low	38.9	Very low	76 Å²	76	156.9 Å²	156.9	78%	0.784	81%	0.809	S	S	*	*			trans	39.1	123.6	139.9	0	0	0	0	0	123.8
144	R	40.8	Very low	38.7	Very low	222 Å²	222	157 Å²	157	84%	0.838	82%	0.815	S	S	*	*				96.6	106.8	120.7	-153.6	-177.2	-158.2	-161.1	6.3	119.2
145	R	42.8	Very low	37.9	Very low	227 Å²	227	156.1 Å²	156.1	86%	0.857	81%	0.812	S	S	*	*			trans	59.2	110.6	147.2	-72.6	-179	165.8	177.2	-7.1	119.7
146	S	35.9	Very low	38.2	Very low	117 Å²	117	155.8 Å²	155.8	82%	0.818	82%	0.815	S	S	*	*				-143.6	153.8	123.1	62.1	0	0	0	0	109.7
147	N	33.8	Very low	38.1	Very low	165 Å²	165	152.8 Å²	152.8	88%	0.882	81%	0.809	S	S	*	*			trans	-79	133.9	171.3	-78.1	13.2	0	0	0	109.1
148	H	29.8	Very low	38	Very low	168 Å²	168	153.8 Å²	153.8	78%	0.778	81%	0.806	S	S	*	*			trans	-106.1	132.4	160.9	-165.2	-66.9	0	0	0	107.7	P150	H148-P150 WeakPolarHBondContact O-CD 3.25Å
149	I	37.8	Very low	38.1	Very low	143 Å²	143	146.5 Å²	146.5	73%	0.733	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-85.5	116.8	170.1	-63.9	163.8	0	0	0	105.7
150	P	37.9	Very low	38.2	Very low	94 Å²	94	143.1 Å²	143.1	61%	0.61	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-70.4	134.1	169.4	-9.6	26.6	0	0	0	108.8	H148	H148-P150 WeakPolarHBondContact O-CD 3.25Å
151	E	34.7	Very low	38.8	Very low	179 Å²	179	143.8 Å²	143.8	84%	0.836	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-81.6	128	160.6	-65.6	-170.1	148.4	0	0	107.4	E153	E151-E153 VanDerWaalsContact C-N 3.27Å; E151-E153 PolarHBondContact O-N 3.46Å
152	E	33.6	Very low	39.3	Very low	169 Å²	169	139.6 Å²	139.6	79%	0.79	74%	0.744	S	S	*	*			trans	-75.1	75.6	-178.5	-70.5	-73.3	151.6	0	0	110.7	S154	E152-S154 PolarHBondContact O-N 2.7Å
153	E	32.5	Very low	40	Very low	164 Å²	164	132.4 Å²	132.4	77%	0.766	72%	0.721	S	S	*	*			trans	-66.6	107.5	160.6	-81.6	-69.1	164.5	0	0	108.7	E151 S155	E151-E153 VanDerWaalsContact C-N 3.27Å; E151-E153 PolarHBondContact O-N 3.46Å; E153-S155 PolarHBondContact O-N 3.04Å; E153-S155 PolarHBondContact O-OG 2.85Å
154	S	41.7	Very low	41	Very low	117 Å²	117	133.5 Å²	133.5	82%	0.818	71%	0.709	S	S	*	*			trans	-61.3	92.6	-176.3	-70	0	0	0	0	111.7	E152	E152-S154 PolarHBondContact O-N 2.7Å
155	S	32.3	Very low	41.7	Very low	103 Å²	103	125.6 Å²	125.6	72%	0.72	68%	0.684	S	S	*	*			trans	-111.9	93.2	173.5	41.1	0	0	0	0	108.8	E153 S157	E153-S155 PolarHBondContact O-N 3.04Å; E153-S155 PolarHBondContact O-OG 2.85Å; S155-S157 PolarHBondContact O-N 2.8Å
156	S	43.3	Very low	42.6	Very low	129 Å²	129	124 Å²	124	90%	0.902	68%	0.678	S	S	*	*			trans	-65.1	80.9	175.2	-58.7	0	0	0	0	111.4
157	S	38.9	Very low	43.7	Very low	101 Å²	101	123.8 Å²	123.8	71%	0.706	66%	0.662	S	S	*	*			trans	-97.5	71.1	162.8	-176.7	0	0	0	0	108.7	S155 S159	S155-S157 PolarHBondContact O-N 2.8Å; S157-S159 PolarHBondContact O-N 2.73Å
158	S	39.3	Very low	44.9	Very low	84 Å²	84	119.7 Å²	119.7	59%	0.587	64%	0.637	S	S	*	*			trans	-58	108.3	176.5	-171.6	0	0	0	0	110.1
159	S	40.5	Very low	46.5	Very low	62 Å²	62	113.6 Å²	113.6	43%	0.434	61%	0.61	S	S	.	*			trans	-96.9	119.1	161.4	-55.7	0	0	0	0	105.9	S157 E161 D162	S157-S159 PolarHBondContact O-N 2.73Å; S159-E161 PolarHBondContact O-N 2.95Å; S159-D162 PolarHBondContact O-N 2.85Å
160	D	48.3	Very low	48.1	Very low	132 Å²	132	112.2 Å²	112.2	71%	0.706	60%	0.604	S	S	*	*	H	α-helix	trans	-58.6	-23	-168.4	-60.4	-66.5	0	0	0	113.7	E163 D164	D160-E163 PolarHBondContact O-N 2.99Å; D160-D164 PolarHBondContact O-N 2.91Å
161	E	51.5	Low	50.2	Low	156 Å²	156	113.4 Å²	113.4	73%	0.729	60%	0.602	S	S	*	*	H	α-helix	trans	-65.9	-33.6	174.4	-58.8	-173.1	172.7	0	0	113.5	S159 E163 D164 D165	S159-E161 PolarHBondContact O-N 2.95Å; E161-E163 VanDerWaalsContact C-N 3.34Å; E161-D164 PolarHBondContact O-N 2.75Å; E161-D165 PolarHBondContact O-N 2.89Å
162	D	53.8	Low	52.6	Low	72 Å²	72	105.9 Å²	105.9	39%	0.385	57%	0.567	S	S	.	*	H	α-helix	trans	-74	-24.9	-179.8	-72.4	-54.5	0	0	0	112.8	S159 R166 K209	S159-D162 PolarHBondContact O-N 2.85Å; D162-R166 VanDerWaalsContact O-CG 3.29Å; D162-R166 WeakPolarHBondContact O-CG 3.19Å; D162-R166 PolarHBondContact O-N 2.77Å; D162-K209 WeakPolarHBondContact OD1-CE 3.3Å; D162-K209 IonicContact OD1-NZ 2.65Å; D162-K209 PolarHBondContact OD1-NZ 3.5Å
163	E	55.5	Low	55.2	Low	100 Å²	100	99.6 Å²	99.6	47%	0.467	54%	0.539	S	S	.	.	H	α-helix	trans	-73.4	-41.7	172.1	-81.7	-129.5	139.9	0	0	111.7	D160 E161 R166 K167	D160-E163 PolarHBondContact O-N 2.99Å; E161-E163 VanDerWaalsContact C-N 3.34Å; E163-R166 PolarHBondContact O-N 2.78Å; E163-K167 WeakPolarHBondContact O-CB 3.1Å; E163-K167 WeakPolarHBondContact O-CD 3.44Å; E163-K167 WeakPolarHBondContact O-CG 3.49Å; E163-K167 PolarHBondContact O-N 2.69Å; E163-K167 WeakPolarHBondContact OE2-CE 3.33Å; E163-K167 IonicContact OE2-NZ 3.13Å; E163-K167 PolarHBondContact OE2-NZ 2.84Å
164	D	57.3	Low	57.8	Low	99 Å²	99	91.9 Å²	91.9	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-69.6	-41.4	-175	-141.1	9.6	0	0	0	111.3	D160 E161 R166 K167 Q168	D160-D164 PolarHBondContact O-N 2.91Å; E161-D164 PolarHBondContact O-N 2.75Å; D164-R166 PolarHBondContact O-N 2.71Å; D164-K167 PolarHBondContact O-N 3.46Å; D164-Q168 VanDerWaalsContact O-CB 3.31Å; D164-Q168 WeakPolarHBondContact O-CB 3.5Å; D164-Q168 PolarHBondContact O-N 3.32Å
165	D	55.4	Low	60.1	Low	56 Å²	56	88.6 Å²	88.6	30%	0.299	47%	0.474	S	S	.	.	H	α-helix	trans	-60.5	-43.2	172.1	-79.8	-30.9	0	0	0	112.1	E161 Q168 I169 K209	E161-D165 PolarHBondContact O-N 2.89Å; D165-Q168 PolarHBondContact O-N 3.47Å; D165-I169 WeakPolarHBondContact O-CG1 3.37Å; D165-I169 PolarHBondContact O-N 3.09Å; D165-K209 WeakPolarHBondContact OD2-CE 3.42Å; D165-K209 IonicContact OD2-NZ 2.65Å; D165-K209 PolarHBondContact OD2-NZ 2.77Å
166	R	59.9	Low	63	Low	195 Å²	195	83.8 Å²	83.8	74%	0.736	44%	0.441	S	S	*	.	H	α-helix	trans	-65.1	-46.3	177.9	-77.9	-179.8	-175.5	-132	4.9	111.9	D162 E163 D164 Q168 I169 D170	D162-R166 VanDerWaalsContact O-CG 3.29Å; D162-R166 WeakPolarHBondContact O-CG 3.19Å; D162-R166 PolarHBondContact O-N 2.77Å; E163-R166 PolarHBondContact O-N 2.78Å; D164-R166 PolarHBondContact O-N 2.71Å; R166-Q168 PolarHBondContact O-N 3.34Å; R166-I169 PolarHBondContact O-N 3.39Å; R166-I169 VanDerWaalsContact O-N 3.15Å; R166-D170 WeakPolarHBondContact O-CB 3.29Å; R166-D170 PolarHBondContact O-N 2.88Å
167	K	59.8	Low	65.3	Low	112 Å²	112	77.7 Å²	77.7	49%	0.487	40%	0.398	S	S	.	.	H	α-helix	trans	-58.5	-38.1	175.5	-70.9	161.7	-168.8	168.2	0	111.5	E163 D164 D170 E171	E163-K167 WeakPolarHBondContact O-CB 3.1Å; E163-K167 WeakPolarHBondContact O-CD 3.44Å; E163-K167 WeakPolarHBondContact O-CG 3.49Å; E163-K167 PolarHBondContact O-N 2.69Å; E163-K167 WeakPolarHBondContact OE2-CE 3.33Å; E163-K167 IonicContact OE2-NZ 3.13Å; E163-K167 PolarHBondContact OE2-NZ 2.84Å; D164-K167 PolarHBondContact O-N 3.46Å; K167-D170 PolarHBondContact O-N 3.04Å; K167-E171 PolarHBondContact O-N 3.02Å
168	Q	58.9	Low	67.8	Low	78 Å²	78	73.2 Å²	73.2	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-70.3	-33.2	176.3	-94.3	-163.8	49.1	0	0	114.4	D164 D165 R166 R227	D164-Q168 VanDerWaalsContact O-CB 3.31Å; D164-Q168 WeakPolarHBondContact O-CB 3.5Å; D164-Q168 PolarHBondContact O-N 3.32Å; D165-Q168 PolarHBondContact O-N 3.47Å; R166-Q168 PolarHBondContact O-N 3.34Å; Q168-R227 VanDerWaalsContact C-NH1 3.29Å; Q168-R227 PolarHBondContact O-NH1 3.45Å; Q168-R227 PolarHBondContact O-NH2 3.39Å; Q168-R227 VanDerWaalsContact OE1-NE 3.09Å; Q168-R227 VanDerWaalsContact OE1-NH2 3.09Å
169	I	63.7	Low	70.4	Confident	41 Å²	41	69.4 Å²	69.4	21%	0.21	34%	0.34	C	S	.	.	H	α-helix	trans	-68.2	-46.7	172.1	-68.4	166.5	0	0	0	109.6	D165 R166 E171 L172 L173 I212	D165-I169 WeakPolarHBondContact O-CG1 3.37Å; D165-I169 PolarHBondContact O-N 3.09Å; R166-I169 PolarHBondContact O-N 3.39Å; R166-I169 VanDerWaalsContact O-N 3.15Å; I169-E171 VanDerWaalsContact C-N 3.32Å; I169-E171 PolarHBondContact O-N 2.59Å; I169-L172 PolarHBondContact O-N 2.86Å; I169-L173 PolarHBondContact O-N 3.43Å; I169-I212 HydrophobicContact CG1-CG2 4.02Å; I169-I212 HydrophobicContact CG2-CG2 4.38Å
170	D	70.3	Confident	72.7	Confident	113 Å²	113	69.3 Å²	69.3	60%	0.604	33%	0.334	S	S	*	.	H	α-helix	trans	-55.2	-44.1	178	-163.3	33.3	0	0	0	111.8	R166 K167 L172 L173	R166-D170 WeakPolarHBondContact O-CB 3.29Å; R166-D170 PolarHBondContact O-N 2.88Å; K167-D170 PolarHBondContact O-N 3.04Å; D170-L172 PolarHBondContact O-N 3.44Å; D170-L172 VanDerWaalsContact O-N 3.14Å; D170-L173 WeakPolarHBondContact O-CB 3.46Å; D170-L173 PolarHBondContact O-N 3.2Å; D170-L173 VanDerWaalsContact O-N 3.12Å
171	E	82.8	Confident	74.5	Confident	120 Å²	120	67.4 Å²	67.4	56%	0.561	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.9	177.2	-155.7	-143.5	134.5	0	0	114.6	K167 I169 K175	K167-E171 PolarHBondContact O-N 3.02Å; I169-E171 VanDerWaalsContact C-N 3.32Å; I169-E171 PolarHBondContact O-N 2.59Å; E171-K175 WeakPolarHBondContact O-CD 3.46Å; E171-K175 WeakPolarHBondContact O-CE 3.37Å; E171-K175 PolarHBondContact O-NZ 3.14Å; E171-K175 IonicContact OE1-NZ 3.35Å; E171-K175 PolarHBondContact OE1-NZ 3.31Å; E171-K175 VanDerWaalsContact OE1-NZ 3.13Å
172	L	85.9	Confident	75.8	Confident	20 Å²	20	66.2 Å²	66.2	11%	0.105	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-12.8	177.8	-68.8	-171.4	0	0	0	113.9	I169 D170 G174 K175 V196 I212	I169-L172 PolarHBondContact O-N 2.86Å; D170-L172 PolarHBondContact O-N 3.44Å; D170-L172 VanDerWaalsContact O-N 3.14Å; L172-G174 PolarHBondContact O-N 2.92Å; L172-K175 HydrophobicContact CD2-CD 4Å; L172-K175 WeakPolarHBondContact O-CB 3.5Å; L172-K175 PolarHBondContact O-N 3.31Å; L172-V196 HydrophobicContact CB-CG1 4.29Å; L172-V196 HydrophobicContact CB-CG2 4.35Å; L172-V196 VanDerWaalsContact O-CB 3.26Å; L172-V196 WeakPolarHBondContact O-CB 3.29Å; L172-I212 HydrophobicContact CD1-CD1 4.4Å
173	L	88.1	Confident	76.9	Confident	37 Å²	37	63.7 Å²	63.7	19%	0.194	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	136.8	179.4	-63.7	-178.5	0	0	0	110.8	I169 D170 K175 V196 S399	I169-L173 PolarHBondContact O-N 3.43Å; D170-L173 WeakPolarHBondContact O-CB 3.46Å; D170-L173 PolarHBondContact O-N 3.2Å; D170-L173 VanDerWaalsContact O-N 3.12Å; L173-K175 PolarHBondContact O-N 3.36Å; L173-K175 VanDerWaalsContact O-N 3.09Å; L173-V196 HydrophobicContact CD2-CG1 4.23Å; L173-S399 CarbonylContact C-O 3.49Å
174	G	87.4	Confident	77.4	Confident	2 Å²	2	66.9 Å²	66.9	2%	0.021	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	1.5	177.3	0	0	0	0	0	114.9	L172 V196 R259 S399	L172-G174 PolarHBondContact O-N 2.92Å; G174-V196 PolarHBondContact N-O 2.8Å; G174-V196 VanDerWaalsContact N-O 3.11Å; G174-R259 PolarHBondContact O-NH1 3.28Å; G174-S399 WeakPolarHBondContact CA-O 3Å; G174-S399 PolarHBondContact N-O 3.1Å
175	K	90.1	Very high	77.9	Confident	48 Å²	48	69.4 Å²	69.4	21%	0.209	34%	0.336	C	S	.	.			trans	-88.2	148.1	173.6	-61.9	-172.2	173.1	175.2	0	112.1	E171 L172 L173 V196 E232	E171-K175 WeakPolarHBondContact O-CD 3.46Å; E171-K175 WeakPolarHBondContact O-CE 3.37Å; E171-K175 PolarHBondContact O-NZ 3.14Å; E171-K175 IonicContact OE1-NZ 3.35Å; E171-K175 PolarHBondContact OE1-NZ 3.31Å; E171-K175 VanDerWaalsContact OE1-NZ 3.13Å; L172-K175 HydrophobicContact CD2-CD 4Å; L172-K175 WeakPolarHBondContact O-CB 3.5Å; L172-K175 PolarHBondContact O-N 3.31Å; L173-K175 PolarHBondContact O-N 3.36Å; L173-K175 VanDerWaalsContact O-N 3.09Å; K175-V196 PolarHBondContact O-N 3.18Å; K175-V196 VanDerWaalsContact O-N 3.13Å; K175-E232 HydrophobicContact CD-CG 4.33Å; K175-E232 WeakPolarHBondContact CD-OE2 3.32Å; K175-E232 WeakPolarHBondContact CE-OE2 3.5Å; K175-E232 IonicContact NZ-OE1 2.89Å; K175-E232 IonicContact NZ-OE2 2.82Å; K175-E232 PolarHBondContact NZ-OE2 2.86Å
176	V	91.3	Very high	78.3	Confident	3 Å²	3	74.7 Å²	74.7	2%	0.018	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.4	176.8	172.4	0	0	0	0	109	L195 F217 I233 A252 F255 H256	V176-L195 HydrophobicContact CG2-CD1 4.36Å; V176-F217 HydrophobicContact CG1-CE2 4.11Å; V176-F217 HydrophobicContact CG2-CE2 4.11Å; V176-F217 HydrophobicContact CG2-CZ 4.08Å; V176-I233 HydrophobicContact CG1-CB 4.34Å; V176-I233 HydrophobicContact CG1-CD1 4.01Å; V176-I233 PolarHBondContact O-N 2.72Å; V176-A252 HydrophobicContact CG1-CB 3.81Å; V176-F255 HydrophobicContact CG2-CD1 3.7Å; V176-F255 HydrophobicContact CG2-CE1 4.36Å; V176-H256 HydrophobicContact CB-CB 4.42Å; V176-H256 HydrophobicContact CG2-CB 4.15Å
177	V	92.4	Very high	78.5	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	150.4	-167.7	-63.1	0	0	0	0	112.7	V179 P193 A194 V196 V214 V230 H231	V177-V179 HydrophobicContact CG2-CG2 4.21Å; V177-P193 CarbonylContact O-C 2.99Å; V177-P193 WeakPolarHBondContact O-CA 3.45Å; V177-A194 HydrophobicContact CG2-CB 4.26Å; V177-A194 WeakPolarHBondContact CG2-O 3.45Å; V177-A194 PolarHBondContact N-O 3.15Å; V177-A194 PolarHBondContact O-N 2.89Å; V177-V196 HydrophobicContact CB-CG2 4.33Å; V177-V196 HydrophobicContact CG1-CG2 3.63Å; V177-V196 HydrophobicContact CG2-CG2 3.67Å; V177-V214 HydrophobicContact CG2-CG1 4.5Å; V177-V230 HydrophobicContact CB-CG1 3.5Å; V177-V230 HydrophobicContact CG1-CG1 3.77Å; V177-V230 HydrophobicContact CG2-CG1 3.57Å; V177-H231 CarbonylContact C-O 3.5Å; V177-H231 WeakPolarHBondContact CA-O 3.11Å; V177-H231 WeakPolarHBondContact CB-O 3.32Å
178	C	92.1	Very high	79	Confident	8 Å²	8	74.1 Å²	74.1	5%	0.054	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.1	162.1	-83.9	0	0	0	0	108.4	W191 V230 H231 I233 P239	C178-W191 HydrophobicContact CB-CE3 4.39Å; C178-W191 VanDerWaalsContact SG-CZ3 3.54Å; C178-V230 WeakPolarHBondContact O-CA 3.35Å; C178-H231 PolarHBondContact N-O 3.42Å; C178-H231 PolarHBondContact O-N 2.92Å; C178-I233 HydrophobicContact CB-CD1 4.4Å; C178-I233 HydrophobicContact CB-CG1 4.19Å; C178-I233 WeakPolarHBondContact SG-CD1 3.42Å; C178-I233 VanDerWaalsContact SG-CG1 3.52Å; C178-P239 VanDerWaalsContact SG-CG 3.6Å
179	V	92.6	Very high	79.6	Confident	3 Å²	3	73.9 Å²	73.9	2%	0.018	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119	171.4	-175.3	0	0	0	0	109.3	V177 W191 F192 A194 V214 V225 D229 V230	V177-V179 HydrophobicContact CG2-CG2 4.21Å; V179-W191 CarbonylContact O-C 3.54Å; V179-W191 WeakPolarHBondContact O-CA 3.31Å; V179-F192 HydrophobicContact CB-CD1 4.2Å; V179-F192 HydrophobicContact CB-CE1 3.75Å; V179-F192 HydrophobicContact CB-CE2 4.08Å; V179-F192 HydrophobicContact CB-CZ 3.68Å; V179-F192 HydrophobicContact CG1-CE1 3.78Å; V179-F192 HydrophobicContact CG1-CZ 3.77Å; V179-F192 HydrophobicContact CG2-CE2 4.16Å; V179-F192 HydrophobicContact CG2-CZ 4.12Å; V179-F192 PolarHBondContact N-O 3.31Å; V179-F192 PolarHBondContact O-N 3.49Å; V179-A194 HydrophobicContact CG2-CB 3.96Å; V179-V214 HydrophobicContact CG2-CG2 4.29Å; V179-V225 HydrophobicContact CG1-CB 3.98Å; V179-V225 HydrophobicContact CG1-CG1 3.94Å; V179-V225 HydrophobicContact CG1-CG2 4.1Å; V179-V225 HydrophobicContact CG2-CG2 4.4Å; V179-D229 WeakPolarHBondContact CA-O 3.29Å; V179-V230 HydrophobicContact CG1-CG2 4.39Å; V179-V230 HydrophobicContact CG2-CG1 4.5Å; V179-V230 HydrophobicContact CG2-CG2 4.18Å
180	D	90.3	Very high	80.7	Confident	60 Å²	60	73.9 Å²	73.9	32%	0.321	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	142.7	175	-73.3	-58.1	0	0	0	111.5	L190 D229 H231	D180-L190 CarbonylContact C-O 3.56Å; D180-D229 PolarHBondContact N-O 3.2Å; D180-H231 IonicContact OD2-CE1 2.76Å; D180-H231 PolarHBondContact OD2-CE1 2.91Å; D180-H231 IonicContact OD2-ND1 2.63Å; D180-H231 PolarHBondContact OD2-ND1 3.02Å; D180-H231 VanDerWaalsContact OD2-ND1 3.11Å
181	Y	86.1	Confident	81.6	Confident	92 Å²	92	70.2 Å²	70.2	36%	0.361	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	152.2	173.1	76.8	-77.8	0	0	0	112.3	L190 F192	Y181-L190 HydrophobicContact CD1-CB 3.99Å; Y181-L190 WeakPolarHBondContact CD1-O 3.08Å; Y181-L190 HydrophobicContact CE1-CB 3.46Å; Y181-L190 VanDerWaalsContact CE1-CB 3.46Å; Y181-L190 HydrophobicContact CE2-CB 4.19Å; Y181-L190 HydrophobicContact CE2-CD1 4.16Å; Y181-L190 PolarHBondContact N-O 3.43Å; Y181-L190 PolarHBondContact O-N 2.93Å; Y181-L190 WeakPolarHBondContact OH-CD1 3.22Å; Y181-F192 AromaticContact CD1-CD1 3.79Å; Y181-F192 HydrophobicContact CD1-CD1 3.79Å; Y181-F192 HydrophobicContact CD1-CE1 4.03Å; Y181-F192 AromaticContact CE1-CD1 3.84Å; Y181-F192 HydrophobicContact CE1-CD1 3.84Å; Y181-F192 HydrophobicContact CE1-CE1 4.42Å
182	I	79.1	Confident	82	Confident	131 Å²	131	65.8 Å²	65.8	67%	0.672	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.3	-179.6	-57.6	174.7	0	0	0	109.4	L184	I182-L184 PolarHBondContact O-N 3.25Å
183	S	75	Confident	82.4	Confident	20 Å²	20	64.8 Å²	64.8	14%	0.14	32%	0.322	C	S	.	.			trans	-70.5	119.4	171.9	175.8	0	0	0	0	110.9	D185 K186 K187 K188	S183-D185 VanDerWaalsContact C-N 3.25Å; S183-D185 PolarHBondContact O-N 3.44Å; S183-K186 PolarHBondContact O-N 2.99Å; S183-K187 PolarHBondContact O-N 3.24Å; S183-K188 PolarHBondContact N-O 3.13Å
184	L	66.9	Low	82.7	Confident	166 Å²	166	63 Å²	63	87%	0.869	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-41.6	177	-93.1	73.2	0	0	0	112.4	I182	I182-L184 PolarHBondContact O-N 3.25Å
185	D	67	Low	82.9	Confident	152 Å²	152	63 Å²	63	81%	0.813	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-26.2	-171.7	-55.1	-54.2	0	0	0	114	S183	S183-D185 VanDerWaalsContact C-N 3.25Å; S183-D185 PolarHBondContact O-N 3.44Å
186	K	63.7	Low	83.1	Confident	168 Å²	168	60.7 Å²	60.7	73%	0.73	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	-11.1	-167.4	-65.8	-173	-179	179.6	0	115.2	S183 K188	S183-K186 PolarHBondContact O-N 2.99Å; K186-K188 HydrophobicContact CB-CB 4.34Å; K186-K188 PolarHBondContact O-N 3.38Å
187	K	64.4	Low	83.1	Confident	192 Å²	192	60.6 Å²	60.6	84%	0.835	30%	0.302	S	S	*	.			trans	49.7	17.8	-169.6	-63.1	-175.1	177	-178.4	0	114.2	S183	S183-K187 PolarHBondContact O-N 3.24Å
188	K	70.3	Confident	82.8	Confident	102 Å²	102	61.3 Å²	61.3	44%	0.443	31%	0.307	S	S	.	.			trans	-83.8	129.7	172.4	-166.2	-170.3	168.5	-169.1	0	106.8	S183 K186 L190 D242	S183-K188 PolarHBondContact N-O 3.13Å; K186-K188 HydrophobicContact CB-CB 4.34Å; K186-K188 PolarHBondContact O-N 3.38Å; K188-L190 HydrophobicContact CD-CD2 3.81Å; K188-L190 HydrophobicContact CG-CD2 4.27Å; K188-L190 PolarHBondContact O-N 3.43Å; K188-D242 IonicContact NZ-OD1 3.39Å; K188-D242 IonicContact NZ-OD2 2.75Å; K188-D242 PolarHBondContact NZ-OD2 3.39Å
189	A	72.3	Confident	82.5	Confident	73 Å²	73	63.2 Å²	63.2	60%	0.603	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.9	122.1	161.9	0	0	0	0	0	107.8
190	L	85.9	Confident	82	Confident	42 Å²	42	67.7 Å²	67.7	22%	0.22	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	155.2	173.6	-65.8	-179	0	0	0	107.5	D180 Y181 K188	D180-L190 CarbonylContact C-O 3.56Å; Y181-L190 HydrophobicContact CD1-CB 3.99Å; Y181-L190 WeakPolarHBondContact CD1-O 3.08Å; Y181-L190 HydrophobicContact CE1-CB 3.46Å; Y181-L190 VanDerWaalsContact CE1-CB 3.46Å; Y181-L190 HydrophobicContact CE2-CB 4.19Å; Y181-L190 HydrophobicContact CE2-CD1 4.16Å; Y181-L190 PolarHBondContact N-O 3.43Å; Y181-L190 PolarHBondContact O-N 2.93Å; Y181-L190 WeakPolarHBondContact OH-CD1 3.22Å; K188-L190 HydrophobicContact CD-CD2 3.81Å; K188-L190 HydrophobicContact CG-CD2 4.27Å; K188-L190 PolarHBondContact O-N 3.43Å
191	W	90.3	Very high	81.5	Confident	35 Å²	35	64.9 Å²	64.9	13%	0.133	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	164.1	175.4	63	-90.5	0	0	0	110.2	C178 V179 P239 P241 L245 F249	C178-W191 HydrophobicContact CB-CE3 4.39Å; C178-W191 VanDerWaalsContact SG-CZ3 3.54Å; V179-W191 CarbonylContact O-C 3.54Å; V179-W191 WeakPolarHBondContact O-CA 3.31Å; W191-P239 HydrophobicContact CD2-CG 4.02Å; W191-P239 HydrophobicContact CE3-CG 4.28Å; W191-P239 HydrophobicContact CH2-CG 3.9Å; W191-P239 HydrophobicContact CZ2-CB 3.85Å; W191-P239 HydrophobicContact CZ2-CG 3.61Å; W191-P239 VanDerWaalsContact CZ2-O 3.31Å; W191-P239 WeakPolarHBondContact CZ2-O 3.47Å; W191-P239 HydrophobicContact CZ3-CG 4.22Å; W191-P241 HydrophobicContact CH2-CB 4.09Å; W191-P241 HydrophobicContact CZ2-CB 4.11Å; W191-L245 HydrophobicContact CD2-CD1 4.49Å; W191-L245 WeakPolarHBondContact O-CD1 3.41Å; W191-F249 AromaticContact CH2-CD2 3.69Å; W191-F249 HydrophobicContact CH2-CD2 3.69Å; W191-F249 HydrophobicContact CH2-CE2 4.2Å; W191-F249 HydrophobicContact CH2-CG 4.26Å; W191-F249 AromaticContact CZ3-CD2 3.93Å; W191-F249 HydrophobicContact CZ3-CD2 3.93Å
192	F	91.8	Very high	81.2	Confident	27 Å²	27	60.8 Å²	60.8	12%	0.118	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	147.1	168.6	61.7	-82.4	0	0	0	110.9	V179 Y181 A194 L245	V179-F192 HydrophobicContact CB-CD1 4.2Å; V179-F192 HydrophobicContact CB-CE1 3.75Å; V179-F192 HydrophobicContact CB-CE2 4.08Å; V179-F192 HydrophobicContact CB-CZ 3.68Å; V179-F192 HydrophobicContact CG1-CE1 3.78Å; V179-F192 HydrophobicContact CG1-CZ 3.77Å; V179-F192 HydrophobicContact CG2-CE2 4.16Å; V179-F192 HydrophobicContact CG2-CZ 4.12Å; V179-F192 PolarHBondContact N-O 3.31Å; V179-F192 PolarHBondContact O-N 3.49Å; Y181-F192 AromaticContact CD1-CD1 3.79Å; Y181-F192 HydrophobicContact CD1-CD1 3.79Å; Y181-F192 HydrophobicContact CD1-CE1 4.03Å; Y181-F192 AromaticContact CE1-CD1 3.84Å; Y181-F192 HydrophobicContact CE1-CD1 3.84Å; Y181-F192 HydrophobicContact CE1-CE1 4.42Å; F192-A194 HydrophobicContact CD2-CB 4.16Å; F192-A194 HydrophobicContact CE2-CB 3.94Å; F192-L245 HydrophobicContact CB-CD2 4.38Å
193	P	92.8	Very high	80.8	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	137.1	171.1	28.8	-30.8	0	0	0	110.6	V177 F217 I233 A248 F249 A252	V177-P193 CarbonylContact O-C 2.99Å; V177-P193 WeakPolarHBondContact O-CA 3.45Å; P193-F217 HydrophobicContact CB-CB 4.45Å; P193-F217 HydrophobicContact CB-CD2 4.27Å; P193-F217 HydrophobicContact CG-CB 4.2Å; P193-F217 PolarHBondContact O-N 2.82Å; P193-I233 HydrophobicContact CB-CD1 4.14Å; P193-A248 HydrophobicContact CG-CB 3.98Å; P193-F249 HydrophobicContact CG-CB 4.4Å; P193-A252 HydrophobicContact CB-CB 3.73Å; P193-A252 HydrophobicContact CG-CB 4.41Å
194	A	94.1	Very high	81	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	165.6	177.6	0	0	0	0	0	111.6	V177 V179 F192 V214 R215	V177-A194 HydrophobicContact CG2-CB 4.26Å; V177-A194 WeakPolarHBondContact CG2-O 3.45Å; V177-A194 PolarHBondContact N-O 3.15Å; V177-A194 PolarHBondContact O-N 2.89Å; V179-A194 HydrophobicContact CG2-CB 3.96Å; F192-A194 HydrophobicContact CD2-CB 4.16Å; F192-A194 HydrophobicContact CE2-CB 3.94Å; A194-V214 HydrophobicContact CB-CB 3.84Å; A194-V214 HydrophobicContact CB-CG2 4.02Å; A194-R215 CarbonylContact C-O 3.59Å; A194-R215 VanDerWaalsContact CA-O 3.29Å; A194-R215 WeakPolarHBondContact CA-O 3.25Å; A194-R215 WeakPolarHBondContact CB-O 3.38Å
195	L	93.2	Very high	81.9	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.6	172.1	175.2	64.5	0	0	0	108.6	V176 V197 V214 R215 F217 F255 W265 A400	V176-L195 HydrophobicContact CG2-CD1 4.36Å; L195-V197 HydrophobicContact CD2-CG1 4.46Å; L195-V197 HydrophobicContact CG-CG1 4.27Å; L195-V214 CarbonylContact O-C 3.46Å; L195-V214 VanDerWaalsContact O-CA 3.22Å; L195-V214 WeakPolarHBondContact O-CA 3.23Å; L195-R215 PolarHBondContact N-O 3.41Å; L195-R215 PolarHBondContact O-N 3.37Å; L195-F217 HydrophobicContact CB-CE2 3.88Å; L195-F217 HydrophobicContact CB-CZ 4.13Å; L195-F255 HydrophobicContact CD1-CD1 4.32Å; L195-F255 HydrophobicContact CD1-CE1 3.6Å; L195-F255 HydrophobicContact CD1-CZ 4.22Å; L195-F255 HydrophobicContact CD2-CE1 3.88Å; L195-F255 HydrophobicContact CD2-CE2 4.41Å; L195-F255 HydrophobicContact CD2-CZ 3.72Å; L195-F255 HydrophobicContact CG-CE1 4.37Å; L195-W265 HydrophobicContact CB-CH2 3.88Å; L195-W265 HydrophobicContact CD2-CH2 3.77Å; L195-W265 HydrophobicContact CD2-CZ3 3.74Å; L195-A400 HydrophobicContact CD2-CB 3.9Å
196	V	92.8	Very high	82.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	136.3	175.1	-171.7	0	0	0	0	109.7	L172 L173 G174 K175 V177 I212 V214	L172-V196 HydrophobicContact CB-CG1 4.29Å; L172-V196 HydrophobicContact CB-CG2 4.35Å; L172-V196 VanDerWaalsContact O-CB 3.26Å; L172-V196 WeakPolarHBondContact O-CB 3.29Å; L173-V196 HydrophobicContact CD2-CG1 4.23Å; G174-V196 PolarHBondContact N-O 2.8Å; G174-V196 VanDerWaalsContact N-O 3.11Å; K175-V196 PolarHBondContact O-N 3.18Å; K175-V196 VanDerWaalsContact O-N 3.13Å; V177-V196 HydrophobicContact CB-CG2 4.33Å; V177-V196 HydrophobicContact CG1-CG2 3.63Å; V177-V196 HydrophobicContact CG2-CG2 3.67Å; V196-I212 HydrophobicContact CG1-CB 4.46Å; V196-I212 HydrophobicContact CG1-CD1 3.96Å; V196-I212 HydrophobicContact CG2-CD1 4.02Å; V196-V214 HydrophobicContact CG2-CG1 4.22Å
197	V	91.2	Very high	83.7	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	159.5	-175	-63.3	0	0	0	0	110.8	L195 L213 F222 Y396	L195-V197 HydrophobicContact CD2-CG1 4.46Å; L195-V197 HydrophobicContact CG-CG1 4.27Å; V197-L213 HydrophobicContact CG2-CB 4.01Å; V197-L213 HydrophobicContact CG2-CD2 3.87Å; V197-L213 HydrophobicContact CG2-CG 3.75Å; V197-L213 PolarHBondContact N-O 2.79Å; V197-F222 HydrophobicContact CG2-CD1 4.09Å; V197-F222 HydrophobicContact CG2-CE1 4.13Å; V197-Y396 HydrophobicContact CB-CD2 4.46Å; V197-Y396 HydrophobicContact CG1-CD2 3.85Å; V197-Y396 HydrophobicContact CG1-CE2 3.7Å
198	C	87.8	Confident	84.8	Confident	15 Å²	15	50.3 Å²	50.3	10%	0.101	28%	0.277	C	S	.	.			trans	-62.8	137	176.8	-178.5	0	0	0	0	111	D200 C201 E395 S399	C198-D200 PolarHBondContact O-N 2.99Å; C198-D200 VanDerWaalsContact O-N 3.13Å; C198-C201 VanDerWaalsContact O-CB 3.28Å; C198-C201 WeakPolarHBondContact O-CB 3.47Å; C198-C201 PolarHBondContact O-N 3.07Å; C198-C201 PolarHBondContact O-SG 2.72Å; C198-E395 HydrophobicContact CB-CG 3.97Å; C198-E395 VanDerWaalsContact CB-OE1 3.31Å; C198-E395 WeakPolarHBondContact CB-OE1 3.37Å; C198-E395 PolarHBondContact SG-OE1 2.69Å; C198-S399 WeakPolarHBondContact CB-OG 3.23Å; C198-S399 PolarHBondContact N-OG 2.93Å
199	P	85.5	Confident	85.4	Confident	48 Å²	48	50.5 Å²	50.5	31%	0.312	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-50.1	-35.1	175.6	-31.4	38.1	0	0	0	114.5	C201 S202 V207	P199-C201 PolarHBondContact O-N 2.75Å; P199-S202 PolarHBondContact O-N 3.17Å; P199-V207 HydrophobicContact CB-CB 4.25Å; P199-V207 HydrophobicContact CB-CG2 3.89Å; P199-V207 HydrophobicContact CG-CB 4.5Å; P199-V207 HydrophobicContact CG-CG1 4.46Å; P199-V207 HydrophobicContact CG-CG2 4.35Å
200	D	81.3	Confident	86.1	Confident	98 Å²	98	52.7 Å²	52.7	52%	0.524	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-68.7	-4.8	-177.6	-66.3	-6.1	0	0	0	113.7	C198 S202 E395	C198-D200 PolarHBondContact O-N 2.99Å; C198-D200 VanDerWaalsContact O-N 3.13Å; D200-S202 PolarHBondContact O-N 3.16Å; D200-E395 HydrophobicContact CB-CG 4.22Å
201	C	80.4	Confident	86.4	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-65.8	-19	170.9	-62.5	0	0	0	0	113.3	C198 P199 L213 F222 F319 Y396	C198-C201 VanDerWaalsContact O-CB 3.28Å; C198-C201 WeakPolarHBondContact O-CB 3.47Å; C198-C201 PolarHBondContact O-N 3.07Å; C198-C201 PolarHBondContact O-SG 2.72Å; P199-C201 PolarHBondContact O-N 2.75Å; C201-L213 HydrophobicContact CB-CD2 4.2Å; C201-F222 HydrophobicContact CB-CE1 4.49Å; C201-F319 HydrophobicContact CB-CE2 4.27Å; C201-F319 HydrophobicContact CB-CZ 4.39Å; C201-F319 WeakPolarHBondContact O-CZ 3.47Å; C201-Y396 WeakPolarHBondContact SG-CA 3.34Å
202	S	78.6	Confident	86.5	Confident	7 Å²	7	50.4 Å²	50.4	5%	0.049	27%	0.27	C	S	.	.			trans	-145.4	106.6	-176.2	-171.5	0	0	0	0	113.8	P199 D200 E204 I205	P199-S202 PolarHBondContact O-N 3.17Å; D200-S202 PolarHBondContact O-N 3.16Å; S202-E204 PolarHBondContact O-N 3.03Å; S202-I205 PolarHBondContact O-N 2.89Å
203	D	72.1	Confident	86.5	Confident	134 Å²	134	49.1 Å²	49.1	72%	0.717	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-20	174.5	-49.7	-76.3	0	0	0	113.4	R323	D203-R323 IonicContact OD2-CZ 3.52Å; D203-R323 IonicContact OD2-NH2 3.6Å; D203-R323 PolarHBondContact OD2-NH2 2.96Å
204	E	79.4	Confident	86.6	Confident	141 Å²	141	49.1 Å²	49.1	66%	0.659	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-27.5	-178.9	-63.2	-161.9	151.5	0	0	112.8	S202	S202-E204 PolarHBondContact O-N 3.03Å
205	I	84	Confident	86.5	Confident	46 Å²	46	49.3 Å²	49.3	24%	0.236	27%	0.265	C	S	.	.	S	Bend	trans	-105.6	92.5	-171.1	-57.8	175.2	0	0	0	109.7	S202 V207 L213 F222	S202-I205 PolarHBondContact O-N 2.89Å; I205-V207 PolarHBondContact O-N 2.92Å; I205-L213 HydrophobicContact CB-CD1 4.14Å; I205-L213 HydrophobicContact CD1-CD1 4.2Å; I205-L213 HydrophobicContact CG2-CD1 3.72Å; I205-F222 HydrophobicContact CD1-CB 3.47Å; I205-F222 VanDerWaalsContact CD1-CB 3.47Å; I205-F222 WeakPolarHBondContact CD1-O 3.41Å
206	A	84.4	Confident	86.5	Confident	95 Å²	95	49.5 Å²	49.5	79%	0.785	27%	0.266	S	S	*	.			trans	-63.5	105.4	173.3	0	0	0	0	0	111.6
207	V	85.8	Confident	86.4	Confident	43 Å²	43	49.5 Å²	49.5	26%	0.261	27%	0.266	S	S	.	.			trans	-78.6	134.1	175	-172.7	0	0	0	0	109.6	P199 I205 N211 L213	P199-V207 HydrophobicContact CB-CB 4.25Å; P199-V207 HydrophobicContact CB-CG2 3.89Å; P199-V207 HydrophobicContact CG-CB 4.5Å; P199-V207 HydrophobicContact CG-CG1 4.46Å; P199-V207 HydrophobicContact CG-CG2 4.35Å; I205-V207 PolarHBondContact O-N 2.92Å; V207-N211 HydrophobicContact CG1-CB 4.01Å; V207-N211 VanDerWaalsContact CG1-O 3.23Å; V207-N211 WeakPolarHBondContact CG1-O 3.5Å; V207-L213 HydrophobicContact CG2-CB 4Å; V207-L213 HydrophobicContact CG2-CD1 4.21Å
208	K	87.4	Confident	86.3	Confident	150 Å²	150	54 Å²	54	65%	0.652	29%	0.286	S	S	*	.			trans	-89.1	159.8	175	-62.4	178.5	-178	175.7	0	110.4	D210 N211	K208-D210 VanDerWaalsContact C-N 3.3Å; K208-D210 PolarHBondContact O-N 2.84Å; K208-N211 HydrophobicContact CB-CB 4.26Å; K208-N211 WeakPolarHBondContact O-CB 3.17Å; K208-N211 PolarHBondContact O-N 3.31Å
209	K	82.1	Confident	86.2	Confident	106 Å²	106	57.2 Å²	57.2	46%	0.461	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	-48.9	179.2	-171.1	178.9	172.6	-178.8	0	113.4	D162 D165 N211	D162-K209 WeakPolarHBondContact OD1-CE 3.3Å; D162-K209 IonicContact OD1-NZ 2.65Å; D162-K209 PolarHBondContact OD1-NZ 3.5Å; D165-K209 WeakPolarHBondContact OD2-CE 3.42Å; D165-K209 IonicContact OD2-NZ 2.65Å; D165-K209 PolarHBondContact OD2-NZ 2.77Å; K209-N211 VanDerWaalsContact C-N 3.28Å; K209-N211 PolarHBondContact O-N 2.9Å
210	D	87.1	Confident	86.3	Confident	118 Å²	118	55 Å²	55	63%	0.631	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	6.6	-176.6	-36	-42.5	0	0	0	114.1	K208 R227	K208-D210 VanDerWaalsContact C-N 3.3Å; K208-D210 PolarHBondContact O-N 2.84Å; D210-R227 PolarHBondContact O-N 3.09Å
211	N	91.9	Very high	86.6	Confident	27 Å²	27	56.1 Å²	56.1	14%	0.144	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	155.8	-178.9	-76.6	23.3	0	0	0	110.9	V207 K208 K209 S224 V225 P226	V207-N211 HydrophobicContact CG1-CB 4.01Å; V207-N211 VanDerWaalsContact CG1-O 3.23Å; V207-N211 WeakPolarHBondContact CG1-O 3.5Å; K208-N211 HydrophobicContact CB-CB 4.26Å; K208-N211 WeakPolarHBondContact O-CB 3.17Å; K208-N211 PolarHBondContact O-N 3.31Å; K209-N211 VanDerWaalsContact C-N 3.28Å; K209-N211 PolarHBondContact O-N 2.9Å; N211-S224 VanDerWaalsContact CB-OG 3.3Å; N211-S224 WeakPolarHBondContact CB-OG 3.4Å; N211-S224 PolarHBondContact ND2-OG 3.3Å; N211-V225 CarbonylContact C-O 3.21Å; N211-V225 WeakPolarHBondContact CA-O 3.35Å; N211-V225 WeakPolarHBondContact CB-O 3.48Å; N211-P226 WeakPolarHBondContact OD1-CA 3.09Å
212	I	92.4	Very high	87.1	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	157.1	168.4	60.3	176.6	0	0	0	110.5	I169 L172 V196 V214 S224 V225 V230	I169-I212 HydrophobicContact CG1-CG2 4.02Å; I169-I212 HydrophobicContact CG2-CG2 4.38Å; L172-I212 HydrophobicContact CD1-CD1 4.4Å; V196-I212 HydrophobicContact CG1-CB 4.46Å; V196-I212 HydrophobicContact CG1-CD1 3.96Å; V196-I212 HydrophobicContact CG2-CD1 4.02Å; I212-V214 HydrophobicContact CD1-CG1 4.19Å; I212-V214 HydrophobicContact CG1-CG1 4.12Å; I212-S224 WeakPolarHBondContact O-CA 3.26Å; I212-V225 HydrophobicContact CG1-CG2 4Å; I212-V225 PolarHBondContact N-O 3.14Å; I212-V225 PolarHBondContact O-N 3.07Å; I212-V230 HydrophobicContact CD1-CB 4.17Å; I212-V230 HydrophobicContact CD1-CG1 4Å; I212-V230 HydrophobicContact CD1-CG2 3.92Å; I212-V230 HydrophobicContact CG1-CG2 4.28Å
213	L	92.6	Very high	87.7	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.9	172.2	-167.8	65.8	0	0	0	109.1	V197 C201 I205 V207 F222	V197-L213 HydrophobicContact CG2-CB 4.01Å; V197-L213 HydrophobicContact CG2-CD2 3.87Å; V197-L213 HydrophobicContact CG2-CG 3.75Å; V197-L213 PolarHBondContact N-O 2.79Å; C201-L213 HydrophobicContact CB-CD2 4.2Å; I205-L213 HydrophobicContact CB-CD1 4.14Å; I205-L213 HydrophobicContact CD1-CD1 4.2Å; I205-L213 HydrophobicContact CG2-CD1 3.72Å; V207-L213 HydrophobicContact CG2-CB 4Å; V207-L213 HydrophobicContact CG2-CD1 4.21Å; L213-F222 HydrophobicContact CD1-CB 4.29Å; L213-F222 HydrophobicContact CD2-CD1 4.39Å
214	V	93.6	Very high	88.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	144.8	177.3	-59	0	0	0	0	111.1	V177 V179 A194 L195 V196 I212 F222 T223 V225	V177-V214 HydrophobicContact CG2-CG1 4.5Å; V179-V214 HydrophobicContact CG2-CG2 4.29Å; A194-V214 HydrophobicContact CB-CB 3.84Å; A194-V214 HydrophobicContact CB-CG2 4.02Å; L195-V214 CarbonylContact O-C 3.46Å; L195-V214 VanDerWaalsContact O-CA 3.22Å; L195-V214 WeakPolarHBondContact O-CA 3.23Å; V196-V214 HydrophobicContact CG2-CG1 4.22Å; I212-V214 HydrophobicContact CD1-CG1 4.19Å; I212-V214 HydrophobicContact CG1-CG1 4.12Å; V214-F222 CarbonylContact O-C 3.59Å; V214-F222 VanDerWaalsContact O-CA 3.29Å; V214-F222 WeakPolarHBondContact O-CA 3.28Å; V214-T223 WeakPolarHBondContact CG2-O 3.43Å; V214-T223 PolarHBondContact N-O 3.37Å; V214-T223 PolarHBondContact O-N 2.91Å; V214-V225 HydrophobicContact CB-CG2 4.47Å; V214-V225 HydrophobicContact CG1-CG2 3.79Å; V214-V225 HydrophobicContact CG2-CG1 3.89Å; V214-V225 HydrophobicContact CG2-CG2 3.8Å
215	R	92.5	Very high	89.4	Confident	3 Å²	3	48.1 Å²	48.1	1%	0.011	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	117.1	169	-162.8	-177.9	-172.1	-168.5	2.7	109.5	A194 L195 G220 K221 F222 W265 D322 Y396	A194-R215 CarbonylContact C-O 3.59Å; A194-R215 VanDerWaalsContact CA-O 3.29Å; A194-R215 WeakPolarHBondContact CA-O 3.25Å; A194-R215 WeakPolarHBondContact CB-O 3.38Å; L195-R215 PolarHBondContact N-O 3.41Å; L195-R215 PolarHBondContact O-N 3.37Å; R215-G220 VanDerWaalsContact CG-O 3.23Å; R215-G220 WeakPolarHBondContact CG-O 3.39Å; R215-G220 PolarHBondContact NE-O 3.32Å; R215-K221 WeakPolarHBondContact CA-O 3.45Å; R215-F222 HydrophobicContact CB-CD1 3.99Å; R215-F222 HydrophobicContact CB-CE1 3.9Å; R215-F222 HydrophobicContact CG-CD1 4.13Å; R215-F222 HydrophobicContact CG-CE1 3.92Å; R215-F222 HydrophobicContact CG-CZ 4.19Å; R215-W265 HydrophobicContact CB-CZ2 4.45Å; R215-W265 HydrophobicContact CG-CZ2 4.15Å; R215-D322 IonicContact CZ-OD2 3.83Å; R215-D322 IonicContact NE-OD2 3.19Å; R215-D322 IonicContact NH2-OD2 3.96Å; R215-D322 PolarHBondContact NH2-OD2 3.27Å; R215-Y396 PolarHBondContact NH1-OH 2.8Å
216	S	92.7	Very high	89.8	Confident	4 Å²	4	48 Å²	48	3%	0.028	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	129.9	-177.4	157.1	0	0	0	0	111.9	K218 D219 G220 K221 W265	S216-K218 PolarHBondContact O-N 3.19Å; S216-K218 WeakPolarHBondContact OG-CB 3.43Å; S216-K218 PolarHBondContact OG-N 2.79Å; S216-D219 WeakPolarHBondContact CB-OD1 3.38Å; S216-D219 PolarHBondContact OG-N 2.96Å; S216-D219 PolarHBondContact OG-OD1 3.48Å; S216-G220 WeakPolarHBondContact O-CA 3.48Å; S216-G220 PolarHBondContact O-N 3.11Å; S216-K221 PolarHBondContact N-O 3.01Å; S216-W265 PolarHBondContact O-NE1 2.93Å
217	F	91	Very high	90	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-24.9	171.5	-76.9	-84.7	0	0	0	111.9	V176 P193 L195 A248 Q251 A252 F255 P262 N264 W265	V176-F217 HydrophobicContact CG1-CE2 4.11Å; V176-F217 HydrophobicContact CG2-CE2 4.11Å; V176-F217 HydrophobicContact CG2-CZ 4.08Å; P193-F217 HydrophobicContact CB-CB 4.45Å; P193-F217 HydrophobicContact CB-CD2 4.27Å; P193-F217 HydrophobicContact CG-CB 4.2Å; P193-F217 PolarHBondContact O-N 2.82Å; L195-F217 HydrophobicContact CB-CE2 3.88Å; L195-F217 HydrophobicContact CB-CZ 4.13Å; F217-A248 HydrophobicContact CB-CB 4.36Å; F217-A248 WeakPolarHBondContact CB-O 3.33Å; F217-Q251 HydrophobicContact CD1-CB 4.33Å; F217-A252 HydrophobicContact CB-CB 4.43Å; F217-A252 HydrophobicContact CD1-CB 4.16Å; F217-A252 HydrophobicContact CD2-CB 3.63Å; F217-A252 HydrophobicContact CE1-CB 4.35Å; F217-A252 HydrophobicContact CE2-CB 3.83Å; F217-A252 HydrophobicContact CG-CB 3.81Å; F217-A252 HydrophobicContact CZ-CB 4.2Å; F217-F255 HydrophobicContact CE1-CB 3.74Å; F217-F255 HydrophobicContact CE1-CG 4.07Å; F217-F255 HydrophobicContact CZ-CB 3.84Å; F217-F255 AromaticContact CZ-CD1 4Å; F217-F255 HydrophobicContact CZ-CD1 4Å; F217-F255 AromaticContact CZ-CG 3.91Å; F217-F255 HydrophobicContact CZ-CG 3.91Å; F217-P262 HydrophobicContact CD1-CG 3.68Å; F217-P262 HydrophobicContact CE1-CG 3.79Å; F217-N264 PolarHBondContact O-ND2 3.37Å; F217-N264 VanDerWaalsContact O-ND2 3.14Å; F217-W265 AromaticContact CD1-CH2 3.89Å; F217-W265 HydrophobicContact CD1-CH2 3.89Å; F217-W265 AromaticContact CD1-CZ2 3.64Å; F217-W265 HydrophobicContact CD1-CZ2 3.64Å; F217-W265 HydrophobicContact CD2-CH2 4.48Å; F217-W265 HydrophobicContact CD2-CZ2 4.33Å; F217-W265 AromaticContact CE1-CH2 3.46Å; F217-W265 HydrophobicContact CE1-CH2 3.46Å; F217-W265 VanDerWaalsContact CE1-CH2 3.46Å; F217-W265 AromaticContact CE1-CZ2 3.75Å; F217-W265 HydrophobicContact CE1-CZ2 3.75Å; F217-W265 HydrophobicContact CE1-CZ3 4.14Å; F217-W265 HydrophobicContact CE2-CH2 4.13Å; F217-W265 HydrophobicContact CE2-CZ2 4.43Å; F217-W265 HydrophobicContact CG-CH2 4.37Å; F217-W265 AromaticContact CG-CZ2 3.94Å; F217-W265 HydrophobicContact CG-CZ2 3.94Å; F217-W265 AromaticContact CZ-CH2 3.6Å; F217-W265 HydrophobicContact CZ-CH2 3.6Å; F217-W265 HydrophobicContact CZ-CZ2 4.15Å; F217-W265 HydrophobicContact CZ-CZ3 4.41Å
218	K	89.6	Confident	90.2	Very high	96 Å²	96	51.7 Å²	51.7	42%	0.417	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-37.5	-176.4	-178.3	-169.5	175.9	-171.4	0	113.7	S216 L245 A248	S216-K218 PolarHBondContact O-N 3.19Å; S216-K218 WeakPolarHBondContact OG-CB 3.43Å; S216-K218 PolarHBondContact OG-N 2.79Å; K218-L245 HydrophobicContact CD-CD2 3.9Å; K218-L245 HydrophobicContact CG-CD2 4.34Å; K218-A248 HydrophobicContact CB-CB 4.09Å
219	D	86.4	Confident	90.4	Very high	83 Å²	83	46.9 Å²	46.9	44%	0.444	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-141.5	3.9	-173.6	68.1	-20.7	0	0	0	114.5	S216 K221	S216-D219 WeakPolarHBondContact CB-OD1 3.38Å; S216-D219 PolarHBondContact OG-N 2.96Å; S216-D219 PolarHBondContact OG-OD1 3.48Å; D219-K221 PolarHBondContact O-N 3.26Å; D219-K221 WeakPolarHBondContact OD2-CD 3.11Å
220	G	86.2	Confident	90.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.213	C	C	.	.			trans	78	-5.1	175.7	0	0	0	0	0	115.7	R215 S216	R215-G220 VanDerWaalsContact CG-O 3.23Å; R215-G220 WeakPolarHBondContact CG-O 3.39Å; R215-G220 PolarHBondContact NE-O 3.32Å; S216-G220 WeakPolarHBondContact O-CA 3.48Å; S216-G220 PolarHBondContact O-N 3.11Å
221	K	88.1	Confident	90.9	Very high	123 Å²	123	41.7 Å²	41.7	54%	0.535	20%	0.204	S	C	.	.			trans	-83.8	147.1	-169.6	-63.5	-174.7	-175.7	174.8	0	113	R215 S216 D219	R215-K221 WeakPolarHBondContact CA-O 3.45Å; S216-K221 PolarHBondContact N-O 3.01Å; D219-K221 PolarHBondContact O-N 3.26Å; D219-K221 WeakPolarHBondContact OD2-CD 3.11Å
222	F	90.5	Very high	90.7	Very high	13 Å²	13	44 Å²	44	6%	0.057	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	141.8	167.5	-61.4	-79.6	0	0	0	110.5	V197 C201 I205 L213 V214 R215 F319 D322 Y396	V197-F222 HydrophobicContact CG2-CD1 4.09Å; V197-F222 HydrophobicContact CG2-CE1 4.13Å; C201-F222 HydrophobicContact CB-CE1 4.49Å; I205-F222 HydrophobicContact CD1-CB 3.47Å; I205-F222 VanDerWaalsContact CD1-CB 3.47Å; I205-F222 WeakPolarHBondContact CD1-O 3.41Å; L213-F222 HydrophobicContact CD1-CB 4.29Å; L213-F222 HydrophobicContact CD2-CD1 4.39Å; V214-F222 CarbonylContact O-C 3.59Å; V214-F222 VanDerWaalsContact O-CA 3.29Å; V214-F222 WeakPolarHBondContact O-CA 3.28Å; R215-F222 HydrophobicContact CB-CD1 3.99Å; R215-F222 HydrophobicContact CB-CE1 3.9Å; R215-F222 HydrophobicContact CG-CD1 4.13Å; R215-F222 HydrophobicContact CG-CE1 3.92Å; R215-F222 HydrophobicContact CG-CZ 4.19Å; F222-F319 HydrophobicContact CE2-CD2 4.2Å; F222-F319 HydrophobicContact CE2-CE2 4.26Å; F222-F319 AromaticContact CZ-CD2 3.78Å; F222-F319 HydrophobicContact CZ-CD2 3.78Å; F222-F319 AromaticContact CZ-CE2 3.72Å; F222-F319 HydrophobicContact CZ-CE2 3.72Å; F222-D322 HydrophobicContact CD2-CB 4.26Å; F222-D322 HydrophobicContact CE2-CB 3.94Å; F222-Y396 HydrophobicContact CE1-CD2 4.34Å; F222-Y396 HydrophobicContact CE1-CE2 4.35Å; F222-Y396 HydrophobicContact CZ-CD2 4.48Å; F222-Y396 HydrophobicContact CZ-CE2 4.49Å
223	T	91.5	Very high	90.2	Very high	61 Å²	61	44.2 Å²	44.2	37%	0.374	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	138.7	176.6	-62.1	0	0	0	0	109.7	V214 V225	V214-T223 WeakPolarHBondContact CG2-O 3.43Å; V214-T223 PolarHBondContact N-O 3.37Å; V214-T223 PolarHBondContact O-N 2.91Å; T223-V225 HydrophobicContact CG2-CG1 3.75Å
224	S	93.8	Very high	89.2	Confident	28 Å²	28	46.8 Å²	46.8	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	122.7	171.2	-177.8	0	0	0	0	110.1	N211 I212	N211-S224 VanDerWaalsContact CB-OG 3.3Å; N211-S224 WeakPolarHBondContact CB-OG 3.4Å; N211-S224 PolarHBondContact ND2-OG 3.3Å; I212-S224 WeakPolarHBondContact O-CA 3.26Å
225	V	93.3	Very high	87.9	Confident	11 Å²	11	51.4 Å²	51.4	7%	0.067	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.2	-172.6	-58.3	0	0	0	0	110.6	V179 N211 I212 V214 T223 R227 V230	V179-V225 HydrophobicContact CG1-CB 3.98Å; V179-V225 HydrophobicContact CG1-CG1 3.94Å; V179-V225 HydrophobicContact CG1-CG2 4.1Å; V179-V225 HydrophobicContact CG2-CG2 4.4Å; N211-V225 CarbonylContact C-O 3.21Å; N211-V225 WeakPolarHBondContact CA-O 3.35Å; N211-V225 WeakPolarHBondContact CB-O 3.48Å; I212-V225 HydrophobicContact CG1-CG2 4Å; I212-V225 PolarHBondContact N-O 3.14Å; I212-V225 PolarHBondContact O-N 3.07Å; V214-V225 HydrophobicContact CB-CG2 4.47Å; V214-V225 HydrophobicContact CG1-CG2 3.79Å; V214-V225 HydrophobicContact CG2-CG1 3.89Å; V214-V225 HydrophobicContact CG2-CG2 3.8Å; T223-V225 HydrophobicContact CG2-CG1 3.75Å; V225-R227 PolarHBondContact O-N 3.07Å; V225-V230 HydrophobicContact CG2-CG2 3.63Å
226	P	92.4	Very high	86.4	Confident	43 Å²	43	58.3 Å²	58.3	28%	0.279	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	134	179.4	-19.1	33.7	0	0	0	111.2	N211 K228 D229	N211-P226 WeakPolarHBondContact OD1-CA 3.09Å; P226-K228 HydrophobicContact CB-CG 3.92Å; P226-K228 PolarHBondContact O-N 2.97Å; P226-K228 VanDerWaalsContact O-N 3.15Å; P226-D229 WeakPolarHBondContact CB-OD2 3.4Å; P226-D229 VanDerWaalsContact CG-OD2 3.26Å; P226-D229 WeakPolarHBondContact CG-OD2 3.32Å; P226-D229 PolarHBondContact O-N 3.09Å
227	R	89.2	Confident	85	Confident	53 Å²	53	62.9 Å²	62.9	20%	0.2	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-53.9	-39.4	-176	-177.5	-179.3	176.6	76.5	9.3	113	Q168 D210 V225 D229 V230	Q168-R227 VanDerWaalsContact C-NH1 3.29Å; Q168-R227 PolarHBondContact O-NH1 3.45Å; Q168-R227 PolarHBondContact O-NH2 3.39Å; Q168-R227 VanDerWaalsContact OE1-NE 3.09Å; Q168-R227 VanDerWaalsContact OE1-NH2 3.09Å; D210-R227 PolarHBondContact O-N 3.09Å; V225-R227 PolarHBondContact O-N 3.07Å; R227-D229 PolarHBondContact O-N 3.34Å; R227-V230 WeakPolarHBondContact O-CB 3.33Å; R227-V230 PolarHBondContact O-N 2.98Å; R227-V230 VanDerWaalsContact O-N 3.12Å
228	K	90.1	Very high	83.8	Confident	164 Å²	164	64.5 Å²	64.5	71%	0.713	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-61.1	-17.3	177.4	57.9	158.4	-166.4	175.2	0	115.6	P226	P226-K228 HydrophobicContact CB-CG 3.92Å; P226-K228 PolarHBondContact O-N 2.97Å; P226-K228 VanDerWaalsContact O-N 3.15Å
229	D	90.9	Very high	83	Confident	49 Å²	49	62.4 Å²	62.4	26%	0.262	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-100.5	10.4	-178.9	-54.8	-34.4	0	0	0	110.5	V179 D180 P226 R227	V179-D229 WeakPolarHBondContact CA-O 3.29Å; D180-D229 PolarHBondContact N-O 3.2Å; P226-D229 WeakPolarHBondContact CB-OD2 3.4Å; P226-D229 VanDerWaalsContact CG-OD2 3.26Å; P226-D229 WeakPolarHBondContact CG-OD2 3.32Å; P226-D229 PolarHBondContact O-N 3.09Å; R227-D229 PolarHBondContact O-N 3.34Å
230	V	91.4	Very high	82.6	Confident	15 Å²	15	67.8 Å²	67.8	9%	0.091	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.3	-174.8	-174.1	0	0	0	0	111.3	V177 C178 V179 I212 V225 R227	V177-V230 HydrophobicContact CB-CG1 3.5Å; V177-V230 HydrophobicContact CG1-CG1 3.77Å; V177-V230 HydrophobicContact CG2-CG1 3.57Å; C178-V230 WeakPolarHBondContact O-CA 3.35Å; V179-V230 HydrophobicContact CG1-CG2 4.39Å; V179-V230 HydrophobicContact CG2-CG1 4.5Å; V179-V230 HydrophobicContact CG2-CG2 4.18Å; I212-V230 HydrophobicContact CD1-CB 4.17Å; I212-V230 HydrophobicContact CD1-CG1 4Å; I212-V230 HydrophobicContact CD1-CG2 3.92Å; I212-V230 HydrophobicContact CG1-CG2 4.28Å; V225-V230 HydrophobicContact CG2-CG2 3.63Å; R227-V230 WeakPolarHBondContact O-CB 3.33Å; R227-V230 PolarHBondContact O-N 2.98Å; R227-V230 VanDerWaalsContact O-N 3.12Å
231	H	88.5	Confident	82.3	Confident	99 Å²	99	69.7 Å²	69.7	46%	0.458	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133	-176.1	-56.8	97.6	0	0	0	110.7	V177 C178 D180 I233	V177-H231 CarbonylContact C-O 3.5Å; V177-H231 WeakPolarHBondContact CA-O 3.11Å; V177-H231 WeakPolarHBondContact CB-O 3.32Å; C178-H231 PolarHBondContact N-O 3.42Å; C178-H231 PolarHBondContact O-N 2.92Å; D180-H231 IonicContact OD2-CE1 2.76Å; D180-H231 PolarHBondContact OD2-CE1 2.91Å; D180-H231 IonicContact OD2-ND1 2.63Å; D180-H231 PolarHBondContact OD2-ND1 3.02Å; D180-H231 VanDerWaalsContact OD2-ND1 3.11Å; H231-I233 PolarHBondContact O-N 3.35Å
232	E	87.7	Confident	82.1	Confident	77 Å²	77	67.7 Å²	67.7	36%	0.36	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.1	176.7	-173.2	171.3	169	0	0	111.6	K175 T234	K175-E232 HydrophobicContact CD-CG 4.33Å; K175-E232 WeakPolarHBondContact CD-OE2 3.32Å; K175-E232 WeakPolarHBondContact CE-OE2 3.5Å; K175-E232 IonicContact NZ-OE1 2.89Å; K175-E232 IonicContact NZ-OE2 2.82Å; K175-E232 PolarHBondContact NZ-OE2 2.86Å; E232-T234 HydrophobicContact CG-CG2 4.46Å; E232-T234 PolarHBondContact O-N 2.95Å
233	I	82.8	Confident	81.8	Confident	5 Å²	5	71.7 Å²	71.7	3%	0.026	40%	0.401	C	S	.	.			trans	-83.8	103.6	174.5	-62.7	177	0	0	0	107.9	V176 C178 P193 H231 A238 F249 L253	V176-I233 HydrophobicContact CG1-CB 4.34Å; V176-I233 HydrophobicContact CG1-CD1 4.01Å; V176-I233 PolarHBondContact O-N 2.72Å; C178-I233 HydrophobicContact CB-CD1 4.4Å; C178-I233 HydrophobicContact CB-CG1 4.19Å; C178-I233 WeakPolarHBondContact SG-CD1 3.42Å; C178-I233 VanDerWaalsContact SG-CG1 3.52Å; P193-I233 HydrophobicContact CB-CD1 4.14Å; H231-I233 PolarHBondContact O-N 3.35Å; I233-A238 HydrophobicContact CG2-CB 4.03Å; I233-F249 HydrophobicContact CD1-CE2 4.26Å; I233-F249 HydrophobicContact CG2-CE2 4.17Å; I233-L253 HydrophobicContact CG2-CD2 4.17Å
234	T	71.2	Confident	81.5	Confident	55 Å²	55	74.6 Å²	74.6	34%	0.337	42%	0.418	S	S	.	.			trans	-97.2	158.2	162.1	75.2	0	0	0	0	109.8	E232 D236 T237 A238	E232-T234 HydrophobicContact CG-CG2 4.46Å; E232-T234 PolarHBondContact O-N 2.95Å; T234-D236 PolarHBondContact O-N 3.5Å; T234-T237 PolarHBondContact O-N 3.24Å; T234-T237 PolarHBondContact OG1-OG1 2.88Å; T234-A238 PolarHBondContact O-N 3.12Å
235	S	66.3	Low	81.2	Confident	98 Å²	98	74 Å²	74	69%	0.685	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-25.2	-178.3	52.1	0	0	0	0	114.1
236	D	61.1	Low	81	Confident	147 Å²	147	78.6 Å²	78.6	79%	0.786	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-17.9	-166	-59.5	2.4	0	0	0	112.6	T234	T234-D236 PolarHBondContact O-N 3.5Å
237	T	63.8	Low	80.8	Confident	101 Å²	101	83.2 Å²	83.2	62%	0.62	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-4.2	-179.4	58.5	0	0	0	0	114.1	T234	T234-T237 PolarHBondContact O-N 3.24Å; T234-T237 PolarHBondContact OG1-OG1 2.88Å
238	A	65.8	Low	80.9	Confident	33 Å²	33	80.9 Å²	80.9	27%	0.273	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-65	129.1	-167.9	0	0	0	0	0	114.1	I233 T234 F249	I233-A238 HydrophobicContact CG2-CB 4.03Å; T234-A238 PolarHBondContact O-N 3.12Å; A238-F249 HydrophobicContact CB-CE2 3.92Å; A238-F249 HydrophobicContact CB-CZ 3.55Å
239	P	72.3	Confident	80.9	Confident	53 Å²	53	74.1 Å²	74.1	34%	0.344	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-66.7	143.9	177.2	24.8	-31.5	0	0	0	111.8	C178 W191 P241	C178-P239 VanDerWaalsContact SG-CG 3.6Å; W191-P239 HydrophobicContact CD2-CG 4.02Å; W191-P239 HydrophobicContact CE3-CG 4.28Å; W191-P239 HydrophobicContact CH2-CG 3.9Å; W191-P239 HydrophobicContact CZ2-CB 3.85Å; W191-P239 HydrophobicContact CZ2-CG 3.61Å; W191-P239 VanDerWaalsContact CZ2-O 3.31Å; W191-P239 WeakPolarHBondContact CZ2-O 3.47Å; W191-P239 HydrophobicContact CZ3-CG 4.22Å; P239-P241 WeakPolarHBondContact O-CD 3.24Å
240	K	78.1	Confident	80.8	Confident	195 Å²	195	76.3 Å²	76.3	85%	0.848	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-65	120.8	178	-69.9	-178.6	179.1	177.1	0	110.2
241	P	80.6	Confident	80.8	Confident	41 Å²	41	77.1 Å²	77.1	27%	0.266	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-72.1	135.3	-179.2	28.5	-35	0	0	0	111.8	W191 P239 L245 K246 F249	W191-P241 HydrophobicContact CH2-CB 4.09Å; W191-P241 HydrophobicContact CZ2-CB 4.11Å; P239-P241 WeakPolarHBondContact O-CD 3.24Å; P241-L245 HydrophobicContact CB-CB 4.08Å; P241-K246 HydrophobicContact CG-CB 4.44Å; P241-F249 HydrophobicContact CB-CB 4.08Å; P241-F249 HydrophobicContact CB-CD1 4.47Å; P241-F249 HydrophobicContact CB-CG 4.29Å; P241-F249 HydrophobicContact CG-CB 4.2Å; P241-F249 HydrophobicContact CG-CD1 3.79Å; P241-F249 HydrophobicContact CG-CE1 4.49Å; P241-F249 HydrophobicContact CG-CG 4.1Å
242	D	82.7	Confident	80.8	Confident	81 Å²	81	72.5 Å²	72.5	43%	0.433	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-59.6	154.7	162.4	-79.4	-16.7	0	0	0	109	K188 V244 L245 K246	K188-D242 IonicContact NZ-OD1 3.39Å; K188-D242 IonicContact NZ-OD2 2.75Å; K188-D242 PolarHBondContact NZ-OD2 3.39Å; D242-V244 PolarHBondContact O-N 2.92Å; D242-L245 PolarHBondContact O-N 3.5Å; D242-K246 PolarHBondContact O-N 3.28Å
243	A	84.1	Confident	80.9	Confident	97 Å²	97	71.9 Å²	71.9	80%	0.802	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-28.8	-173.8	0	0	0	0	0	114.9	L245	A243-L245 VanDerWaalsContact C-N 3.35Å
244	V	85.4	Confident	81.2	Confident	122 Å²	122	76.5 Å²	76.5	74%	0.739	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-25	177.1	179.9	0	0	0	0	112.9	D242	D242-V244 PolarHBondContact O-N 2.92Å
245	L	87.4	Confident	82	Confident	15 Å²	15	73.9 Å²	73.9	8%	0.079	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-12.3	-177.7	-67	169.2	0	0	0	113.1	W191 F192 K218 P241 D242 A243 Q247 A248 F249	W191-L245 HydrophobicContact CD2-CD1 4.49Å; W191-L245 WeakPolarHBondContact O-CD1 3.41Å; F192-L245 HydrophobicContact CB-CD2 4.38Å; K218-L245 HydrophobicContact CD-CD2 3.9Å; K218-L245 HydrophobicContact CG-CD2 4.34Å; P241-L245 HydrophobicContact CB-CB 4.08Å; D242-L245 PolarHBondContact O-N 3.5Å; A243-L245 VanDerWaalsContact C-N 3.35Å; L245-Q247 PolarHBondContact O-N 2.84Å; L245-A248 PolarHBondContact O-N 3.25Å; L245-A248 VanDerWaalsContact O-N 3.17Å; L245-F249 WeakPolarHBondContact O-CB 3.37Å; L245-F249 PolarHBondContact O-N 3.41Å
246	K	88.3	Confident	83	Confident	107 Å²	107	73.6 Å²	73.6	47%	0.465	40%	0.395	S	S	.	.	H	α-helix	trans	-52.9	-48.1	-174.7	-174.6	174	-174.4	-71.3	0	112.9	P241 D242 F249 E250	P241-K246 HydrophobicContact CG-CB 4.44Å; D242-K246 PolarHBondContact O-N 3.28Å; K246-F249 PolarHBondContact O-N 2.86Å; K246-E250 WeakPolarHBondContact CE-OE1 3.47Å; K246-E250 WeakPolarHBondContact CG-OE1 3.41Å; K246-E250 IonicContact NZ-OE1 3.24Å; K246-E250 PolarHBondContact NZ-OE1 2.92Å; K246-E250 IonicContact NZ-OE2 3.77Å; K246-E250 WeakPolarHBondContact O-CB 3.31Å; K246-E250 WeakPolarHBondContact O-CG 3.32Å; K246-E250 PolarHBondContact O-N 2.71Å
247	Q	90.1	Very high	84.2	Confident	140 Å²	140	75.3 Å²	75.3	65%	0.654	40%	0.395	S	S	*	.	H	α-helix	trans	-63.4	-47.7	178.1	-177.2	-180	4.1	0	0	112.3	L245 F249 E250 Q251	L245-Q247 PolarHBondContact O-N 2.84Å; Q247-F249 PolarHBondContact O-N 3.27Å; Q247-E250 PolarHBondContact O-N 2.65Å; Q247-Q251 WeakPolarHBondContact O-CG 3.48Å; Q247-Q251 PolarHBondContact O-N 3.26Å
248	A	90.1	Very high	85.2	Confident	5 Å²	5	73.7 Å²	73.7	4%	0.041	39%	0.388	C	S	.	.	H	α-helix	trans	-63.1	-33	178.9	0	0	0	0	0	112.4	P193 F217 K218 L245 A252	P193-A248 HydrophobicContact CG-CB 3.98Å; F217-A248 HydrophobicContact CB-CB 4.36Å; F217-A248 WeakPolarHBondContact CB-O 3.33Å; K218-A248 HydrophobicContact CB-CB 4.09Å; L245-A248 PolarHBondContact O-N 3.25Å; L245-A248 VanDerWaalsContact O-N 3.17Å; A248-A252 WeakPolarHBondContact O-CB 3.37Å; A248-A252 PolarHBondContact O-N 3.06Å
249	F	89.8	Confident	86.1	Confident	21 Å²	21	77 Å²	77	9%	0.092	39%	0.393	C	S	.	.	H	α-helix	trans	-75.1	-40	176.5	-179.2	-99.7	0	0	0	112.2	W191 P193 I233 A238 P241 L245 K246 Q247 A252 L253	W191-F249 AromaticContact CH2-CD2 3.69Å; W191-F249 HydrophobicContact CH2-CD2 3.69Å; W191-F249 HydrophobicContact CH2-CE2 4.2Å; W191-F249 HydrophobicContact CH2-CG 4.26Å; W191-F249 AromaticContact CZ3-CD2 3.93Å; W191-F249 HydrophobicContact CZ3-CD2 3.93Å; P193-F249 HydrophobicContact CG-CB 4.4Å; I233-F249 HydrophobicContact CD1-CE2 4.26Å; I233-F249 HydrophobicContact CG2-CE2 4.17Å; A238-F249 HydrophobicContact CB-CE2 3.92Å; A238-F249 HydrophobicContact CB-CZ 3.55Å; P241-F249 HydrophobicContact CB-CB 4.08Å; P241-F249 HydrophobicContact CB-CD1 4.47Å; P241-F249 HydrophobicContact CB-CG 4.29Å; P241-F249 HydrophobicContact CG-CB 4.2Å; P241-F249 HydrophobicContact CG-CD1 3.79Å; P241-F249 HydrophobicContact CG-CE1 4.49Å; P241-F249 HydrophobicContact CG-CG 4.1Å; L245-F249 WeakPolarHBondContact O-CB 3.37Å; L245-F249 PolarHBondContact O-N 3.41Å; K246-F249 PolarHBondContact O-N 2.86Å; Q247-F249 PolarHBondContact O-N 3.27Å; F249-A252 PolarHBondContact O-N 3.27Å; F249-L253 HydrophobicContact CD1-CD1 4.11Å; F249-L253 HydrophobicContact CE1-CD1 3.45Å; F249-L253 VanDerWaalsContact CE1-CD1 3.45Å; F249-L253 HydrophobicContact CE1-CG 4.04Å; F249-L253 HydrophobicContact CZ-CD1 3.79Å; F249-L253 HydrophobicContact CZ-CD2 4.18Å; F249-L253 HydrophobicContact CZ-CG 4.01Å; F249-L253 WeakPolarHBondContact O-CG 3.48Å; F249-L253 PolarHBondContact O-N 2.81Å
250	E	89.4	Confident	86.6	Confident	96 Å²	96	77.2 Å²	77.2	45%	0.449	39%	0.394	S	S	.	.	H	α-helix	trans	-60.1	-44.5	171.5	-75.5	166.1	179.3	0	0	111.3	K246 Q247 A252 L253 E254	K246-E250 WeakPolarHBondContact CE-OE1 3.47Å; K246-E250 WeakPolarHBondContact CG-OE1 3.41Å; K246-E250 IonicContact NZ-OE1 3.24Å; K246-E250 PolarHBondContact NZ-OE1 2.92Å; K246-E250 IonicContact NZ-OE2 3.77Å; K246-E250 WeakPolarHBondContact O-CB 3.31Å; K246-E250 WeakPolarHBondContact O-CG 3.32Å; K246-E250 PolarHBondContact O-N 2.71Å; Q247-E250 PolarHBondContact O-N 2.65Å; E250-A252 PolarHBondContact O-N 3.38Å; E250-L253 PolarHBondContact O-N 3.2Å; E250-E254 PolarHBondContact O-N 3.32Å
251	Q	90.8	Very high	86.9	Confident	32 Å²	32	68.7 Å²	68.7	15%	0.15	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-39.4	173.6	-72.3	175.4	-43.2	0	0	113.2	F217 Q247 E254 F255 P262 N264	F217-Q251 HydrophobicContact CD1-CB 4.33Å; Q247-Q251 WeakPolarHBondContact O-CG 3.48Å; Q247-Q251 PolarHBondContact O-N 3.26Å; Q251-E254 PolarHBondContact O-N 2.72Å; Q251-F255 PolarHBondContact O-N 2.74Å; Q251-P262 HydrophobicContact CB-CG 4.28Å; Q251-N264 PolarHBondContact NE2-OD1 3.47Å
252	A	89.7	Confident	87.1	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.008	35%	0.348	C	S	.	.	H	α-helix	trans	-66.3	-40.1	177.6	0	0	0	0	0	112.3	V176 P193 F217 A248 F249 E250 H256	V176-A252 HydrophobicContact CG1-CB 3.81Å; P193-A252 HydrophobicContact CB-CB 3.73Å; P193-A252 HydrophobicContact CG-CB 4.41Å; F217-A252 HydrophobicContact CB-CB 4.43Å; F217-A252 HydrophobicContact CD1-CB 4.16Å; F217-A252 HydrophobicContact CD2-CB 3.63Å; F217-A252 HydrophobicContact CE1-CB 4.35Å; F217-A252 HydrophobicContact CE2-CB 3.83Å; F217-A252 HydrophobicContact CG-CB 3.81Å; F217-A252 HydrophobicContact CZ-CB 4.2Å; A248-A252 WeakPolarHBondContact O-CB 3.37Å; A248-A252 PolarHBondContact O-N 3.06Å; F249-A252 PolarHBondContact O-N 3.27Å; E250-A252 PolarHBondContact O-N 3.38Å; A252-H256 WeakPolarHBondContact O-CB 3.49Å; A252-H256 PolarHBondContact O-N 3.48Å
253	L	88.3	Confident	87	Confident	65 Å²	65	67.1 Å²	67.1	34%	0.34	36%	0.359	S	S	.	.	H	α-helix	trans	-67.4	-37	173.2	-70.4	-179.9	0	0	0	112.5	I233 F249 E250 H256 K257	I233-L253 HydrophobicContact CG2-CD2 4.17Å; F249-L253 HydrophobicContact CD1-CD1 4.11Å; F249-L253 HydrophobicContact CE1-CD1 3.45Å; F249-L253 VanDerWaalsContact CE1-CD1 3.45Å; F249-L253 HydrophobicContact CE1-CG 4.04Å; F249-L253 HydrophobicContact CZ-CD1 3.79Å; F249-L253 HydrophobicContact CZ-CD2 4.18Å; F249-L253 HydrophobicContact CZ-CG 4.01Å; F249-L253 WeakPolarHBondContact O-CG 3.48Å; F249-L253 PolarHBondContact O-N 2.81Å; E250-L253 PolarHBondContact O-N 3.2Å; L253-H256 PolarHBondContact O-N 3.09Å; L253-K257 WeakPolarHBondContact O-CB 3.42Å; L253-K257 PolarHBondContact O-N 2.7Å
254	E	89.6	Confident	86.8	Confident	101 Å²	101	65.1 Å²	65.1	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-46.2	175.5	-165.1	-178.2	173.9	0	0	111.3	E250 Q251 H256 K257 S258 T260	E250-E254 PolarHBondContact O-N 3.32Å; Q251-E254 PolarHBondContact O-N 2.72Å; E254-H256 VanDerWaalsContact C-N 3.33Å; E254-H256 PolarHBondContact O-N 3.29Å; E254-K257 PolarHBondContact O-N 3.06Å; E254-K257 VanDerWaalsContact O-N 3.14Å; E254-S258 PolarHBondContact O-N 3.37Å; E254-S258 PolarHBondContact O-OG 3.04Å; E254-S258 VanDerWaalsContact O-OG 3.12Å; E254-T260 PolarHBondContact OE1-OG1 2.77Å
255	F	89.1	Confident	86.7	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.1	-42.7	173.3	-176	-87	0	0	0	111.8	V176 L195 F217 Q251 K257 R259 I261 W265 I402	V176-F255 HydrophobicContact CG2-CD1 3.7Å; V176-F255 HydrophobicContact CG2-CE1 4.36Å; L195-F255 HydrophobicContact CD1-CD1 4.32Å; L195-F255 HydrophobicContact CD1-CE1 3.6Å; L195-F255 HydrophobicContact CD1-CZ 4.22Å; L195-F255 HydrophobicContact CD2-CE1 3.88Å; L195-F255 HydrophobicContact CD2-CE2 4.41Å; L195-F255 HydrophobicContact CD2-CZ 3.72Å; L195-F255 HydrophobicContact CG-CE1 4.37Å; F217-F255 HydrophobicContact CE1-CB 3.74Å; F217-F255 HydrophobicContact CE1-CG 4.07Å; F217-F255 HydrophobicContact CZ-CB 3.84Å; F217-F255 AromaticContact CZ-CD1 4Å; F217-F255 HydrophobicContact CZ-CD1 4Å; F217-F255 AromaticContact CZ-CG 3.91Å; F217-F255 HydrophobicContact CZ-CG 3.91Å; Q251-F255 PolarHBondContact O-N 2.74Å; F255-K257 VanDerWaalsContact C-N 3.31Å; F255-K257 PolarHBondContact O-N 3.02Å; F255-R259 WeakPolarHBondContact O-CA 3.5Å; F255-R259 PolarHBondContact O-N 2.97Å; F255-I261 HydrophobicContact CD2-CG1 4.23Å; F255-I261 HydrophobicContact CE2-CG1 3.96Å; F255-W265 HydrophobicContact CE2-CZ3 4.41Å; F255-I402 HydrophobicContact CE2-CD1 4.48Å; F255-I402 HydrophobicContact CE2-CG1 4.21Å; F255-I402 HydrophobicContact CZ-CG1 4.2Å
256	H	86.1	Confident	86.4	Confident	92 Å²	92	61 Å²	61	43%	0.426	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-38	175.8	-179.1	79.9	0	0	0	112.6	V176 A252 L253 E254	V176-H256 HydrophobicContact CB-CB 4.42Å; V176-H256 HydrophobicContact CG2-CB 4.15Å; A252-H256 WeakPolarHBondContact O-CB 3.49Å; A252-H256 PolarHBondContact O-N 3.48Å; L253-H256 PolarHBondContact O-N 3.09Å; E254-H256 VanDerWaalsContact C-N 3.33Å; E254-H256 PolarHBondContact O-N 3.29Å
257	K	86.3	Confident	86	Confident	184 Å²	184	57.9 Å²	57.9	80%	0.8	30%	0.296	S	S	*	.	H	α-helix	trans	-80.9	-42.6	-175.5	-176	-178.1	176.1	-172.5	0	114.1	L253 E254 F255	L253-K257 WeakPolarHBondContact O-CB 3.42Å; L253-K257 PolarHBondContact O-N 2.7Å; E254-K257 PolarHBondContact O-N 3.06Å; E254-K257 VanDerWaalsContact O-N 3.14Å; F255-K257 VanDerWaalsContact C-N 3.31Å; F255-K257 PolarHBondContact O-N 3.02Å
258	S	85.2	Confident	85.2	Confident	67 Å²	67	59.9 Å²	59.9	47%	0.469	31%	0.305	S	S	.	.	H	α-helix	trans	-132	6.4	-170	50.4	0	0	0	0	114.2	E254 T260	E254-S258 PolarHBondContact O-N 3.37Å; E254-S258 PolarHBondContact O-OG 3.04Å; E254-S258 VanDerWaalsContact O-OG 3.12Å; S258-T260 PolarHBondContact O-N 2.68Å; S258-T260 PolarHBondContact OG-OG1 3.24Å
259	R	84.7	Confident	84	Confident	101 Å²	101	62.3 Å²	62.3	38%	0.381	32%	0.317	S	S	.	.			trans	54.6	20.7	-173.4	-57	-68.6	176.3	166.6	-4.8	113.2	G174 F255 I261 A400	G174-R259 PolarHBondContact O-NH1 3.28Å; F255-R259 WeakPolarHBondContact O-CA 3.5Å; F255-R259 PolarHBondContact O-N 2.97Å; R259-I261 PolarHBondContact O-N 3.15Å; R259-A400 PolarHBondContact NH1-O 2.67Å; R259-A400 VanDerWaalsContact NH1-O 3.13Å
260	T	84	Confident	82	Confident	59 Å²	59	68.8 Å²	68.8	36%	0.362	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-64.1	123.1	176.3	-49	0	0	0	0	109.6	E254 S258	E254-T260 PolarHBondContact OE1-OG1 2.77Å; S258-T260 PolarHBondContact O-N 2.68Å; S258-T260 PolarHBondContact OG-OG1 3.24Å
261	I	83.8	Confident	79.8	Confident	16 Å²	16	72.8 Å²	72.8	8%	0.082	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-84.7	127.4	-176.4	-72.1	172.3	0	0	0	111	F255 R259 W265 K266 Q315 I402	F255-I261 HydrophobicContact CD2-CG1 4.23Å; F255-I261 HydrophobicContact CE2-CG1 3.96Å; R259-I261 PolarHBondContact O-N 3.15Å; I261-W265 HydrophobicContact CG2-CB 3.89Å; I261-W265 HydrophobicContact CG2-CE3 4.23Å; I261-K266 HydrophobicContact CG2-CG 4.36Å; I261-Q315 VanDerWaalsContact CD1-CD 3.41Å; I261-Q315 HydrophobicContact CG2-CG 4.3Å; I261-I402 HydrophobicContact CD1-CB 4.43Å; I261-I402 HydrophobicContact CD1-CD1 3.67Å; I261-I402 HydrophobicContact CD1-CG1 3.9Å; I261-I402 HydrophobicContact CD1-CG2 3.65Å; I261-I402 HydrophobicContact CG1-CD1 4.44Å
262	P	85.1	Confident	77.1	Confident	9 Å²	9	77.9 Å²	77.9	6%	0.058	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-54.5	143.1	-179.5	-25.8	32.6	0	0	0	113.5	F217 Q251 N264 W265	F217-P262 HydrophobicContact CD1-CG 3.68Å; F217-P262 HydrophobicContact CE1-CG 3.79Å; Q251-P262 HydrophobicContact CB-CG 4.28Å; P262-N264 WeakPolarHBondContact CB-OD1 3.22Å; P262-N264 PolarHBondContact O-N 3.43Å; P262-W265 HydrophobicContact CB-CD2 4.39Å; P262-W265 HydrophobicContact CB-CG 4.2Å; P262-W265 HydrophobicContact CG-CD2 3.99Å; P262-W265 HydrophobicContact CG-CE3 4.24Å; P262-W265 HydrophobicContact CG-CG 4.32Å; P262-W265 WeakPolarHBondContact O-CB 3.44Å; P262-W265 PolarHBondContact O-N 3.18Å
263	A	80.4	Confident	74.9	Confident	80 Å²	80	81.3 Å²	81.3	66%	0.661	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-58.2	-34.4	178.1	0	0	0	0	0	113	W265 K266	A263-W265 PolarHBondContact O-N 3.19Å; A263-K266 PolarHBondContact O-N 3.04Å; A263-K266 VanDerWaalsContact O-N 3.1Å
264	N	79.9	Confident	72.6	Confident	55 Å²	55	83.3 Å²	83.3	29%	0.294	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-69.9	-5.2	174.9	55.7	-57.9	0	0	0	114.4	F217 Q251 P262	F217-N264 PolarHBondContact O-ND2 3.37Å; F217-N264 VanDerWaalsContact O-ND2 3.14Å; Q251-N264 PolarHBondContact NE2-OD1 3.47Å; P262-N264 WeakPolarHBondContact CB-OD1 3.22Å; P262-N264 PolarHBondContact O-N 3.43Å
265	W	82.9	Confident	69.9	Low	0 Å²	0	83.9 Å²	83.9	0%	0	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-101.9	7.7	172.3	-65.2	6.5	0	0	0	112.6	L195 R215 S216 F217 F255 I261 P262 A263 K318 Y396	L195-W265 HydrophobicContact CB-CH2 3.88Å; L195-W265 HydrophobicContact CD2-CH2 3.77Å; L195-W265 HydrophobicContact CD2-CZ3 3.74Å; R215-W265 HydrophobicContact CB-CZ2 4.45Å; R215-W265 HydrophobicContact CG-CZ2 4.15Å; S216-W265 PolarHBondContact O-NE1 2.93Å; F217-W265 AromaticContact CD1-CH2 3.89Å; F217-W265 HydrophobicContact CD1-CH2 3.89Å; F217-W265 AromaticContact CD1-CZ2 3.64Å; F217-W265 HydrophobicContact CD1-CZ2 3.64Å; F217-W265 HydrophobicContact CD2-CH2 4.48Å; F217-W265 HydrophobicContact CD2-CZ2 4.33Å; F217-W265 AromaticContact CE1-CH2 3.46Å; F217-W265 HydrophobicContact CE1-CH2 3.46Å; F217-W265 VanDerWaalsContact CE1-CH2 3.46Å; F217-W265 AromaticContact CE1-CZ2 3.75Å; F217-W265 HydrophobicContact CE1-CZ2 3.75Å; F217-W265 HydrophobicContact CE1-CZ3 4.14Å; F217-W265 HydrophobicContact CE2-CH2 4.13Å; F217-W265 HydrophobicContact CE2-CZ2 4.43Å; F217-W265 HydrophobicContact CG-CH2 4.37Å; F217-W265 AromaticContact CG-CZ2 3.94Å; F217-W265 HydrophobicContact CG-CZ2 3.94Å; F217-W265 AromaticContact CZ-CH2 3.6Å; F217-W265 HydrophobicContact CZ-CH2 3.6Å; F217-W265 HydrophobicContact CZ-CZ2 4.15Å; F217-W265 HydrophobicContact CZ-CZ3 4.41Å; F255-W265 HydrophobicContact CE2-CZ3 4.41Å; I261-W265 HydrophobicContact CG2-CB 3.89Å; I261-W265 HydrophobicContact CG2-CE3 4.23Å; P262-W265 HydrophobicContact CB-CD2 4.39Å; P262-W265 HydrophobicContact CB-CG 4.2Å; P262-W265 HydrophobicContact CG-CD2 3.99Å; P262-W265 HydrophobicContact CG-CE3 4.24Å; P262-W265 HydrophobicContact CG-CG 4.32Å; P262-W265 WeakPolarHBondContact O-CB 3.44Å; P262-W265 PolarHBondContact O-N 3.18Å; A263-W265 PolarHBondContact O-N 3.19Å; W265-K318 WeakPolarHBondContact O-CB 3.38Å; W265-K318 WeakPolarHBondContact O-CG 3.42Å; W265-Y396 WeakPolarHBondContact CZ3-OH 3.4Å
266	K	81.4	Confident	66.9	Low	51 Å²	51	88.8 Å²	88.8	22%	0.222	49%	0.485	C	S	.	.	S	Bend	trans	-119.6	146.2	175.2	-59.5	-172	-170.8	-172.1	0	109.6	I261 A263 N311 Q314 Q315	I261-K266 HydrophobicContact CG2-CG 4.36Å; A263-K266 PolarHBondContact O-N 3.04Å; A263-K266 VanDerWaalsContact O-N 3.1Å; K266-N311 WeakPolarHBondContact CE-OD1 3.28Å; K266-N311 PolarHBondContact NZ-ND2 2.87Å; K266-N311 VanDerWaalsContact NZ-ND2 3.14Å; K266-N311 PolarHBondContact NZ-OD1 2.89Å; K266-N311 VanDerWaalsContact NZ-OD1 3.07Å; K266-Q314 HydrophobicContact CB-CB 4.09Å; K266-Q315 HydrophobicContact CG-CG 4.13Å
267	T	80.5	Confident	64.6	Low	40 Å²	40	93.5 Å²	93.5	25%	0.245	51%	0.507	C	S	.	.			trans	-97.2	138.5	171	-57	0	0	0	0	109.4	L269 Q314 K318	T267-L269 PolarHBondContact O-N 3.09Å; T267-L269 VanDerWaalsContact O-N 3.15Å; T267-Q314 PolarHBondContact N-O 3.03Å; T267-Q314 VanDerWaalsContact N-O 3.09Å; T267-Q314 WeakPolarHBondContact O-CB 3.42Å; T267-Q314 VanDerWaalsContact O-CG 3.29Å; T267-Q314 WeakPolarHBondContact O-CG 3.44Å; T267-K318 VanDerWaalsContact OG1-CA 3.31Å; T267-K318 WeakPolarHBondContact OG1-CA 3.5Å; T267-K318 WeakPolarHBondContact OG1-CB 3.23Å; T267-K318 WeakPolarHBondContact OG1-CD 3.45Å; T267-K318 PolarHBondContact OG1-N 3.4Å
268	E	71.3	Confident	62.1	Low	183 Å²	183	88.6 Å²	88.6	86%	0.855	50%	0.501	S	S	*	.			trans	-65.4	110.7	167.8	-69.1	177.8	-174.1	0	0	109.5	K270	E268-K270 PolarHBondContact O-N 3.33Å
269	L	64.9	Low	59.7	Low	55 Å²	55	93 Å²	93	29%	0.288	51%	0.514	S	S	.	.			trans	-80.5	114.1	168.4	-66.2	174	0	0	0	107.5	T267 E310 L313 Q314 Y317	T267-L269 PolarHBondContact O-N 3.09Å; T267-L269 VanDerWaalsContact O-N 3.15Å; L269-E310 HydrophobicContact CD1-CG 4.04Å; L269-L313 HydrophobicContact CD1-CB 3.79Å; L269-Q314 HydrophobicContact CD1-CG 3.76Å; L269-Q314 HydrophobicContact CG-CG 3.9Å; L269-Y317 HydrophobicContact CD2-CG 4.41Å
270	K	49	Very low	57.2	Low	158 Å²	158	97.8 Å²	97.8	69%	0.687	54%	0.541	S	S	*	.			trans	-68.4	135.3	171.8	-71.3	-169.4	172.5	-166.7	0	110.2	E268 D272	E268-K270 PolarHBondContact O-N 3.33Å; K270-D272 PolarHBondContact O-N 3.13Å
271	E	43.4	Very low	54.8	Low	179 Å²	179	102.7 Å²	102.7	84%	0.836	56%	0.56	S	S	*	*	S	Bend	trans	-66.5	-3.5	-179.8	-66.6	-176.6	134.7	0	0	114.2	S273 S274	E271-S273 PolarHBondContact O-N 3.01Å; E271-S274 PolarHBondContact O-N 3.46Å
272	D	33.8	Very low	52.5	Low	140 Å²	140	111 Å²	111	75%	0.749	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	31.2	173.2	-48.9	-42.2	0	0	0	113.6	K270	K270-D272 PolarHBondContact O-N 3.13Å
273	S	44.1	Very low	50.2	Low	72 Å²	72	119.6 Å²	119.6	50%	0.503	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-146.3	8.4	-167.9	-112.9	0	0	0	0	112.7	E271 R330	E271-S273 PolarHBondContact O-N 3.01Å; S273-R330 PolarHBondContact O-NH2 2.86Å; S273-R330 PolarHBondContact OG-NH2 2.92Å
274	S	40.1	Very low	47.9	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	65%	0.648	S	S	*	*	S	Bend	trans	-138.5	141.8	164.1	-158.6	0	0	0	0	108.6	E271	E271-S274 PolarHBondContact O-N 3.46Å
275	S	32.3	Very low	45.9	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	68%	0.677	S	S	*	*	S	Bend	trans	66.9	74.1	-177.8	-175	0	0	0	0	117.5
276	S	26.7	Very low	43.6	Very low	103 Å²	103	138.2 Å²	138.2	72%	0.72	71%	0.714	S	S	*	*				168.4	96	113.6	62.1	0	0	0	0	111.1	A278	S276-A278 PolarHBondContact O-N 2.84Å; S276-A278 VanDerWaalsContact O-N 3.12Å
277	E	37	Very low	41.3	Very low	191 Å²	191	142 Å²	142	89%	0.893	74%	0.736	S	S	*	*			trans	-79.6	79.1	152.4	-68.7	-173.8	163.6	0	0	106.2
278	A	32.7	Very low	39.5	Very low	81 Å²	81	148 Å²	148	67%	0.669	76%	0.762	S	S	*	*			trans	-97.1	105.5	159.9	0	0	0	0	0	105.4	S276 E280	S276-A278 PolarHBondContact O-N 2.84Å; S276-A278 VanDerWaalsContact O-N 3.12Å; A278-E280 PolarHBondContact O-N 2.91Å
279	E	35.4	Very low	37.9	Very low	160 Å²	160	149.1 Å²	149.1	75%	0.748	76%	0.764	S	S	*	*			trans	-68.1	120.9	176.2	-58.8	-169	137.7	0	0	108.6	E281	E279-E281 HydrophobicContact CB-CG 4.1Å; E279-E281 PolarHBondContact O-N 3.27Å
280	E	32.6	Very low	36.9	Very low	200 Å²	200	155.5 Å²	155.5	94%	0.935	79%	0.792	S	S	*	*			trans	-76.1	73	159.9	-70.5	-176.2	165.4	0	0	107.5	A278	A278-E280 PolarHBondContact O-N 2.91Å
281	E	32.6	Very low	36.4	Very low	163 Å²	163	157.1 Å²	157.1	76%	0.762	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-75.6	127.2	160.3	-67.2	-150.6	128.7	0	0	108.5	E279	E279-E281 HydrophobicContact CB-CG 4.1Å; E279-E281 PolarHBondContact O-N 3.27Å
282	E	35.5	Very low	35.9	Very low	190 Å²	190	156.9 Å²	156.9	89%	0.888	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.3	145.9	176.5	-65.8	-175.2	146.5	0	0	110.8	E284	E282-E284 PolarHBondContact O-N 3.49Å
283	E	36.6	Very low	35.9	Very low	190 Å²	190	157.2 Å²	157.2	89%	0.888	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-62.2	116.1	-178.5	-60.6	175.7	156.6	0	0	112.4
284	E	33.6	Very low	35.2	Very low	188 Å²	188	161.3 Å²	161.3	88%	0.879	82%	0.816	S	S	*	*			trans	-135.6	112.2	153.8	-74.9	-73.2	179.9	0	0	108.4	E282	E282-E284 PolarHBondContact O-N 3.49Å
285	E	37.9	Very low	34.9	Very low	192 Å²	192	160.5 Å²	160.5	90%	0.897	81%	0.81	S	S	*	*			trans	-70.8	133	167.6	-62.4	179	131.6	0	0	109.2
286	D	33.2	Very low	35.1	Very low	145 Å²	145	158.9 Å²	158.9	78%	0.775	80%	0.799	S	S	*	*				173.1	143.8	113.7	-156.2	12.4	0	0	0	114.3
287	D	34.7	Very low	35.6	Very low	131 Å²	131	162.4 Å²	162.4	70%	0.701	80%	0.804	S	S	*	*			trans	46.1	102.9	160.5	-98.2	-10.2	0	0	0	124.4
288	E	41.9	Very low	35.7	Very low	167 Å²	167	160.1 Å²	160.1	78%	0.78	79%	0.793	S	S	*	*			trans	25.6	114.9	134.4	-59.7	-170.4	171.7	0	0	121.6
289	K	37.8	Very low	36	Very low	206 Å²	206	164.5 Å²	164.5	90%	0.896	80%	0.8	S	S	*	*				-163.7	133.2	112.2	-111.5	157.1	-168.4	138.3	0	116.2
290	E	43.2	Very low	36.4	Very low	188 Å²	188	165.2 Å²	165.2	88%	0.879	80%	0.803	S	S	*	*			trans	-48.6	131.6	175.1	-54.4	170.2	142.8	0	0	113.6
291	K	39.1	Very low	37.3	Very low	193 Å²	193	159.2 Å²	159.2	84%	0.839	78%	0.775	S	S	*	*			trans	-152	89.3	146.7	-85.5	-122.7	168.2	-144.5	0	111.5
292	E	32.9	Very low	38	Very low	174 Å²	174	158.8 Å²	158.8	81%	0.813	78%	0.777	S	S	*	*			trans	28.4	115.1	147.3	-64.5	176.7	142.9	0	0	118.7	N294	E292-N294 PolarHBondContact O-N 3.21Å
293	D	34.2	Very low	39	Very low	146 Å²	146	151.1 Å²	151.1	78%	0.781	74%	0.741	S	S	*	*			trans	-28.3	124.6	160.8	-67	-69.3	0	0	0	115.3
294	N	29.6	Very low	39.8	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	71%	0.71	S	S	*	*			trans	-144	65.1	137.2	-95.3	-76.2	0	0	0	108.1	E292 S296	E292-N294 PolarHBondContact O-N 3.21Å; N294-S296 PolarHBondContact O-N 3.09Å
295	S	34.2	Very low	41	Very low	92 Å²	92	138.5 Å²	138.5	64%	0.643	68%	0.684	S	S	*	*			trans	-64.7	87.3	153.8	-172.7	0	0	0	0	107.2	E297	S295-E297 PolarHBondContact O-N 3.48Å
296	S	34.9	Very low	42.2	Very low	79 Å²	79	133.8 Å²	133.8	55%	0.552	67%	0.67	S	S	*	*			trans	-76.1	68.5	167.8	70	0	0	0	0	108	N294 E298	N294-S296 PolarHBondContact O-N 3.09Å; S296-E298 PolarHBondContact O-N 3.22Å
297	E	38.8	Very low	44	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.822	67%	0.67	S	S	*	*			trans	-68.9	66.9	161.7	-158.5	163.3	-172.1	0	0	106.6	S295 E299	S295-E297 PolarHBondContact O-N 3.48Å; E297-E299 PolarHBondContact O-N 2.82Å
298	E	38.9	Very low	45.9	Very low	143 Å²	143	130.4 Å²	130.4	67%	0.668	65%	0.646	S	S	*	*			trans	-62.8	102.4	178.6	-75.5	-173.1	139	0	0	107.5	S296 E300	S296-E298 PolarHBondContact O-N 3.22Å; E298-E300 PolarHBondContact O-N 3.32Å
299	E	38.6	Very low	47.7	Very low	174 Å²	174	126.3 Å²	126.3	81%	0.813	62%	0.623	S	S	*	*			trans	4	101.8	166.3	-62	-176.5	159.7	0	0	112.7	E297 E301	E297-E299 PolarHBondContact O-N 2.82Å; E299-E301 PolarHBondContact O-N 2.96Å
300	E	44	Very low	49.8	Very low	175 Å²	175	120.5 Å²	120.5	82%	0.818	60%	0.599	S	S	*	*			trans	-56.4	97.6	158.6	-83.3	-152.3	133.9	0	0	106.5	E298 I302	E298-E300 PolarHBondContact O-N 3.32Å; E300-I302 VanDerWaalsContact C-N 3.31Å; E300-I302 PolarHBondContact O-N 3.32Å
301	E	50.4	Low	51.7	Low	74 Å²	74	114 Å²	114	35%	0.346	57%	0.57	S	S	.	*			trans	-55.4	96.8	-178.8	177.1	-169.8	-134.7	0	0	107	E299 E303 R345	E299-E301 PolarHBondContact O-N 2.96Å; E301-E303 WeakPolarHBondContact O-CA 3.33Å; E301-E303 PolarHBondContact O-N 3.25Å; E301-R345 IonicContact OE2-CZ 2.72Å; E301-R345 IonicContact OE2-NH1 3.92Å; E301-R345 IonicContact OE2-NH2 2.71Å; E301-R345 PolarHBondContact OE2-NH2 2.65Å
302	I	47.6	Very low	54	Low	154 Å²	154	104.8 Å²	104.8	79%	0.79	53%	0.53	S	S	*	.			trans	-43.9	101.8	-166.7	-63.6	172.9	0	0	0	108.3	E300 P304	E300-I302 VanDerWaalsContact C-N 3.31Å; E300-I302 PolarHBondContact O-N 3.32Å; I302-P304 VanDerWaalsContact O-CD 3.32Å; I302-P304 WeakPolarHBondContact O-CD 3.43Å; I302-P304 VanDerWaalsContact O-N 3.07Å
303	E	57.1	Low	56.6	Low	28 Å²	28	98 Å²	98	13%	0.131	50%	0.499	C	S	.	.			trans	-67.2	116.3	-169.8	-76.5	-172.1	167.6	0	0	106.5	E301 F305 R309 N339	E301-E303 WeakPolarHBondContact O-CA 3.33Å; E301-E303 PolarHBondContact O-N 3.25Å; E303-F305 PolarHBondContact O-N 3.38Å; E303-R309 VanDerWaalsContact CD-NH1 3.29Å; E303-R309 IonicContact OE1-NH1 3.75Å; E303-R309 WeakPolarHBondContact OE2-CD 3.45Å; E303-R309 WeakPolarHBondContact OE2-CG 3.34Å; E303-R309 IonicContact OE2-CZ 2.65Å; E303-R309 IonicContact OE2-NE 2.68Å; E303-R309 PolarHBondContact OE2-NE 3.06Å; E303-R309 IonicContact OE2-NH1 2.72Å; E303-R309 PolarHBondContact OE2-NH1 2.97Å; E303-N339 PolarHBondContact OE1-ND2 3.25Å
304	P	52.4	Low	59.1	Low	38 Å²	38	92.9 Å²	92.9	25%	0.247	47%	0.471	C	S	.	.	S	Bend	trans	-69.9	-6.3	-154.9	22.3	-33.3	0	0	0	114.9	I302 L408 P409	I302-P304 VanDerWaalsContact O-CD 3.32Å; I302-P304 WeakPolarHBondContact O-CD 3.43Å; I302-P304 VanDerWaalsContact O-N 3.07Å; P304-L408 HydrophobicContact CG-CD2 3.74Å; P304-P409 VanDerWaalsContact CB-CD 3.42Å; P304-P409 HydrophobicContact CB-CG 3.83Å; P304-P409 HydrophobicContact CG-CG 4.45Å
305	F	58.7	Low	61.9	Low	76 Å²	76	85.7 Å²	85.7	33%	0.333	43%	0.432	S	S	.	.			trans	-140.9	79.3	178.2	-58.3	-73.7	0	0	0	110.1	E303 E307 E308 R309	E303-F305 PolarHBondContact O-N 3.38Å; F305-E307 VanDerWaalsContact C-N 3.32Å; F305-E307 PolarHBondContact O-N 2.73Å; F305-E308 HydrophobicContact CB-CB 3.87Å; F305-E308 PolarHBondContact O-N 3.37Å; F305-E308 VanDerWaalsContact O-N 3.15Å; F305-R309 PolarHBondContact O-N 3.05Å
306	P	64.6	Low	64.5	Low	92 Å²	92	81.3 Å²	81.3	60%	0.597	40%	0.401	S	S	*	.	H	α-helix	trans	-62.6	-37.2	-177.7	23.8	-33.1	0	0	0	112.7	E308 R309 E310	P306-E308 VanDerWaalsContact C-N 3.29Å; P306-E308 PolarHBondContact O-N 2.92Å; P306-R309 PolarHBondContact O-N 3.35Å; P306-E310 PolarHBondContact O-N 2.84Å
307	E	69.7	Low	67	Low	167 Å²	167	80 Å²	80	78%	0.78	39%	0.385	S	S	*	.	H	α-helix	trans	-61.7	-36.2	174.9	-63.9	-176.4	-179.4	0	0	112.2	F305 E310 N311	F305-E307 VanDerWaalsContact C-N 3.32Å; F305-E307 PolarHBondContact O-N 2.73Å; E307-E310 PolarHBondContact O-N 3.44Å; E307-N311 VanDerWaalsContact O-CB 3.28Å; E307-N311 WeakPolarHBondContact O-CB 3.45Å; E307-N311 PolarHBondContact O-N 2.96Å
308	E	75.4	Confident	69.2	Low	39 Å²	39	73.2 Å²	73.2	18%	0.182	35%	0.352	C	S	.	.	H	α-helix	trans	-81.7	-35.1	-178.7	-170.6	157.1	-151.7	0	0	112.7	F305 P306 E310 N311 F312 F404 Q405	F305-E308 HydrophobicContact CB-CB 3.87Å; F305-E308 PolarHBondContact O-N 3.37Å; F305-E308 VanDerWaalsContact O-N 3.15Å; P306-E308 VanDerWaalsContact C-N 3.29Å; P306-E308 PolarHBondContact O-N 2.92Å; E308-E310 VanDerWaalsContact C-N 3.27Å; E308-E310 PolarHBondContact O-N 3.39Å; E308-N311 PolarHBondContact O-N 3.08Å; E308-F312 VanDerWaalsContact O-CB 3.3Å; E308-F312 WeakPolarHBondContact O-CB 3.24Å; E308-F312 PolarHBondContact O-N 3.12Å; E308-F404 HydrophobicContact CG-CB 4.46Å; E308-F404 HydrophobicContact CG-CD1 4.1Å; E308-F404 WeakPolarHBondContact OE1-CA 3.38Å; E308-Q405 PolarHBondContact OE1-N 2.93Å; E308-Q405 WeakPolarHBondContact OE2-CA 3.38Å; E308-Q405 WeakPolarHBondContact OE2-CB 3.33Å; E308-Q405 WeakPolarHBondContact OE2-CG 3.26Å; E308-Q405 PolarHBondContact OE2-N 3.05Å; E308-Q405 VanDerWaalsContact OE2-N 3.16Å
309	R	80.3	Confident	71.4	Confident	81 Å²	81	66.4 Å²	66.4	31%	0.306	32%	0.32	S	S	.	.	H	α-helix	trans	-53.8	-47.5	164.9	175.4	-141.6	177.5	131.6	-17.6	110.1	E303 F305 P306 L313 F341	E303-R309 VanDerWaalsContact CD-NH1 3.29Å; E303-R309 IonicContact OE1-NH1 3.75Å; E303-R309 WeakPolarHBondContact OE2-CD 3.45Å; E303-R309 WeakPolarHBondContact OE2-CG 3.34Å; E303-R309 IonicContact OE2-CZ 2.65Å; E303-R309 IonicContact OE2-NE 2.68Å; E303-R309 PolarHBondContact OE2-NE 3.06Å; E303-R309 IonicContact OE2-NH1 2.72Å; E303-R309 PolarHBondContact OE2-NH1 2.97Å; F305-R309 PolarHBondContact O-N 3.05Å; P306-R309 PolarHBondContact O-N 3.35Å; R309-L313 HydrophobicContact CG-CD1 4.23Å; R309-L313 VanDerWaalsContact O-CG 3.29Å; R309-L313 WeakPolarHBondContact O-CG 3.48Å; R309-L313 PolarHBondContact O-N 3.18Å; R309-F341 HydrophobicContact CB-CD1 3.78Å; R309-F341 HydrophobicContact CB-CE1 3.83Å; R309-F341 HydrophobicContact CB-CG 4.15Å; R309-F341 HydrophobicContact CB-CZ 4.24Å; R309-F341 HydrophobicContact CG-CB 4.07Å; R309-F341 HydrophobicContact CG-CD1 3.68Å; R309-F341 HydrophobicContact CG-CE1 4.26Å; R309-F341 HydrophobicContact CG-CG 3.9Å
310	E	81.5	Confident	73.7	Confident	84 Å²	84	58.2 Å²	58.2	39%	0.393	28%	0.282	S	S	.	.	H	α-helix	trans	-65.4	-48.2	178.6	-158.1	-161.8	153	0	0	111.4	L269 P306 E307 E308 F312 L313 Q314	L269-E310 HydrophobicContact CD1-CG 4.04Å; P306-E310 PolarHBondContact O-N 2.84Å; E307-E310 PolarHBondContact O-N 3.44Å; E308-E310 VanDerWaalsContact C-N 3.27Å; E308-E310 PolarHBondContact O-N 3.39Å; E310-F312 VanDerWaalsContact C-N 3.31Å; E310-F312 PolarHBondContact O-N 2.77Å; E310-L313 CarbonylContact O-C 3.56Å; E310-L313 PolarHBondContact O-N 3.21Å; E310-Q314 HydrophobicContact CG-CG 4.32Å; E310-Q314 WeakPolarHBondContact O-CG 3.4Å; E310-Q314 PolarHBondContact O-N 3.26Å; E310-Q314 PolarHBondContact OE1-NE2 3.05Å
311	N	83.2	Confident	75.7	Confident	50 Å²	50	54.7 Å²	54.7	27%	0.267	27%	0.266	S	S	.	.	H	α-helix	trans	-57	-42.2	178.2	-166.7	-29.9	0	0	0	112.2	K266 E307 E308 Q315	K266-N311 WeakPolarHBondContact CE-OD1 3.28Å; K266-N311 PolarHBondContact NZ-ND2 2.87Å; K266-N311 VanDerWaalsContact NZ-ND2 3.14Å; K266-N311 PolarHBondContact NZ-OD1 2.89Å; K266-N311 VanDerWaalsContact NZ-OD1 3.07Å; E307-N311 VanDerWaalsContact O-CB 3.28Å; E307-N311 WeakPolarHBondContact O-CB 3.45Å; E307-N311 PolarHBondContact O-N 2.96Å; E308-N311 PolarHBondContact O-N 3.08Å; N311-Q315 VanDerWaalsContact O-CG 3.31Å; N311-Q315 WeakPolarHBondContact O-CG 3.29Å; N311-Q315 PolarHBondContact O-N 3.26Å; N311-Q315 VanDerWaalsContact O-N 3.09Å; N311-Q315 PolarHBondContact OD1-NE2 2.87Å
312	F	87.8	Confident	77.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-49	171.2	170.6	-89.9	0	0	0	111.8	E308 E310 Q315 L316 F341 F344 L390 F393 F404	E308-F312 VanDerWaalsContact O-CB 3.3Å; E308-F312 WeakPolarHBondContact O-CB 3.24Å; E308-F312 PolarHBondContact O-N 3.12Å; E310-F312 VanDerWaalsContact C-N 3.31Å; E310-F312 PolarHBondContact O-N 2.77Å; F312-Q315 PolarHBondContact O-N 3.02Å; F312-L316 HydrophobicContact CE1-CD2 3.83Å; F312-L316 HydrophobicContact CZ-CD2 4.11Å; F312-L316 VanDerWaalsContact O-CB 3.25Å; F312-L316 WeakPolarHBondContact O-CB 3.38Å; F312-L316 PolarHBondContact O-N 2.81Å; F312-F341 HydrophobicContact CB-CD2 3.97Å; F312-F341 HydrophobicContact CB-CE2 4.2Å; F312-F341 HydrophobicContact CD1-CB 4.04Å; F312-F341 AromaticContact CD1-CD2 3.63Å; F312-F341 HydrophobicContact CD1-CD2 3.63Å; F312-F341 HydrophobicContact CD1-CG 4.31Å; F312-F341 HydrophobicContact CD2-CD2 4.3Å; F312-F341 HydrophobicContact CE1-CB 4.18Å; F312-F341 HydrophobicContact CE1-CD2 4.18Å; F312-F341 AromaticContact CG-CD2 3.7Å; F312-F341 HydrophobicContact CG-CD2 3.7Å; F312-F341 HydrophobicContact CG-CE2 4.26Å; F312-F344 HydrophobicContact CD2-CD1 4.06Å; F312-F344 HydrophobicContact CD2-CE1 4.27Å; F312-F344 HydrophobicContact CE1-CB 4.39Å; F312-F344 HydrophobicContact CE2-CB 4.04Å; F312-F344 AromaticContact CE2-CD1 3.25Å; F312-F344 HydrophobicContact CE2-CD1 3.25Å; F312-F344 HydrophobicContact CE2-CD2 4.08Å; F312-F344 AromaticContact CE2-CE1 3.61Å; F312-F344 HydrophobicContact CE2-CE1 3.61Å; F312-F344 HydrophobicContact CE2-CE2 4.37Å; F312-F344 AromaticContact CE2-CG 3.52Å; F312-F344 HydrophobicContact CE2-CG 3.52Å; F312-F344 HydrophobicContact CE2-CZ 4.17Å; F312-F344 HydrophobicContact CZ-CB 3.58Å; F312-F344 AromaticContact CZ-CD1 3.76Å; F312-F344 HydrophobicContact CZ-CD1 3.76Å; F312-F344 HydrophobicContact CZ-CD2 4.12Å; F312-F344 HydrophobicContact CZ-CE1 4.48Å; F312-F344 AromaticContact CZ-CG 3.55Å; F312-F344 HydrophobicContact CZ-CG 3.55Å; F312-L390 HydrophobicContact CZ-CD2 3.94Å; F312-F393 AromaticContact CD2-CE1 3.76Å; F312-F393 HydrophobicContact CD2-CE1 3.76Å; F312-F393 AromaticContact CE2-CD1 3.88Å; F312-F393 HydrophobicContact CE2-CD1 3.88Å; F312-F393 AromaticContact CE2-CE1 3.46Å; F312-F393 HydrophobicContact CE2-CE1 3.46Å; F312-F393 VanDerWaalsContact CE2-CE1 3.46Å; F312-F393 HydrophobicContact CZ-CD1 4.35Å; F312-F393 HydrophobicContact CZ-CE1 4.24Å; F312-F404 HydrophobicContact CB-CD1 4.1Å; F312-F404 HydrophobicContact CB-CE1 3.85Å; F312-F404 HydrophobicContact CB-CZ 4.37Å; F312-F404 HydrophobicContact CD2-CD1 4.43Å; F312-F404 HydrophobicContact CD2-CD2 4.21Å; F312-F404 HydrophobicContact CD2-CE1 4.22Å; F312-F404 AromaticContact CD2-CE2 3.99Å; F312-F404 HydrophobicContact CD2-CE2 3.99Å; F312-F404 HydrophobicContact CD2-CG 4.42Å; F312-F404 AromaticContact CD2-CZ 3.99Å; F312-F404 HydrophobicContact CD2-CZ 3.99Å
313	L	87.5	Confident	78.5	Confident	32 Å²	32	46.9 Å²	46.9	17%	0.168	23%	0.226	C	C	.	.	H	α-helix	trans	-65.2	-43.5	180	-69.4	171.3	0	0	0	111.8	L269 R309 E310 Q315 L316 Y317 L340	L269-L313 HydrophobicContact CD1-CB 3.79Å; R309-L313 HydrophobicContact CG-CD1 4.23Å; R309-L313 VanDerWaalsContact O-CG 3.29Å; R309-L313 WeakPolarHBondContact O-CG 3.48Å; R309-L313 PolarHBondContact O-N 3.18Å; E310-L313 CarbonylContact O-C 3.56Å; E310-L313 PolarHBondContact O-N 3.21Å; L313-Q315 VanDerWaalsContact C-N 3.31Å; L313-Q315 PolarHBondContact O-N 3.42Å; L313-L316 PolarHBondContact O-N 3.29Å; L313-Y317 HydrophobicContact CD2-CE2 4.37Å; L313-Y317 WeakPolarHBondContact O-CB 3.29Å; L313-Y317 VanDerWaalsContact O-CD2 3.24Å; L313-Y317 WeakPolarHBondContact O-CD2 3.35Å; L313-Y317 PolarHBondContact O-N 2.81Å; L313-L340 HydrophobicContact CD2-CB 4.33Å
314	Q	86.8	Confident	79.4	Confident	39 Å²	39	47.5 Å²	47.5	18%	0.182	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-42.5	176.7	-68.7	-179.6	-1.3	0	0	111.8	K266 T267 L269 E310 K318	K266-Q314 HydrophobicContact CB-CB 4.09Å; T267-Q314 PolarHBondContact N-O 3.03Å; T267-Q314 VanDerWaalsContact N-O 3.09Å; T267-Q314 WeakPolarHBondContact O-CB 3.42Å; T267-Q314 VanDerWaalsContact O-CG 3.29Å; T267-Q314 WeakPolarHBondContact O-CG 3.44Å; L269-Q314 HydrophobicContact CD1-CG 3.76Å; L269-Q314 HydrophobicContact CG-CG 3.9Å; E310-Q314 HydrophobicContact CG-CG 4.32Å; E310-Q314 WeakPolarHBondContact O-CG 3.4Å; E310-Q314 PolarHBondContact O-N 3.26Å; E310-Q314 PolarHBondContact OE1-NE2 3.05Å; Q314-K318 WeakPolarHBondContact O-CB 3.44Å; Q314-K318 PolarHBondContact O-N 3.36Å
315	Q	87.4	Confident	80.8	Confident	7 Å²	7	48.7 Å²	48.7	3%	0.033	25%	0.247	C	C	.	.	H	α-helix	trans	-69.4	-45	175.7	-72.9	-179.4	53.1	0	0	112.6	I261 K266 N311 F312 L313 Y317 K318 F319 F393 F404	I261-Q315 VanDerWaalsContact CD1-CD 3.41Å; I261-Q315 HydrophobicContact CG2-CG 4.3Å; K266-Q315 HydrophobicContact CG-CG 4.13Å; N311-Q315 VanDerWaalsContact O-CG 3.31Å; N311-Q315 WeakPolarHBondContact O-CG 3.29Å; N311-Q315 PolarHBondContact O-N 3.26Å; N311-Q315 VanDerWaalsContact O-N 3.09Å; N311-Q315 PolarHBondContact OD1-NE2 2.87Å; F312-Q315 PolarHBondContact O-N 3.02Å; L313-Q315 VanDerWaalsContact C-N 3.31Å; L313-Q315 PolarHBondContact O-N 3.42Å; Q315-Y317 PolarHBondContact O-N 3.2Å; Q315-K318 PolarHBondContact O-N 3.05Å; Q315-F319 WeakPolarHBondContact O-CB 3.25Å; Q315-F319 PolarHBondContact O-N 2.92Å; Q315-F393 HydrophobicContact CB-CE2 4Å; Q315-F393 HydrophobicContact CB-CZ 3.88Å; Q315-F404 VanDerWaalsContact NE2-CE1 3.34Å
316	L	88.8	Confident	81.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-46	-180	175.9	63.1	0	0	0	110.9	F312 L313 K318 F319 M320 L340 L390 F393	F312-L316 HydrophobicContact CE1-CD2 3.83Å; F312-L316 HydrophobicContact CZ-CD2 4.11Å; F312-L316 VanDerWaalsContact O-CB 3.25Å; F312-L316 WeakPolarHBondContact O-CB 3.38Å; F312-L316 PolarHBondContact O-N 2.81Å; L313-L316 PolarHBondContact O-N 3.29Å; L316-K318 PolarHBondContact O-N 3.2Å; L316-F319 PolarHBondContact O-N 3.06Å; L316-M320 HydrophobicContact CD1-CG 4.07Å; L316-M320 HydrophobicContact CG-CG 4.47Å; L316-M320 WeakPolarHBondContact O-CB 3.15Å; L316-M320 WeakPolarHBondContact O-CG 3.47Å; L316-M320 PolarHBondContact O-N 3.24Å; L316-L340 HydrophobicContact CD2-CB 4.21Å; L316-L340 HydrophobicContact CD2-CD1 3.93Å; L316-L390 HydrophobicContact CD1-CD2 4.21Å; L316-L390 HydrophobicContact CD2-CD2 3.66Å; L316-F393 HydrophobicContact CB-CE2 4.47Å; L316-F393 HydrophobicContact CB-CZ 4.46Å; L316-F393 HydrophobicContact CD1-CB 3.57Å; L316-F393 HydrophobicContact CD1-CD1 3.96Å; L316-F393 HydrophobicContact CD1-CD2 4.01Å; L316-F393 HydrophobicContact CD1-CG 3.56Å
317	Y	87.3	Confident	82.6	Confident	52 Å²	52	44.1 Å²	44.1	20%	0.204	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-40.7	177.3	-86.4	-112.3	0	0	0	111.5	L269 L313 Q315 M320 E321 I327	L269-Y317 HydrophobicContact CD2-CG 4.41Å; L313-Y317 HydrophobicContact CD2-CE2 4.37Å; L313-Y317 WeakPolarHBondContact O-CB 3.29Å; L313-Y317 VanDerWaalsContact O-CD2 3.24Å; L313-Y317 WeakPolarHBondContact O-CD2 3.35Å; L313-Y317 PolarHBondContact O-N 2.81Å; Q315-Y317 PolarHBondContact O-N 3.2Å; Y317-M320 PolarHBondContact O-N 2.91Å; Y317-E321 PolarHBondContact O-N 2.91Å; Y317-I327 HydrophobicContact CD1-CB 4.2Å; Y317-I327 HydrophobicContact CE1-CB 3.81Å; Y317-I327 HydrophobicContact CE1-CG2 3.97Å; Y317-I327 WeakPolarHBondContact CE1-O 3.42Å; Y317-I327 HydrophobicContact CE2-CD1 4.45Å
318	K	85.3	Confident	82.9	Confident	32 Å²	32	43 Å²	43	14%	0.139	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-46.2	175	-167.7	77	-168.1	90.2	0	112.2	W265 T267 Q314 Q315 L316 M320 E321 D322	W265-K318 WeakPolarHBondContact O-CB 3.38Å; W265-K318 WeakPolarHBondContact O-CG 3.42Å; T267-K318 VanDerWaalsContact OG1-CA 3.31Å; T267-K318 WeakPolarHBondContact OG1-CA 3.5Å; T267-K318 WeakPolarHBondContact OG1-CB 3.23Å; T267-K318 WeakPolarHBondContact OG1-CD 3.45Å; T267-K318 PolarHBondContact OG1-N 3.4Å; Q314-K318 WeakPolarHBondContact O-CB 3.44Å; Q314-K318 PolarHBondContact O-N 3.36Å; Q315-K318 PolarHBondContact O-N 3.05Å; L316-K318 PolarHBondContact O-N 3.2Å; K318-M320 VanDerWaalsContact C-N 3.29Å; K318-M320 PolarHBondContact O-N 3.47Å; K318-E321 IonicContact NZ-OE2 2.79Å; K318-E321 PolarHBondContact NZ-OE2 2.88Å; K318-E321 WeakPolarHBondContact O-CB 3.41Å; K318-E321 PolarHBondContact O-N 2.93Å; K318-D322 IonicContact NZ-OD1 2.59Å; K318-D322 PolarHBondContact NZ-OD1 3.21Å; K318-D322 IonicContact NZ-OD2 2.72Å; K318-D322 WeakPolarHBondContact O-CB 3.37Å; K318-D322 VanDerWaalsContact O-CG 3.27Å; K318-D322 PolarHBondContact O-N 3.48Å
319	F	85.6	Confident	83	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-42.8	176.5	175.1	-97.9	0	0	0	111.7	C201 F222 Q315 L316 D322 R323 G392 F393 Y396	C201-F319 HydrophobicContact CB-CE2 4.27Å; C201-F319 HydrophobicContact CB-CZ 4.39Å; C201-F319 WeakPolarHBondContact O-CZ 3.47Å; F222-F319 HydrophobicContact CE2-CD2 4.2Å; F222-F319 HydrophobicContact CE2-CE2 4.26Å; F222-F319 AromaticContact CZ-CD2 3.78Å; F222-F319 HydrophobicContact CZ-CD2 3.78Å; F222-F319 AromaticContact CZ-CE2 3.72Å; F222-F319 HydrophobicContact CZ-CE2 3.72Å; Q315-F319 WeakPolarHBondContact O-CB 3.25Å; Q315-F319 PolarHBondContact O-N 2.92Å; L316-F319 PolarHBondContact O-N 3.06Å; F319-D322 PolarHBondContact O-N 2.98Å; F319-R323 WeakPolarHBondContact O-CG 3.3Å; F319-R323 PolarHBondContact O-N 3.31Å; F319-R323 VanDerWaalsContact O-N 3.08Å; F319-G392 VanDerWaalsContact CE1-C 3.48Å; F319-G392 WeakPolarHBondContact CZ-O 3.22Å; F319-F393 HydrophobicContact CB-CD2 3.8Å; F319-F393 HydrophobicContact CB-CE2 4.2Å; F319-F393 HydrophobicContact CD1-CB 3.92Å; F319-F393 AromaticContact CD1-CD2 3.85Å; F319-F393 HydrophobicContact CD1-CD2 3.85Å; F319-F393 HydrophobicContact CD1-CG 4.39Å; F319-F393 HydrophobicContact CD2-CD2 4.38Å; F319-F393 HydrophobicContact CE1-CB 4.01Å; F319-F393 AromaticContact CG-CD2 3.75Å; F319-F393 HydrophobicContact CG-CD2 3.75Å; F319-Y396 HydrophobicContact CD2-CD1 4.04Å; F319-Y396 AromaticContact CD2-CG 3.99Å; F319-Y396 HydrophobicContact CD2-CG 3.99Å; F319-Y396 HydrophobicContact CE2-CD1 4.34Å; F319-Y396 HydrophobicContact CE2-CD2 4.3Å; F319-Y396 AromaticContact CE2-CG 3.83Å; F319-Y396 HydrophobicContact CE2-CG 3.83Å
320	M	86.9	Confident	83	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-69.6	-33.1	179	-69.2	-69.7	-86	0	0	112.7	L316 Y317 K318 T325 I327 Y389	L316-M320 HydrophobicContact CD1-CG 4.07Å; L316-M320 HydrophobicContact CG-CG 4.47Å; L316-M320 WeakPolarHBondContact O-CB 3.15Å; L316-M320 WeakPolarHBondContact O-CG 3.47Å; L316-M320 PolarHBondContact O-N 3.24Å; Y317-M320 PolarHBondContact O-N 2.91Å; K318-M320 VanDerWaalsContact C-N 3.29Å; K318-M320 PolarHBondContact O-N 3.47Å; M320-T325 CarbonylContact O-C 3.5Å; M320-T325 WeakPolarHBondContact O-CA 3.43Å; M320-T325 PolarHBondContact O-N 3.49Å; M320-I327 HydrophobicContact CB-CD1 4.4Å; M320-I327 HydrophobicContact CB-CG1 4.08Å; M320-I327 HydrophobicContact CE-CD1 3.96Å; M320-I327 HydrophobicContact CE-CG1 3.91Å; M320-I327 HydrophobicContact CG-CD1 4.03Å; M320-I327 HydrophobicContact CG-CG1 4.19Å; M320-Y389 HydrophobicContact CE-CD1 3.82Å
321	E	84.7	Confident	83.2	Confident	101 Å²	101	48.2 Å²	48.2	47%	0.472	24%	0.243	S	C	.	.	H	α-helix	trans	-66.6	-49.2	168.4	-176.8	-175.6	-132.5	0	0	111.7	Y317 K318 R323 G324	Y317-E321 PolarHBondContact O-N 2.91Å; K318-E321 IonicContact NZ-OE2 2.79Å; K318-E321 PolarHBondContact NZ-OE2 2.88Å; K318-E321 WeakPolarHBondContact O-CB 3.41Å; K318-E321 PolarHBondContact O-N 2.93Å; E321-R323 VanDerWaalsContact C-N 3.26Å; E321-R323 PolarHBondContact O-N 3.44Å; E321-G324 PolarHBondContact O-N 3.07Å
322	D	81.3	Confident	83.4	Confident	42 Å²	42	50.4 Å²	50.4	23%	0.225	26%	0.258	C	S	.	.	H	α-helix	trans	-64.8	-25.7	-175.6	-72.9	-18	0	0	0	113.6	R215 F222 K318 F319	R215-D322 IonicContact CZ-OD2 3.83Å; R215-D322 IonicContact NE-OD2 3.19Å; R215-D322 IonicContact NH2-OD2 3.96Å; R215-D322 PolarHBondContact NH2-OD2 3.27Å; F222-D322 HydrophobicContact CD2-CB 4.26Å; F222-D322 HydrophobicContact CE2-CB 3.94Å; K318-D322 IonicContact NZ-OD1 2.59Å; K318-D322 PolarHBondContact NZ-OD1 3.21Å; K318-D322 IonicContact NZ-OD2 2.72Å; K318-D322 WeakPolarHBondContact O-CB 3.37Å; K318-D322 VanDerWaalsContact O-CG 3.27Å; K318-D322 PolarHBondContact O-N 3.48Å; F319-D322 PolarHBondContact O-N 2.98Å
323	R	76.6	Confident	83.4	Confident	22 Å²	22	51.2 Å²	51.2	8%	0.083	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	7.7	174.5	76.9	-177.1	-74.8	-172.5	6.3	114.9	D203 F319 E321 T325	D203-R323 IonicContact OD2-CZ 3.52Å; D203-R323 IonicContact OD2-NH2 3.6Å; D203-R323 PolarHBondContact OD2-NH2 2.96Å; F319-R323 WeakPolarHBondContact O-CG 3.3Å; F319-R323 PolarHBondContact O-N 3.31Å; F319-R323 VanDerWaalsContact O-N 3.08Å; E321-R323 VanDerWaalsContact C-N 3.26Å; E321-R323 PolarHBondContact O-N 3.44Å; R323-T325 WeakPolarHBondContact CG-OG1 3.5Å; R323-T325 PolarHBondContact O-N 3.21Å
324	G	75.4	Confident	83.2	Confident	41 Å²	41	51 Å²	51	42%	0.423	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	6.7	178	0	0	0	0	0	115.9	E321 P326	E321-G324 PolarHBondContact O-N 3.07Å; G324-P326 VanDerWaalsContact O-CD 3.3Å; G324-P326 WeakPolarHBondContact O-CD 3.42Å
325	T	81.4	Confident	83.1	Confident	62 Å²	62	59.4 Å²	59.4	38%	0.38	30%	0.3	S	S	.	.			trans	-119.3	56.1	-179	65.1	0	0	0	0	113.5	M320 R323	M320-T325 CarbonylContact O-C 3.5Å; M320-T325 WeakPolarHBondContact O-CA 3.43Å; M320-T325 PolarHBondContact O-N 3.49Å; R323-T325 WeakPolarHBondContact CG-OG1 3.5Å; R323-T325 PolarHBondContact O-N 3.21Å
326	P	80.8	Confident	83	Confident	57 Å²	57	64.3 Å²	64.3	37%	0.37	32%	0.318	S	S	.	.			trans	-63	138.5	-172.4	26.2	-35.6	0	0	0	113	G324 N328	G324-P326 VanDerWaalsContact O-CD 3.3Å; G324-P326 WeakPolarHBondContact O-CD 3.42Å; P326-N328 VanDerWaalsContact C-N 3.27Å; P326-N328 PolarHBondContact O-N 3.33Å
327	I	80.7	Confident	82.9	Confident	16 Å²	16	69 Å²	69	8%	0.082	34%	0.343	C	S	.	.			trans	-81.4	73.8	177.5	-54	-178.5	0	0	0	109.4	Y317 M320 K329 P331 L340 Y389	Y317-I327 HydrophobicContact CD1-CB 4.2Å; Y317-I327 HydrophobicContact CE1-CB 3.81Å; Y317-I327 HydrophobicContact CE1-CG2 3.97Å; Y317-I327 WeakPolarHBondContact CE1-O 3.42Å; Y317-I327 HydrophobicContact CE2-CD1 4.45Å; M320-I327 HydrophobicContact CB-CD1 4.4Å; M320-I327 HydrophobicContact CB-CG1 4.08Å; M320-I327 HydrophobicContact CE-CD1 3.96Å; M320-I327 HydrophobicContact CE-CG1 3.91Å; M320-I327 HydrophobicContact CG-CD1 4.03Å; M320-I327 HydrophobicContact CG-CG1 4.19Å; I327-K329 VanDerWaalsContact CG2-O 3.24Å; I327-K329 WeakPolarHBondContact CG2-O 3.4Å; I327-K329 PolarHBondContact O-N 3.02Å; I327-P331 HydrophobicContact CG2-CG 4.19Å; I327-L340 HydrophobicContact CD1-CD1 4.05Å; I327-Y389 HydrophobicContact CD1-CD1 3.93Å; I327-Y389 HydrophobicContact CG1-CD1 4.19Å; I327-Y389 HydrophobicContact CG1-CE1 4.42Å
328	N	76.5	Confident	82.9	Confident	142 Å²	142	67.1 Å²	67.1	76%	0.759	34%	0.336	S	S	*	.			trans	-68.7	-12.6	-179.2	-65	-29	0	0	0	114.3	P326	P326-N328 VanDerWaalsContact C-N 3.27Å; P326-N328 PolarHBondContact O-N 3.33Å
329	K	77.6	Confident	83.1	Confident	182 Å²	182	67.9 Å²	67.9	79%	0.791	34%	0.342	S	S	*	.	S	Bend	trans	-145	141.7	175	-65.7	-165.9	175.9	-161.2	0	108.9	I327	I327-K329 VanDerWaalsContact CG2-O 3.24Å; I327-K329 WeakPolarHBondContact CG2-O 3.4Å; I327-K329 PolarHBondContact O-N 3.02Å
330	R	80.1	Confident	83.4	Confident	124 Å²	124	68.1 Å²	68.1	47%	0.468	34%	0.343	S	S	.	.			trans	-52.5	129.8	174.1	-66.3	-173.2	-176.3	-167.2	2.9	109.4	S273	S273-R330 PolarHBondContact O-NH2 2.86Å; S273-R330 PolarHBondContact OG-NH2 2.92Å
331	P	86.4	Confident	83.5	Confident	8 Å²	8	68.3 Å²	68.3	5%	0.052	34%	0.344	C	S	.	.			trans	-63.3	139	176.5	-23	35.4	0	0	0	110.6	I327 L338 L340 Y389	I327-P331 HydrophobicContact CG2-CG 4.19Å; P331-L338 HydrophobicContact CB-CB 4.22Å; P331-L338 HydrophobicContact CB-CD2 4.24Å; P331-L338 VanDerWaalsContact O-CB 3.28Å; P331-L338 WeakPolarHBondContact O-CB 3.21Å; P331-L338 PolarHBondContact O-N 3.29Å; P331-L340 HydrophobicContact CG-CD1 4.21Å; P331-L340 HydrophobicContact CG-CD2 4.32Å; P331-Y389 HydrophobicContact CB-CD2 4.16Å; P331-Y389 HydrophobicContact CB-CE1 4.41Å; P331-Y389 HydrophobicContact CB-CE2 3.72Å; P331-Y389 HydrophobicContact CG-CD1 3.99Å; P331-Y389 HydrophobicContact CG-CD2 4.11Å; P331-Y389 HydrophobicContact CG-CE1 3.76Å; P331-Y389 HydrophobicContact CG-CE2 3.92Å; P331-Y389 HydrophobicContact CG-CG 4.17Å
332	V	86.6	Confident	83.8	Confident	96 Å²	96	65.5 Å²	65.5	58%	0.582	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.5	178.8	178.2	0	0	0	0	108.7	R336	V332-R336 WeakPolarHBondContact CA-O 3.48Å; V332-R336 WeakPolarHBondContact CG1-O 3.46Å
333	L	88.1	Confident	84.3	Confident	18 Å²	18	63.5 Å²	63.5	9%	0.094	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	126.6	179.6	-171.6	67	0	0	0	109.2	Y335 R336 L338 Y366 I371 N381 V382	L333-Y335 VanDerWaalsContact C-N 3.25Å; L333-Y335 PolarHBondContact O-N 3.06Å; L333-R336 PolarHBondContact N-O 3.39Å; L333-R336 PolarHBondContact O-N 3.33Å; L333-R336 VanDerWaalsContact O-O 3.12Å; L333-L338 HydrophobicContact CB-CB 4.33Å; L333-L338 HydrophobicContact CB-CD1 4.22Å; L333-L338 HydrophobicContact CD2-CD1 3.9Å; L333-Y366 HydrophobicContact CD1-CE2 4.37Å; L333-Y366 HydrophobicContact CD2-CD2 4.13Å; L333-Y366 HydrophobicContact CD2-CE2 3.87Å; L333-Y366 HydrophobicContact CG-CE2 3.91Å; L333-I371 HydrophobicContact CB-CD1 4.18Å; L333-I371 HydrophobicContact CD2-CD1 4.04Å; L333-I371 HydrophobicContact CG-CD1 4.23Å; L333-N381 HydrophobicContact CD1-CB 3.89Å; L333-V382 HydrophobicContact CD2-CB 4.05Å; L333-V382 HydrophobicContact CD2-CG2 4.41Å
334	G	82.9	Confident	85	Confident	27 Å²	27	62.7 Å²	62.7	28%	0.278	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	35.6	-179.2	0	0	0	0	0	114.1	R336 Y366	G334-R336 PolarHBondContact O-N 3.42Å; G334-Y366 WeakPolarHBondContact CA-OH 3.4Å
335	Y	84.3	Confident	85.7	Confident	215 Å²	215	61.6 Å²	61.6	84%	0.843	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	7.9	-175.1	-48.8	-85.3	0	0	0	115.7	L333	L333-Y335 VanDerWaalsContact C-N 3.25Å; L333-Y335 PolarHBondContact O-N 3.06Å
336	R	85.1	Confident	86.2	Confident	110 Å²	110	59.7 Å²	59.7	42%	0.415	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	152	171.5	-66.7	-175.2	171.9	-162.9	-12.5	110.7	V332 L333 G334 L338 G370	V332-R336 WeakPolarHBondContact CA-O 3.48Å; V332-R336 WeakPolarHBondContact CG1-O 3.46Å; L333-R336 PolarHBondContact N-O 3.39Å; L333-R336 PolarHBondContact O-N 3.33Å; L333-R336 VanDerWaalsContact O-O 3.12Å; G334-R336 PolarHBondContact O-N 3.42Å; R336-L338 PolarHBondContact O-N 3.05Å; R336-G370 PolarHBondContact NH1-O 2.87Å
337	N	86.8	Confident	86.7	Confident	98 Å²	98	57 Å²	57	52%	0.524	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	129.3	170.3	-77.4	-47.5	0	0	0	109.5	N339	N337-N339 PolarHBondContact O-N 2.95Å
338	L	89	Confident	87.1	Confident	13 Å²	13	60.9 Å²	60.9	7%	0.068	29%	0.287	C	S	.	.			trans	-81.9	111.6	-178.2	-177.5	62.5	0	0	0	110.3	P331 L333 R336 L340 L343 L369 I371 A385	P331-L338 HydrophobicContact CB-CB 4.22Å; P331-L338 HydrophobicContact CB-CD2 4.24Å; P331-L338 VanDerWaalsContact O-CB 3.28Å; P331-L338 WeakPolarHBondContact O-CB 3.21Å; P331-L338 PolarHBondContact O-N 3.29Å; L333-L338 HydrophobicContact CB-CB 4.33Å; L333-L338 HydrophobicContact CB-CD1 4.22Å; L333-L338 HydrophobicContact CD2-CD1 3.9Å; R336-L338 PolarHBondContact O-N 3.05Å; L338-L340 HydrophobicContact CD2-CD2 4.05Å; L338-L340 HydrophobicContact CG-CD2 4.34Å; L338-L340 PolarHBondContact O-N 2.89Å; L338-L343 HydrophobicContact CD1-CD2 4.19Å; L338-L343 HydrophobicContact CD2-CD2 4.01Å; L338-L343 HydrophobicContact CG-CD2 4.39Å; L338-L369 HydrophobicContact CD1-CD1 3.77Å; L338-I371 HydrophobicContact CD1-CD1 4.42Å; L338-A385 HydrophobicContact CD2-CB 3.94Å
339	N	89.6	Confident	87.7	Confident	48 Å²	48	62.6 Å²	62.6	26%	0.257	29%	0.288	S	S	.	.			trans	-70.9	100.6	169.5	-176.3	-22.8	0	0	0	109.6	E303 N337 F341 K342 L343	E303-N339 PolarHBondContact OE1-ND2 3.25Å; N337-N339 PolarHBondContact O-N 2.95Å; N339-F341 PolarHBondContact OD1-N 3.27Å; N339-F341 VanDerWaalsContact OD1-N 3.12Å; N339-K342 HydrophobicContact CB-CB 3.99Å; N339-K342 VanDerWaalsContact CG-CB 3.47Å; N339-K342 PolarHBondContact OD1-N 3.19Å; N339-L343 WeakPolarHBondContact O-CB 3.46Å; N339-L343 PolarHBondContact O-N 2.53Å
340	L	91.4	Very high	88.3	Confident	6 Å²	6	57.7 Å²	57.7	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-65.3	-35.4	-178.6	-69.2	173.1	0	0	0	112.7	L313 L316 I327 P331 L338 F344 Y389 L390	L313-L340 HydrophobicContact CD2-CB 4.33Å; L316-L340 HydrophobicContact CD2-CB 4.21Å; L316-L340 HydrophobicContact CD2-CD1 3.93Å; I327-L340 HydrophobicContact CD1-CD1 4.05Å; P331-L340 HydrophobicContact CG-CD1 4.21Å; P331-L340 HydrophobicContact CG-CD2 4.32Å; L338-L340 HydrophobicContact CD2-CD2 4.05Å; L338-L340 HydrophobicContact CG-CD2 4.34Å; L338-L340 PolarHBondContact O-N 2.89Å; L340-F344 VanDerWaalsContact O-CB 3.32Å; L340-F344 WeakPolarHBondContact O-CB 3.27Å; L340-F344 PolarHBondContact O-N 2.96Å; L340-Y389 HydrophobicContact CD2-CG 4.45Å; L340-L390 HydrophobicContact CB-CD2 4.39Å; L340-L390 HydrophobicContact CD2-CD1 4.41Å; L340-L390 HydrophobicContact CD2-CD2 4.41Å; L340-L390 HydrophobicContact CD2-CG 4.32Å
341	F	89.1	Confident	88.5	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-70.1	-47.1	178.4	180	-113.8	0	0	0	111.3	R309 F312 N339 L343 F344 R345 M406	R309-F341 HydrophobicContact CB-CD1 3.78Å; R309-F341 HydrophobicContact CB-CE1 3.83Å; R309-F341 HydrophobicContact CB-CG 4.15Å; R309-F341 HydrophobicContact CB-CZ 4.24Å; R309-F341 HydrophobicContact CG-CB 4.07Å; R309-F341 HydrophobicContact CG-CD1 3.68Å; R309-F341 HydrophobicContact CG-CE1 4.26Å; R309-F341 HydrophobicContact CG-CG 3.9Å; F312-F341 HydrophobicContact CB-CD2 3.97Å; F312-F341 HydrophobicContact CB-CE2 4.2Å; F312-F341 HydrophobicContact CD1-CB 4.04Å; F312-F341 AromaticContact CD1-CD2 3.63Å; F312-F341 HydrophobicContact CD1-CD2 3.63Å; F312-F341 HydrophobicContact CD1-CG 4.31Å; F312-F341 HydrophobicContact CD2-CD2 4.3Å; F312-F341 HydrophobicContact CE1-CB 4.18Å; F312-F341 HydrophobicContact CE1-CD2 4.18Å; F312-F341 AromaticContact CG-CD2 3.7Å; F312-F341 HydrophobicContact CG-CD2 3.7Å; F312-F341 HydrophobicContact CG-CE2 4.26Å; N339-F341 PolarHBondContact OD1-N 3.27Å; N339-F341 VanDerWaalsContact OD1-N 3.12Å; F341-L343 VanDerWaalsContact C-N 3.33Å; F341-L343 PolarHBondContact O-N 2.81Å; F341-F344 PolarHBondContact O-N 2.94Å; F341-R345 WeakPolarHBondContact O-CB 3.07Å; F341-R345 PolarHBondContact O-N 3.4Å; F341-M406 HydrophobicContact CE2-CG 4.23Å; F341-M406 HydrophobicContact CZ-CG 4.47Å
342	K	89.9	Confident	88.7	Confident	43 Å²	43	53.4 Å²	53.4	19%	0.187	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-41.6	174.7	-170.1	176.1	-179.6	-177	0	111.7	N339 L346 D368 L369	N339-K342 HydrophobicContact CB-CB 3.99Å; N339-K342 VanDerWaalsContact CG-CB 3.47Å; N339-K342 PolarHBondContact OD1-N 3.19Å; K342-L346 HydrophobicContact CG-CD1 4.21Å; K342-L346 WeakPolarHBondContact O-CB 3.36Å; K342-L346 WeakPolarHBondContact O-CD1 3.27Å; K342-L346 VanDerWaalsContact O-CG 3.23Å; K342-L346 WeakPolarHBondContact O-CG 3.41Å; K342-L346 PolarHBondContact O-N 2.81Å; K342-D368 WeakPolarHBondContact CE-O 3.46Å; K342-D368 PolarHBondContact NZ-O 2.81Å; K342-D368 VanDerWaalsContact NZ-O 3.09Å; K342-L369 HydrophobicContact CB-CD2 4.2Å; K342-L369 HydrophobicContact CD-CD2 4.35Å; K342-L369 HydrophobicContact CG-CD2 4.11Å
343	L	92.1	Very high	88.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-45.5	174.1	174	56.4	0	0	0	111.9	L338 N339 F341 L346 V347 V365 L369 V382 Y386 L390	L338-L343 HydrophobicContact CD1-CD2 4.19Å; L338-L343 HydrophobicContact CD2-CD2 4.01Å; L338-L343 HydrophobicContact CG-CD2 4.39Å; N339-L343 WeakPolarHBondContact O-CB 3.46Å; N339-L343 PolarHBondContact O-N 2.53Å; F341-L343 VanDerWaalsContact C-N 3.33Å; F341-L343 PolarHBondContact O-N 2.81Å; L343-L346 PolarHBondContact O-N 3.02Å; L343-V347 HydrophobicContact CD1-CG2 4.12Å; L343-V347 PolarHBondContact O-N 2.88Å; L343-V347 VanDerWaalsContact O-N 3.14Å; L343-V365 HydrophobicContact CD1-CG1 3.62Å; L343-L369 HydrophobicContact CB-CD1 4.43Å; L343-L369 HydrophobicContact CB-CD2 4.01Å; L343-L369 HydrophobicContact CD1-CD1 4.19Å; L343-V382 HydrophobicContact CD1-CG2 3.52Å; L343-V382 HydrophobicContact CD2-CG2 4.23Å; L343-Y386 HydrophobicContact CD1-CD2 3.86Å; L343-Y386 HydrophobicContact CD2-CD2 4.08Å; L343-Y386 HydrophobicContact CG-CD2 3.72Å; L343-Y386 HydrophobicContact CG-CE2 4.26Å; L343-L390 HydrophobicContact CB-CD1 4.09Å; L343-L390 HydrophobicContact CD2-CD1 3.69Å; L343-L390 HydrophobicContact CG-CD1 3.64Å
344	F	91.6	Very high	88.8	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-60.3	-49.9	176.9	-172.8	-106	0	0	0	111.6	F312 L340 F341 L346 V347 H348 Y386 L390 E394 F404 M406	F312-F344 HydrophobicContact CD2-CD1 4.06Å; F312-F344 HydrophobicContact CD2-CE1 4.27Å; F312-F344 HydrophobicContact CE1-CB 4.39Å; F312-F344 HydrophobicContact CE2-CB 4.04Å; F312-F344 AromaticContact CE2-CD1 3.25Å; F312-F344 HydrophobicContact CE2-CD1 3.25Å; F312-F344 HydrophobicContact CE2-CD2 4.08Å; F312-F344 AromaticContact CE2-CE1 3.61Å; F312-F344 HydrophobicContact CE2-CE1 3.61Å; F312-F344 HydrophobicContact CE2-CE2 4.37Å; F312-F344 AromaticContact CE2-CG 3.52Å; F312-F344 HydrophobicContact CE2-CG 3.52Å; F312-F344 HydrophobicContact CE2-CZ 4.17Å; F312-F344 HydrophobicContact CZ-CB 3.58Å; F312-F344 AromaticContact CZ-CD1 3.76Å; F312-F344 HydrophobicContact CZ-CD1 3.76Å; F312-F344 HydrophobicContact CZ-CD2 4.12Å; F312-F344 HydrophobicContact CZ-CE1 4.48Å; F312-F344 AromaticContact CZ-CG 3.55Å; F312-F344 HydrophobicContact CZ-CG 3.55Å; L340-F344 VanDerWaalsContact O-CB 3.32Å; L340-F344 WeakPolarHBondContact O-CB 3.27Å; L340-F344 PolarHBondContact O-N 2.96Å; F341-F344 PolarHBondContact O-N 2.94Å; F344-L346 PolarHBondContact O-N 3.23Å; F344-V347 PolarHBondContact O-N 3.09Å; F344-H348 VanDerWaalsContact O-CB 3.25Å; F344-H348 WeakPolarHBondContact O-CB 3.34Å; F344-H348 PolarHBondContact O-N 2.91Å; F344-Y386 HydrophobicContact CD2-CE2 4.5Å; F344-Y386 VanDerWaalsContact CD2-OH 3.25Å; F344-Y386 WeakPolarHBondContact CD2-OH 3.36Å; F344-L390 HydrophobicContact CB-CD1 4.1Å; F344-L390 HydrophobicContact CB-CD2 4.35Å; F344-L390 HydrophobicContact CD2-CB 4.47Å; F344-L390 HydrophobicContact CD2-CD2 4.35Å; F344-E394 HydrophobicContact CE2-CB 3.92Å; F344-E394 HydrophobicContact CE2-CG 4.05Å; F344-F404 HydrophobicContact CE1-CD2 4.49Å; F344-M406 HydrophobicContact CD1-CE 4.34Å; F344-M406 HydrophobicContact CD1-SD 3.33Å; F344-M406 WeakPolarHBondContact CD1-SD 3.35Å; F344-M406 HydrophobicContact CE1-CE 3.79Å; F344-M406 HydrophobicContact CE1-SD 3.39Å; F344-M406 WeakPolarHBondContact CE1-SD 3.48Å
345	R	90.6	Very high	89.1	Confident	18 Å²	18	56.6 Å²	56.6	7%	0.068	27%	0.273	C	S	.	.	H	α-helix	trans	-53.2	-46.9	174.9	178.3	179.4	85.6	-176.3	11.9	112.8	E301 F341 K349 M406	E301-R345 IonicContact OE2-CZ 2.72Å; E301-R345 IonicContact OE2-NH1 3.92Å; E301-R345 IonicContact OE2-NH2 2.71Å; E301-R345 PolarHBondContact OE2-NH2 2.65Å; F341-R345 WeakPolarHBondContact O-CB 3.07Å; F341-R345 PolarHBondContact O-N 3.4Å; R345-K349 WeakPolarHBondContact O-CB 2.98Å; R345-K349 PolarHBondContact O-N 3.13Å; R345-M406 HydrophobicContact CB-CB 4.46Å; R345-M406 WeakPolarHBondContact CD-O 3.39Å; R345-M406 HydrophobicContact CG-CB 4.16Å; R345-M406 WeakPolarHBondContact CG-O 3.07Å
346	L	91.3	Very high	89.4	Confident	23 Å²	23	46.6 Å²	46.6	12%	0.12	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-46.3	-178.8	-74.7	167.3	0	0	0	112	K342 L343 F344 L350 V365 D368 L369	K342-L346 HydrophobicContact CG-CD1 4.21Å; K342-L346 WeakPolarHBondContact O-CB 3.36Å; K342-L346 WeakPolarHBondContact O-CD1 3.27Å; K342-L346 VanDerWaalsContact O-CG 3.23Å; K342-L346 WeakPolarHBondContact O-CG 3.41Å; K342-L346 PolarHBondContact O-N 2.81Å; L343-L346 PolarHBondContact O-N 3.02Å; F344-L346 PolarHBondContact O-N 3.23Å; L346-L350 WeakPolarHBondContact O-CD1 3.44Å; L346-L350 WeakPolarHBondContact O-CG 3.36Å; L346-L350 PolarHBondContact O-N 2.94Å; L346-V365 HydrophobicContact CB-CG1 4.13Å; L346-V365 HydrophobicContact CD1-CG1 4.3Å; L346-D368 HydrophobicContact CD1-CB 3.76Å; L346-D368 HydrophobicContact CD2-CB 3.77Å; L346-D368 HydrophobicContact CG-CB 4.43Å; L346-L369 HydrophobicContact CD1-CD2 4.06Å; L346-L369 HydrophobicContact CD1-CG 4.06Å
347	V	91.9	Very high	89.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-70.8	-40	178.7	169.6	0	0	0	0	111.7	L343 F344 K349 L350 G351 G352 I356 W362 V365 Y386	L343-V347 HydrophobicContact CD1-CG2 4.12Å; L343-V347 PolarHBondContact O-N 2.88Å; L343-V347 VanDerWaalsContact O-N 3.14Å; F344-V347 PolarHBondContact O-N 3.09Å; V347-K349 VanDerWaalsContact C-N 3.34Å; V347-K349 PolarHBondContact O-N 2.92Å; V347-L350 CarbonylContact O-C 3.49Å; V347-L350 WeakPolarHBondContact O-CA 3.43Å; V347-L350 WeakPolarHBondContact O-CB 3.43Å; V347-L350 PolarHBondContact O-N 3.01Å; V347-G351 PolarHBondContact O-N 3.29Å; V347-G352 PolarHBondContact O-N 2.95Å; V347-I356 HydrophobicContact CB-CD1 4.23Å; V347-I356 HydrophobicContact CG1-CD1 3.82Å; V347-I356 HydrophobicContact CG2-CD1 4.1Å; V347-W362 HydrophobicContact CG1-CH2 4.2Å; V347-W362 HydrophobicContact CG2-CH2 3.82Å; V347-W362 HydrophobicContact CG2-CZ3 3.6Å; V347-V365 HydrophobicContact CG2-CG1 4.22Å; V347-V365 HydrophobicContact CG2-CG2 4.49Å; V347-Y386 HydrophobicContact CB-CD2 4.02Å; V347-Y386 HydrophobicContact CB-CE2 3.39Å; V347-Y386 HydrophobicContact CG1-CD2 4.2Å; V347-Y386 HydrophobicContact CG1-CE1 4.13Å; V347-Y386 HydrophobicContact CG1-CE2 3.58Å; V347-Y386 HydrophobicContact CG2-CD2 3.6Å; V347-Y386 HydrophobicContact CG2-CE2 3.52Å; V347-Y386 HydrophobicContact CG2-CG 4.48Å
348	H	89.2	Confident	89.6	Confident	97 Å²	97	47.8 Å²	47.8	45%	0.449	25%	0.248	S	C	.	.	H	α-helix	trans	-61	-41.3	175.8	-172.7	-84.6	0	0	0	112	F344 L350 G351 M406	F344-H348 VanDerWaalsContact O-CB 3.25Å; F344-H348 WeakPolarHBondContact O-CB 3.34Å; F344-H348 PolarHBondContact O-N 2.91Å; H348-L350 PolarHBondContact O-N 3.36Å; H348-G351 PolarHBondContact O-N 2.6Å; H348-M406 HydrophobicContact CB-CE 4.12Å; H348-M406 HydrophobicContact CB-SD 4.24Å; H348-M406 VanDerWaalsContact CG-CE 3.46Å; H348-M406 WeakPolarHBondContact ND1-CE 3.44Å
349	K	88.8	Confident	89.5	Confident	178 Å²	178	49.5 Å²	49.5	77%	0.774	27%	0.268	S	S	*	.	H	α-helix	trans	-60.8	-25.4	174	-175.5	177.4	179.3	-177.7	0	113.2	R345 V347 G351	R345-K349 WeakPolarHBondContact O-CB 2.98Å; R345-K349 PolarHBondContact O-N 3.13Å; V347-K349 VanDerWaalsContact C-N 3.34Å; V347-K349 PolarHBondContact O-N 2.92Å; K349-G351 VanDerWaalsContact C-N 3.33Å
350	L	89	Confident	89.6	Confident	79 Å²	79	50.5 Å²	50.5	41%	0.414	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	7.2	176.7	-65.4	166.4	0	0	0	112.9	L346 V347 H348 I356 V361 V365	L346-L350 WeakPolarHBondContact O-CD1 3.44Å; L346-L350 WeakPolarHBondContact O-CG 3.36Å; L346-L350 PolarHBondContact O-N 2.94Å; V347-L350 CarbonylContact O-C 3.49Å; V347-L350 WeakPolarHBondContact O-CA 3.43Å; V347-L350 WeakPolarHBondContact O-CB 3.43Å; V347-L350 PolarHBondContact O-N 3.01Å; H348-L350 PolarHBondContact O-N 3.36Å; L350-I356 HydrophobicContact CB-CD1 3.76Å; L350-I356 HydrophobicContact CB-CG1 4.1Å; L350-I356 HydrophobicContact CD1-CD1 3.87Å; L350-I356 HydrophobicContact CG-CD1 4.49Å; L350-V361 HydrophobicContact CD1-CG1 3.68Å; L350-V361 HydrophobicContact CD2-CG1 4.33Å; L350-V365 HydrophobicContact CD1-CG2 3.53Å
351	G	85.3	Confident	89.7	Confident	41 Å²	41	52.6 Å²	52.6	42%	0.423	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	9.3	178.2	0	0	0	0	0	115.3	V347 H348 K349 N355	V347-G351 PolarHBondContact O-N 3.29Å; H348-G351 PolarHBondContact O-N 2.6Å; K349-G351 VanDerWaalsContact C-N 3.33Å; G351-N355 PolarHBondContact O-ND2 3.31Å
352	G	89.4	Confident	89.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.01	30%	0.295	C	S	.	.			trans	90.4	173.1	-177.9	0	0	0	0	0	113.6	V347 D354 N355 I356 E394	V347-G352 PolarHBondContact O-N 2.95Å; G352-D354 VanDerWaalsContact C-N 3.33Å; G352-D354 PolarHBondContact O-N 3.21Å; G352-N355 PolarHBondContact O-N 3.24Å; G352-I356 WeakPolarHBondContact O-CG1 3.11Å; G352-E394 WeakPolarHBondContact CA-OE1 3.23Å
353	F	89.6	Confident	90	Very high	18 Å²	18	54.7 Å²	54.7	8%	0.079	31%	0.305	C	S	.	.	S	Bend	trans	-58	-42.2	-171.1	-179.4	-93.8	0	0	0	113.8	N355 I356 W362 K383 Y386 K387 Y391 E394	F353-N355 VanDerWaalsContact C-N 3.32Å; F353-N355 PolarHBondContact O-N 3.46Å; F353-I356 PolarHBondContact O-N 2.82Å; F353-I356 VanDerWaalsContact O-N 3.13Å; F353-W362 AromaticContact CD2-CH2 3.51Å; F353-W362 HydrophobicContact CD2-CH2 3.51Å; F353-W362 AromaticContact CD2-CZ2 3.55Å; F353-W362 HydrophobicContact CD2-CZ2 3.55Å; F353-W362 AromaticContact CE2-CH2 3.94Å; F353-W362 HydrophobicContact CE2-CH2 3.94Å; F353-W362 AromaticContact CE2-CZ2 3.77Å; F353-W362 HydrophobicContact CE2-CZ2 3.77Å; F353-W362 HydrophobicContact CG-CH2 4.47Å; F353-W362 HydrophobicContact CG-CZ2 4.32Å; F353-K383 HydrophobicContact CE2-CG 3.75Å; F353-K383 HydrophobicContact CZ-CD 4.48Å; F353-K383 HydrophobicContact CZ-CG 4.01Å; F353-Y386 HydrophobicContact CB-CD1 4.12Å; F353-Y386 HydrophobicContact CB-CE1 3.88Å; F353-Y386 AromaticContact CD2-CD1 3.45Å; F353-Y386 HydrophobicContact CD2-CD1 3.45Å; F353-Y386 VanDerWaalsContact CD2-CD1 3.45Å; F353-Y386 HydrophobicContact CD2-CE1 4.11Å; F353-Y386 HydrophobicContact CD2-CG 4.12Å; F353-Y386 HydrophobicContact CE2-CD1 4.26Å; F353-Y386 HydrophobicContact CG-CD1 4.17Å; F353-Y386 HydrophobicContact CG-CE1 4.42Å; F353-K387 HydrophobicContact CE2-CB 4Å; F353-K387 HydrophobicContact CZ-CB 4.02Å; F353-K387 HydrophobicContact CZ-CD 4.12Å; F353-K387 HydrophobicContact CZ-CG 4.38Å; F353-Y391 HydrophobicContact CB-CD2 3.72Å; F353-Y391 HydrophobicContact CB-CE2 4.21Å; F353-Y391 AromaticContact CD1-CD2 3.52Å; F353-Y391 HydrophobicContact CD1-CD2 3.52Å; F353-Y391 AromaticContact CD1-CE2 3.61Å; F353-Y391 HydrophobicContact CD1-CE2 3.61Å; F353-Y391 HydrophobicContact CD2-CD2 4.41Å; F353-Y391 HydrophobicContact CE1-CD2 4.22Å; F353-Y391 HydrophobicContact CE1-CE2 4.31Å; F353-Y391 AromaticContact CG-CD2 3.63Å; F353-Y391 HydrophobicContact CG-CD2 3.63Å; F353-Y391 HydrophobicContact CG-CE2 4.14Å; F353-E394 WeakPolarHBondContact CB-OE2 3.23Å; F353-E394 PolarHBondContact N-OE1 3.13Å; F353-E394 VanDerWaalsContact N-OE1 3.16Å; F353-E394 PolarHBondContact N-OE2 2.67Å; F353-E394 VanDerWaalsContact N-OE2 3.07Å
354	D	87.8	Confident	90	Very high	69 Å²	69	59 Å²	59	37%	0.369	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-29.4	-171	-53.3	-55.7	0	0	0	112.5	G352 I356 Y391 R398	G352-D354 VanDerWaalsContact C-N 3.33Å; G352-D354 PolarHBondContact O-N 3.21Å; D354-I356 PolarHBondContact O-N 3.36Å; D354-Y391 WeakPolarHBondContact OD1-CE2 3.31Å; D354-R398 IonicContact OD2-CZ 3.71Å; D354-R398 IonicContact OD2-NH1 4Å; D354-R398 PolarHBondContact OD2-NH1 3.25Å; D354-R398 IonicContact OD2-NH2 3.68Å; D354-R398 PolarHBondContact OD2-NH2 3.38Å
355	N	89.3	Confident	90.1	Very high	122 Å²	122	58.9 Å²	58.9	65%	0.652	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-7.9	175.2	-75.2	-60.1	0	0	0	113.2	G351 G352 F353	G351-N355 PolarHBondContact O-ND2 3.31Å; G352-N355 PolarHBondContact O-N 3.24Å; F353-N355 VanDerWaalsContact C-N 3.32Å; F353-N355 PolarHBondContact O-N 3.46Å
356	I	91.1	Very high	90.2	Very high	5 Å²	5	58.3 Å²	58.3	3%	0.026	32%	0.323	C	S	.	.			trans	-106	80.2	-179.7	-45.5	175.4	0	0	0	111.5	V347 L350 G352 F353 D354 V361 W362 K383	V347-I356 HydrophobicContact CB-CD1 4.23Å; V347-I356 HydrophobicContact CG1-CD1 3.82Å; V347-I356 HydrophobicContact CG2-CD1 4.1Å; L350-I356 HydrophobicContact CB-CD1 3.76Å; L350-I356 HydrophobicContact CB-CG1 4.1Å; L350-I356 HydrophobicContact CD1-CD1 3.87Å; L350-I356 HydrophobicContact CG-CD1 4.49Å; G352-I356 WeakPolarHBondContact O-CG1 3.11Å; F353-I356 PolarHBondContact O-N 2.82Å; F353-I356 VanDerWaalsContact O-N 3.13Å; D354-I356 PolarHBondContact O-N 3.36Å; I356-V361 HydrophobicContact CG2-CB 3.7Å; I356-V361 HydrophobicContact CG2-CG1 3.58Å; I356-W362 HydrophobicContact CB-CZ2 3.75Å; I356-W362 HydrophobicContact CD1-CH2 4.17Å; I356-W362 HydrophobicContact CD1-CZ2 4.09Å; I356-W362 HydrophobicContact CG1-CZ2 4.45Å; I356-W362 HydrophobicContact CG2-CD2 4.1Å; I356-W362 HydrophobicContact CG2-CG 4.11Å; I356-W362 HydrophobicContact CG2-CZ2 4.07Å; I356-W362 PolarHBondContact O-NE1 2.96Å; I356-K383 PolarHBondContact O-NZ 2.91Å
357	E	86.4	Confident	90.2	Very high	171 Å²	171	61.3 Å²	61.3	80%	0.799	34%	0.336	S	S	*	.			trans	-76.3	-40.3	171.3	-61.1	-172.9	160.4	0	0	112.2	G359	E357-G359 PolarHBondContact O-N 2.91Å
358	S	89.2	Confident	90.2	Very high	62 Å²	62	64.5 Å²	64.5	43%	0.434	35%	0.353	S	S	.	.			trans	-71.1	120.1	-170.6	-179.8	0	0	0	0	113.5	A360 V361 W362	S358-A360 PolarHBondContact O-N 3.03Å; S358-A360 VanDerWaalsContact O-N 3.15Å; S358-A360 PolarHBondContact OG-N 2.72Å; S358-V361 PolarHBondContact O-N 2.9Å; S358-W362 PolarHBondContact O-N 2.98Å
359	G	87.6	Confident	90.2	Very high	48 Å²	48	60.9 Å²	60.9	50%	0.495	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-20.9	173.4	0	0	0	0	0	114.3	E357 K363	E357-G359 PolarHBondContact O-N 2.91Å; G359-K363 PolarHBondContact O-N 2.92Å
360	A	90.3	Very high	90.1	Very high	69 Å²	69	53.8 Å²	53.8	57%	0.57	32%	0.315	S	S	*	.	H	α-helix	trans	-70.5	-37.5	173.3	0	0	0	0	0	111.9	S358 K363 Q364	S358-A360 PolarHBondContact O-N 3.03Å; S358-A360 VanDerWaalsContact O-N 3.15Å; S358-A360 PolarHBondContact OG-N 2.72Å; A360-K363 WeakPolarHBondContact O-CB 3.38Å; A360-K363 PolarHBondContact O-N 2.89Å; A360-Q364 PolarHBondContact O-N 3.2Å
361	V	93.5	Very high	90	Very high	51 Å²	51	50.5 Å²	50.5	31%	0.309	30%	0.298	S	S	.	.	H	α-helix	trans	-69.2	-41.7	175.9	179.7	0	0	0	0	110.3	L350 I356 S358 K363 Q364 V365	L350-V361 HydrophobicContact CD1-CG1 3.68Å; L350-V361 HydrophobicContact CD2-CG1 4.33Å; I356-V361 HydrophobicContact CG2-CB 3.7Å; I356-V361 HydrophobicContact CG2-CG1 3.58Å; S358-V361 PolarHBondContact O-N 2.9Å; V361-K363 VanDerWaalsContact C-N 3.26Å; V361-K363 PolarHBondContact O-N 2.82Å; V361-Q364 WeakPolarHBondContact O-CA 3.37Å; V361-Q364 WeakPolarHBondContact O-CB 3.21Å; V361-Q364 PolarHBondContact O-N 3.03Å; V361-V365 WeakPolarHBondContact O-CG2 3.41Å; V361-V365 PolarHBondContact O-N 3.08Å
362	W	94.1	Very high	90.1	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-36.4	170.8	-72.6	105.4	0	0	0	112.9	V347 F353 I356 S358 V365 Y366 G379 V382 K383 Y386	V347-W362 HydrophobicContact CG1-CH2 4.2Å; V347-W362 HydrophobicContact CG2-CH2 3.82Å; V347-W362 HydrophobicContact CG2-CZ3 3.6Å; F353-W362 AromaticContact CD2-CH2 3.51Å; F353-W362 HydrophobicContact CD2-CH2 3.51Å; F353-W362 AromaticContact CD2-CZ2 3.55Å; F353-W362 HydrophobicContact CD2-CZ2 3.55Å; F353-W362 AromaticContact CE2-CH2 3.94Å; F353-W362 HydrophobicContact CE2-CH2 3.94Å; F353-W362 AromaticContact CE2-CZ2 3.77Å; F353-W362 HydrophobicContact CE2-CZ2 3.77Å; F353-W362 HydrophobicContact CG-CH2 4.47Å; F353-W362 HydrophobicContact CG-CZ2 4.32Å; I356-W362 HydrophobicContact CB-CZ2 3.75Å; I356-W362 HydrophobicContact CD1-CH2 4.17Å; I356-W362 HydrophobicContact CD1-CZ2 4.09Å; I356-W362 HydrophobicContact CG1-CZ2 4.45Å; I356-W362 HydrophobicContact CG2-CD2 4.1Å; I356-W362 HydrophobicContact CG2-CG 4.11Å; I356-W362 HydrophobicContact CG2-CZ2 4.07Å; I356-W362 PolarHBondContact O-NE1 2.96Å; S358-W362 PolarHBondContact O-N 2.98Å; W362-V365 PolarHBondContact O-N 3.47Å; W362-Y366 PolarHBondContact O-N 2.76Å; W362-Y366 VanDerWaalsContact O-N 3.09Å; W362-G379 WeakPolarHBondContact CB-O 3.19Å; W362-V382 HydrophobicContact CB-CG1 4.29Å; W362-V382 HydrophobicContact CE3-CG1 4.09Å; W362-V382 VanDerWaalsContact O-CG1 3.22Å; W362-V382 WeakPolarHBondContact O-CG1 3.15Å; W362-K383 HydrophobicContact CD2-CB 3.76Å; W362-K383 HydrophobicContact CD2-CD 4.35Å; W362-K383 HydrophobicContact CD2-CG 4.02Å; W362-K383 HydrophobicContact CE3-CB 4.07Å; W362-K383 HydrophobicContact CG-CB 4.03Å; W362-K383 HydrophobicContact CG-CD 4.36Å; W362-K383 HydrophobicContact CG-CG 4.43Å; W362-K383 HydrophobicContact CZ2-CD 4.44Å; W362-K383 HydrophobicContact CZ2-CG 4.03Å; W362-Y386 HydrophobicContact CH2-CD1 4.49Å; W362-Y386 HydrophobicContact CH2-CD2 4.44Å; W362-Y386 HydrophobicContact CH2-CG 4.09Å; W362-Y386 HydrophobicContact CZ3-CD2 4.36Å; W362-Y386 HydrophobicContact CZ3-CG 4.23Å
363	K	91.9	Very high	90	Very high	91 Å²	91	53.8 Å²	53.8	40%	0.396	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-36.3	172.9	-170.1	-171.6	178.2	-168.4	0	112.1	G359 A360 V361 Y366 Q367	G359-K363 PolarHBondContact O-N 2.92Å; A360-K363 WeakPolarHBondContact O-CB 3.38Å; A360-K363 PolarHBondContact O-N 2.89Å; V361-K363 VanDerWaalsContact C-N 3.26Å; V361-K363 PolarHBondContact O-N 2.82Å; K363-Y366 WeakPolarHBondContact O-CB 2.99Å; K363-Y366 PolarHBondContact O-N 3.15Å; K363-Q367 WeakPolarHBondContact O-CG 3.33Å; K363-Q367 PolarHBondContact O-N 2.79Å
364	Q	92.9	Very high	89.7	Confident	92 Å²	92	59.2 Å²	59.2	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-47.4	173.3	-171.1	62.5	53.9	0	0	111.1	A360 V361 Y366 Q367 D368	A360-Q364 PolarHBondContact O-N 3.2Å; V361-Q364 WeakPolarHBondContact O-CA 3.37Å; V361-Q364 WeakPolarHBondContact O-CB 3.21Å; V361-Q364 PolarHBondContact O-N 3.03Å; Q364-Y366 PolarHBondContact O-N 3.41Å; Q364-Q367 CarbonylContact O-C 3.59Å; Q364-Q367 WeakPolarHBondContact O-CA 3.44Å; Q364-Q367 WeakPolarHBondContact O-CB 3.31Å; Q364-Q367 PolarHBondContact O-N 2.91Å; Q364-D368 PolarHBondContact NE2-OD1 2.9Å; Q364-D368 VanDerWaalsContact O-CG 3.29Å; Q364-D368 PolarHBondContact O-N 2.87Å
365	V	93.4	Very high	89.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-56.1	-37.8	175.1	174.5	0	0	0	0	111.6	L343 L346 V347 L350 V361 W362 Q367 D368 L369 V382	L343-V365 HydrophobicContact CD1-CG1 3.62Å; L346-V365 HydrophobicContact CB-CG1 4.13Å; L346-V365 HydrophobicContact CD1-CG1 4.3Å; V347-V365 HydrophobicContact CG2-CG1 4.22Å; V347-V365 HydrophobicContact CG2-CG2 4.49Å; L350-V365 HydrophobicContact CD1-CG2 3.53Å; V361-V365 WeakPolarHBondContact O-CG2 3.41Å; V361-V365 PolarHBondContact O-N 3.08Å; W362-V365 PolarHBondContact O-N 3.47Å; V365-Q367 VanDerWaalsContact C-N 3.34Å; V365-Q367 PolarHBondContact O-N 2.87Å; V365-D368 PolarHBondContact O-N 3.02Å; V365-L369 WeakPolarHBondContact O-CG 3.4Å; V365-L369 PolarHBondContact O-N 2.56Å; V365-L369 VanDerWaalsContact O-N 3.09Å; V365-V382 HydrophobicContact CG1-CG2 4.24Å
366	Y	92	Very high	89.4	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.027	35%	0.352	C	S	.	.	H	α-helix	trans	-63.3	-37.1	174.2	-165.9	-77	0	0	0	112.9	L333 G334 W362 K363 Q364 I371 V373 A378 V382	L333-Y366 HydrophobicContact CD1-CE2 4.37Å; L333-Y366 HydrophobicContact CD2-CD2 4.13Å; L333-Y366 HydrophobicContact CD2-CE2 3.87Å; L333-Y366 HydrophobicContact CG-CE2 3.91Å; G334-Y366 WeakPolarHBondContact CA-OH 3.4Å; W362-Y366 PolarHBondContact O-N 2.76Å; W362-Y366 VanDerWaalsContact O-N 3.09Å; K363-Y366 WeakPolarHBondContact O-CB 2.99Å; K363-Y366 PolarHBondContact O-N 3.15Å; Q364-Y366 PolarHBondContact O-N 3.41Å; Y366-I371 HydrophobicContact CD1-CB 3.97Å; Y366-I371 HydrophobicContact CD1-CG2 4.36Å; Y366-I371 WeakPolarHBondContact CD1-O 3.48Å; Y366-I371 HydrophobicContact CE1-CB 3.55Å; Y366-I371 HydrophobicContact CE1-CG2 3.45Å; Y366-I371 VanDerWaalsContact CE1-CG2 3.45Å; Y366-I371 VanDerWaalsContact CE1-O 3.29Å; Y366-I371 WeakPolarHBondContact CE1-O 3.33Å; Y366-I371 PolarHBondContact O-N 2.57Å; Y366-I371 WeakPolarHBondContact OH-CG2 3.44Å; Y366-V373 HydrophobicContact CD1-CG2 3.72Å; Y366-V373 HydrophobicContact CE1-CG2 4.19Å; Y366-A378 HydrophobicContact CD1-CB 3.88Å; Y366-A378 HydrophobicContact CD2-CB 3.8Å; Y366-A378 WeakPolarHBondContact CD2-O 3.44Å; Y366-A378 HydrophobicContact CE1-CB 3.93Å; Y366-A378 HydrophobicContact CE2-CB 3.87Å; Y366-A378 HydrophobicContact CG-CB 3.81Å; Y366-V382 HydrophobicContact CD2-CB 3.99Å; Y366-V382 HydrophobicContact CD2-CG1 4.08Å
367	Q	91.4	Very high	89.2	Confident	86 Å²	86	61.5 Å²	61.5	40%	0.402	37%	0.367	S	S	.	.	H	α-helix	trans	-72.3	-43.5	176	-69.5	175.3	-23.4	0	0	111.6	K363 Q364 V365 L369 G370 V373	K363-Q367 WeakPolarHBondContact O-CG 3.33Å; K363-Q367 PolarHBondContact O-N 2.79Å; Q364-Q367 CarbonylContact O-C 3.59Å; Q364-Q367 WeakPolarHBondContact O-CA 3.44Å; Q364-Q367 WeakPolarHBondContact O-CB 3.31Å; Q364-Q367 PolarHBondContact O-N 2.91Å; V365-Q367 VanDerWaalsContact C-N 3.34Å; V365-Q367 PolarHBondContact O-N 2.87Å; Q367-L369 PolarHBondContact O-N 3.21Å; Q367-G370 WeakPolarHBondContact O-CA 3.24Å; Q367-G370 PolarHBondContact O-N 2.81Å; Q367-V373 HydrophobicContact CG-CG2 3.48Å; Q367-V373 VanDerWaalsContact CG-CG2 3.48Å
368	D	91.1	Very high	89.4	Confident	67 Å²	67	53.4 Å²	53.4	36%	0.358	33%	0.329	S	S	.	.	H	α-helix	trans	-66.1	-23.7	179.9	-61.2	-10.3	0	0	0	112.4	K342 L346 Q364 V365 G370	K342-D368 WeakPolarHBondContact CE-O 3.46Å; K342-D368 PolarHBondContact NZ-O 2.81Å; K342-D368 VanDerWaalsContact NZ-O 3.09Å; L346-D368 HydrophobicContact CD1-CB 3.76Å; L346-D368 HydrophobicContact CD2-CB 3.77Å; L346-D368 HydrophobicContact CG-CB 4.43Å; Q364-D368 PolarHBondContact NE2-OD1 2.9Å; Q364-D368 VanDerWaalsContact O-CG 3.29Å; Q364-D368 PolarHBondContact O-N 2.87Å; V365-D368 PolarHBondContact O-N 3.02Å; D368-G370 PolarHBondContact O-N 2.82Å
369	L	89.9	Confident	89.5	Confident	20 Å²	20	50.7 Å²	50.7	11%	0.105	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.7	167.5	-78.1	174.6	0	0	0	113.9	L338 K342 L343 L346 V365 Q367 I371 V382	L338-L369 HydrophobicContact CD1-CD1 3.77Å; K342-L369 HydrophobicContact CB-CD2 4.2Å; K342-L369 HydrophobicContact CD-CD2 4.35Å; K342-L369 HydrophobicContact CG-CD2 4.11Å; L343-L369 HydrophobicContact CB-CD1 4.43Å; L343-L369 HydrophobicContact CB-CD2 4.01Å; L343-L369 HydrophobicContact CD1-CD1 4.19Å; L346-L369 HydrophobicContact CD1-CD2 4.06Å; L346-L369 HydrophobicContact CD1-CG 4.06Å; V365-L369 WeakPolarHBondContact O-CG 3.4Å; V365-L369 PolarHBondContact O-N 2.56Å; V365-L369 VanDerWaalsContact O-N 3.09Å; Q367-L369 PolarHBondContact O-N 3.21Å; L369-I371 HydrophobicContact CB-CD1 4.08Å; L369-I371 HydrophobicContact CB-CG1 4Å; L369-I371 HydrophobicContact CD1-CD1 4.13Å; L369-V382 HydrophobicContact CD1-CG2 4.21Å
370	G	86.4	Confident	89.6	Confident	30 Å²	30	56 Å²	56	31%	0.309	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	28	-174.5	0	0	0	0	0	113	R336 Q367 D368	R336-G370 PolarHBondContact NH1-O 2.87Å; Q367-G370 WeakPolarHBondContact O-CA 3.24Å; Q367-G370 PolarHBondContact O-N 2.81Å; D368-G370 PolarHBondContact O-N 2.82Å
371	I	88.2	Confident	89.7	Confident	10 Å²	10	55.4 Å²	55.4	5%	0.051	31%	0.305	C	S	.	.			trans	-103.2	122.7	178.7	-50.7	174.6	0	0	0	109.1	L333 L338 Y366 L369 V373	L333-I371 HydrophobicContact CB-CD1 4.18Å; L333-I371 HydrophobicContact CD2-CD1 4.04Å; L333-I371 HydrophobicContact CG-CD1 4.23Å; L338-I371 HydrophobicContact CD1-CD1 4.42Å; Y366-I371 HydrophobicContact CD1-CB 3.97Å; Y366-I371 HydrophobicContact CD1-CG2 4.36Å; Y366-I371 WeakPolarHBondContact CD1-O 3.48Å; Y366-I371 HydrophobicContact CE1-CB 3.55Å; Y366-I371 HydrophobicContact CE1-CG2 3.45Å; Y366-I371 VanDerWaalsContact CE1-CG2 3.45Å; Y366-I371 VanDerWaalsContact CE1-O 3.29Å; Y366-I371 WeakPolarHBondContact CE1-O 3.33Å; Y366-I371 PolarHBondContact O-N 2.57Å; Y366-I371 WeakPolarHBondContact OH-CG2 3.44Å; L369-I371 HydrophobicContact CB-CD1 4.08Å; L369-I371 HydrophobicContact CB-CG1 4Å; L369-I371 HydrophobicContact CD1-CD1 4.13Å; I371-V373 PolarHBondContact O-N 3.18Å
372	P	86.1	Confident	89.7	Confident	61 Å²	61	53 Å²	53	40%	0.396	29%	0.29	S	S	.	.			trans	-56.3	127.4	178.9	-28.2	36	0	0	0	112.8	L374	P372-L374 VanDerWaalsContact C-N 3.32Å; P372-L374 HydrophobicContact CB-CD2 4.1Å; P372-L374 HydrophobicContact CB-CG 4.29Å; P372-L374 PolarHBondContact O-N 3.06Å
373	V	87.1	Confident	89.6	Confident	49 Å²	49	56 Å²	56	30%	0.297	30%	0.303	S	S	.	.			trans	-79.8	81.6	179	-179.6	0	0	0	0	109.7	Y366 Q367 I371 A378	Y366-V373 HydrophobicContact CD1-CG2 3.72Å; Y366-V373 HydrophobicContact CE1-CG2 4.19Å; Q367-V373 HydrophobicContact CG-CG2 3.48Å; Q367-V373 VanDerWaalsContact CG-CG2 3.48Å; I371-V373 PolarHBondContact O-N 3.18Å; V373-A378 HydrophobicContact CG1-CB 3.93Å; V373-A378 HydrophobicContact CG2-CB 4.46Å
374	L	84.3	Confident	89.6	Confident	132 Å²	132	54.1 Å²	54.1	69%	0.691	30%	0.301	S	S	*	.			trans	-79	-15.9	-179	-57.9	179.9	0	0	0	113.9	P372	P372-L374 VanDerWaalsContact C-N 3.32Å; P372-L374 HydrophobicContact CB-CD2 4.1Å; P372-L374 HydrophobicContact CB-CG 4.29Å; P372-L374 PolarHBondContact O-N 3.06Å
375	N	84.3	Confident	89.6	Confident	79 Å²	79	50.2 Å²	50.2	42%	0.422	29%	0.285	S	S	.	.	S	Bend	trans	-149	163	-179.8	62.7	54.9	0	0	0	112.6	A377 A378	N375-A377 PolarHBondContact O-N 3.26Å; N375-A377 WeakPolarHBondContact OD1-CA 3.37Å; N375-A377 WeakPolarHBondContact OD1-CB 3.37Å; N375-A377 PolarHBondContact OD1-N 3.42Å; N375-A378 WeakPolarHBondContact O-CB 3.01Å; N375-A378 PolarHBondContact O-N 3.28Å; N375-A378 PolarHBondContact OD1-N 3.15Å
376	S	85.7	Confident	89.6	Confident	125 Å²	125	50.2 Å²	50.2	87%	0.874	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-20.4	176.6	50.4	0	0	0	0	113.8	A378	S376-A378 VanDerWaalsContact C-N 3.28Å; S376-A378 PolarHBondContact O-N 3.06Å
377	A	88.4	Confident	89.5	Confident	40 Å²	40	56.1 Å²	56.1	33%	0.331	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-3.9	179.2	0	0	0	0	0	113.9	N375 G379 Y380 N381	N375-A377 PolarHBondContact O-N 3.26Å; N375-A377 WeakPolarHBondContact OD1-CA 3.37Å; N375-A377 WeakPolarHBondContact OD1-CB 3.37Å; N375-A377 PolarHBondContact OD1-N 3.42Å; A377-G379 VanDerWaalsContact C-N 3.35Å; A377-G379 PolarHBondContact O-N 2.94Å; A377-Y380 WeakPolarHBondContact O-CB 3.28Å; A377-Y380 PolarHBondContact O-N 2.9Å; A377-N381 VanDerWaalsContact O-CG 3.29Å; A377-N381 PolarHBondContact O-N 2.77Å; A377-N381 PolarHBondContact O-ND2 2.97Å
378	A	90.1	Very high	89.4	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-47.9	-51	-179.1	0	0	0	0	0	113.3	Y366 V373 N375 S376 Y380 N381 V382	Y366-A378 HydrophobicContact CD1-CB 3.88Å; Y366-A378 HydrophobicContact CD2-CB 3.8Å; Y366-A378 WeakPolarHBondContact CD2-O 3.44Å; Y366-A378 HydrophobicContact CE1-CB 3.93Å; Y366-A378 HydrophobicContact CE2-CB 3.87Å; Y366-A378 HydrophobicContact CG-CB 3.81Å; V373-A378 HydrophobicContact CG1-CB 3.93Å; V373-A378 HydrophobicContact CG2-CB 4.46Å; N375-A378 WeakPolarHBondContact O-CB 3.01Å; N375-A378 PolarHBondContact O-N 3.28Å; N375-A378 PolarHBondContact OD1-N 3.15Å; S376-A378 VanDerWaalsContact C-N 3.28Å; S376-A378 PolarHBondContact O-N 3.06Å; A378-Y380 PolarHBondContact O-N 2.81Å; A378-N381 PolarHBondContact O-N 2.82Å; A378-V382 PolarHBondContact O-N 3.29Å
379	G	90.6	Very high	89.3	Confident	6 Å²	6	57 Å²	57	6%	0.062	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-40.2	177.5	0	0	0	0	0	113.6	W362 A377 V382 K383	W362-G379 WeakPolarHBondContact CB-O 3.19Å; A377-G379 VanDerWaalsContact C-N 3.35Å; A377-G379 PolarHBondContact O-N 2.94Å; G379-V382 VanDerWaalsContact O-CG1 3.29Å; G379-V382 WeakPolarHBondContact O-CG1 3.22Å; G379-K383 WeakPolarHBondContact O-CB 3.49Å; G379-K383 PolarHBondContact O-N 2.93Å
380	Y	90.6	Very high	89.4	Confident	159 Å²	159	56 Å²	56	62%	0.624	30%	0.304	S	S	*	.	H	α-helix	trans	-65.8	-42.5	175	178.8	-96.3	0	0	0	111.6	A377 A378 V382 K383 C384	A377-Y380 WeakPolarHBondContact O-CB 3.28Å; A377-Y380 PolarHBondContact O-N 2.9Å; A378-Y380 PolarHBondContact O-N 2.81Å; Y380-V382 PolarHBondContact O-N 2.95Å; Y380-K383 PolarHBondContact O-N 2.92Å; Y380-C384 WeakPolarHBondContact CE1-SG 3.4Å; Y380-C384 WeakPolarHBondContact O-CB 3.42Å; Y380-C384 PolarHBondContact O-N 2.85Å; Y380-C384 PolarHBondContact O-SG 3.02Å
381	N	91.6	Very high	89.6	Confident	57 Å²	57	56.9 Å²	56.9	31%	0.305	30%	0.298	S	S	.	.	H	α-helix	trans	-64.3	-40.9	-178.9	-65.1	-30.4	0	0	0	112.1	L333 A377 A378 A385	L333-N381 HydrophobicContact CD1-CB 3.89Å; A377-N381 VanDerWaalsContact O-CG 3.29Å; A377-N381 PolarHBondContact O-N 2.77Å; A377-N381 PolarHBondContact O-ND2 2.97Å; A378-N381 PolarHBondContact O-N 2.82Å; N381-A385 WeakPolarHBondContact O-CB 3.5Å; N381-A385 PolarHBondContact O-N 3.42Å
382	V	93.5	Very high	89.6	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-69.9	-38.1	173	61.5	0	0	0	0	112.3	L333 L343 W362 V365 Y366 L369 A378 G379 Y380 C384 A385 Y386	L333-V382 HydrophobicContact CD2-CB 4.05Å; L333-V382 HydrophobicContact CD2-CG2 4.41Å; L343-V382 HydrophobicContact CD1-CG2 3.52Å; L343-V382 HydrophobicContact CD2-CG2 4.23Å; W362-V382 HydrophobicContact CB-CG1 4.29Å; W362-V382 HydrophobicContact CE3-CG1 4.09Å; W362-V382 VanDerWaalsContact O-CG1 3.22Å; W362-V382 WeakPolarHBondContact O-CG1 3.15Å; V365-V382 HydrophobicContact CG1-CG2 4.24Å; Y366-V382 HydrophobicContact CD2-CB 3.99Å; Y366-V382 HydrophobicContact CD2-CG1 4.08Å; L369-V382 HydrophobicContact CD1-CG2 4.21Å; A378-V382 PolarHBondContact O-N 3.29Å; G379-V382 VanDerWaalsContact O-CG1 3.29Å; G379-V382 WeakPolarHBondContact O-CG1 3.22Å; Y380-V382 PolarHBondContact O-N 2.95Å; V382-C384 VanDerWaalsContact C-N 3.32Å; V382-C384 PolarHBondContact O-N 3.19Å; V382-A385 PolarHBondContact O-N 2.99Å; V382-Y386 WeakPolarHBondContact O-CB 3.19Å; V382-Y386 PolarHBondContact O-N 3.16Å
383	K	92.8	Very high	89.8	Confident	64 Å²	64	53.6 Å²	53.6	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-59	-43.2	173.5	-171.7	171.9	-171.8	156.9	0	111.5	F353 I356 W362 G379 Y380 K387	F353-K383 HydrophobicContact CE2-CG 3.75Å; F353-K383 HydrophobicContact CZ-CD 4.48Å; F353-K383 HydrophobicContact CZ-CG 4.01Å; I356-K383 PolarHBondContact O-NZ 2.91Å; W362-K383 HydrophobicContact CD2-CB 3.76Å; W362-K383 HydrophobicContact CD2-CD 4.35Å; W362-K383 HydrophobicContact CD2-CG 4.02Å; W362-K383 HydrophobicContact CE3-CB 4.07Å; W362-K383 HydrophobicContact CG-CB 4.03Å; W362-K383 HydrophobicContact CG-CD 4.36Å; W362-K383 HydrophobicContact CG-CG 4.43Å; W362-K383 HydrophobicContact CZ2-CD 4.44Å; W362-K383 HydrophobicContact CZ2-CG 4.03Å; G379-K383 WeakPolarHBondContact O-CB 3.49Å; G379-K383 PolarHBondContact O-N 2.93Å; Y380-K383 PolarHBondContact O-N 2.92Å; K383-K387 WeakPolarHBondContact O-CB 3.48Å; K383-K387 PolarHBondContact O-N 2.91Å
384	C	92.1	Very high	89.9	Confident	51 Å²	51	51.8 Å²	51.8	35%	0.345	27%	0.266	S	S	.	.	H	α-helix	trans	-66.7	-40.5	174.6	-74	0	0	0	0	113	Y380 V382 K388	Y380-C384 WeakPolarHBondContact CE1-SG 3.4Å; Y380-C384 WeakPolarHBondContact O-CB 3.42Å; Y380-C384 PolarHBondContact O-N 2.85Å; Y380-C384 PolarHBondContact O-SG 3.02Å; V382-C384 VanDerWaalsContact C-N 3.32Å; V382-C384 PolarHBondContact O-N 3.19Å; C384-K388 VanDerWaalsContact O-CB 3.23Å; C384-K388 WeakPolarHBondContact O-CB 3.4Å; C384-K388 PolarHBondContact O-N 3.19Å
385	A	91.7	Very high	90	Very high	11 Å²	11	46.5 Å²	46.5	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-45.6	175	0	0	0	0	0	111	L338 N381 V382 K388 Y389	L338-A385 HydrophobicContact CD2-CB 3.94Å; N381-A385 WeakPolarHBondContact O-CB 3.5Å; N381-A385 PolarHBondContact O-N 3.42Å; V382-A385 PolarHBondContact O-N 2.99Å; A385-K388 PolarHBondContact O-N 2.79Å; A385-Y389 HydrophobicContact CB-CD2 4.47Å; A385-Y389 WeakPolarHBondContact O-CB 3.5Å; A385-Y389 VanDerWaalsContact O-CD2 3.25Å; A385-Y389 WeakPolarHBondContact O-CD2 3.37Å; A385-Y389 PolarHBondContact O-N 2.83Å
386	Y	93.6	Very high	90.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-52.3	175.4	-162.4	-76	0	0	0	111.5	L343 F344 V347 F353 W362 V382 K388 Y389 L390 Y391 E394	L343-Y386 HydrophobicContact CD1-CD2 3.86Å; L343-Y386 HydrophobicContact CD2-CD2 4.08Å; L343-Y386 HydrophobicContact CG-CD2 3.72Å; L343-Y386 HydrophobicContact CG-CE2 4.26Å; F344-Y386 HydrophobicContact CD2-CE2 4.5Å; F344-Y386 VanDerWaalsContact CD2-OH 3.25Å; F344-Y386 WeakPolarHBondContact CD2-OH 3.36Å; V347-Y386 HydrophobicContact CB-CD2 4.02Å; V347-Y386 HydrophobicContact CB-CE2 3.39Å; V347-Y386 HydrophobicContact CG1-CD2 4.2Å; V347-Y386 HydrophobicContact CG1-CE1 4.13Å; V347-Y386 HydrophobicContact CG1-CE2 3.58Å; V347-Y386 HydrophobicContact CG2-CD2 3.6Å; V347-Y386 HydrophobicContact CG2-CE2 3.52Å; V347-Y386 HydrophobicContact CG2-CG 4.48Å; F353-Y386 HydrophobicContact CB-CD1 4.12Å; F353-Y386 HydrophobicContact CB-CE1 3.88Å; F353-Y386 AromaticContact CD2-CD1 3.45Å; F353-Y386 HydrophobicContact CD2-CD1 3.45Å; F353-Y386 VanDerWaalsContact CD2-CD1 3.45Å; F353-Y386 HydrophobicContact CD2-CE1 4.11Å; F353-Y386 HydrophobicContact CD2-CG 4.12Å; F353-Y386 HydrophobicContact CE2-CD1 4.26Å; F353-Y386 HydrophobicContact CG-CD1 4.17Å; F353-Y386 HydrophobicContact CG-CE1 4.42Å; W362-Y386 HydrophobicContact CH2-CD1 4.49Å; W362-Y386 HydrophobicContact CH2-CD2 4.44Å; W362-Y386 HydrophobicContact CH2-CG 4.09Å; W362-Y386 HydrophobicContact CZ3-CD2 4.36Å; W362-Y386 HydrophobicContact CZ3-CG 4.23Å; V382-Y386 WeakPolarHBondContact O-CB 3.19Å; V382-Y386 PolarHBondContact O-N 3.16Å; Y386-K388 PolarHBondContact O-N 3.41Å; Y386-Y389 PolarHBondContact O-N 2.59Å; Y386-L390 HydrophobicContact CD1-CB 3.99Å; Y386-L390 HydrophobicContact CD2-CB 4.08Å; Y386-L390 HydrophobicContact CD2-CD1 3.65Å; Y386-L390 HydrophobicContact CD2-CG 4.49Å; Y386-L390 HydrophobicContact CE1-CB 3.8Å; Y386-L390 HydrophobicContact CE2-CB 3.89Å; Y386-L390 HydrophobicContact CE2-CD1 3.59Å; Y386-L390 HydrophobicContact CE2-CG 4.41Å; Y386-L390 HydrophobicContact CG-CB 4.12Å; Y386-L390 HydrophobicContact CG-CD1 4.37Å; Y386-L390 WeakPolarHBondContact O-CA 3.29Å; Y386-L390 PolarHBondContact O-N 2.87Å; Y386-Y391 PolarHBondContact O-N 2.84Å; Y386-E394 VanDerWaalsContact CE1-OE2 3.22Å; Y386-E394 WeakPolarHBondContact CE1-OE2 3.46Å; Y386-E394 PolarHBondContact OH-OE2 2.86Å
387	K	90.6	Very high	90.3	Very high	130 Å²	130	37.2 Å²	37.2	57%	0.565	18%	0.178	S	C	*	.	H	α-helix	trans	-58.4	-35.9	179.5	-174	163.1	-177.4	163.3	0	112.6	F353 K383	F353-K387 HydrophobicContact CE2-CB 4Å; F353-K387 HydrophobicContact CZ-CB 4.02Å; F353-K387 HydrophobicContact CZ-CD 4.12Å; F353-K387 HydrophobicContact CZ-CG 4.38Å; K383-K387 WeakPolarHBondContact O-CB 3.48Å; K383-K387 PolarHBondContact O-N 2.91Å
388	K	89	Confident	90.1	Very high	128 Å²	128	40.3 Å²	40.3	56%	0.557	18%	0.182	S	C	*	.	H	α-helix	trans	-76	-42.2	179.9	-176.8	-179.4	176.7	-164.8	0	113.6	C384 A385 Y386	C384-K388 VanDerWaalsContact O-CB 3.23Å; C384-K388 WeakPolarHBondContact O-CB 3.4Å; C384-K388 PolarHBondContact O-N 3.19Å; A385-K388 PolarHBondContact O-N 2.79Å; Y386-K388 PolarHBondContact O-N 3.41Å
389	Y	89.4	Confident	89.9	Confident	43 Å²	43	40.6 Å²	40.6	17%	0.169	18%	0.183	C	C	.	.	H	α-helix	trans	-105.6	-29.3	-168.5	-66.1	-69.3	0	0	0	114.4	M320 I327 P331 L340 A385 Y386	M320-Y389 HydrophobicContact CE-CD1 3.82Å; I327-Y389 HydrophobicContact CD1-CD1 3.93Å; I327-Y389 HydrophobicContact CG1-CD1 4.19Å; I327-Y389 HydrophobicContact CG1-CE1 4.42Å; P331-Y389 HydrophobicContact CB-CD2 4.16Å; P331-Y389 HydrophobicContact CB-CE1 4.41Å; P331-Y389 HydrophobicContact CB-CE2 3.72Å; P331-Y389 HydrophobicContact CG-CD1 3.99Å; P331-Y389 HydrophobicContact CG-CD2 4.11Å; P331-Y389 HydrophobicContact CG-CE1 3.76Å; P331-Y389 HydrophobicContact CG-CE2 3.92Å; P331-Y389 HydrophobicContact CG-CG 4.17Å; L340-Y389 HydrophobicContact CD2-CG 4.45Å; A385-Y389 HydrophobicContact CB-CD2 4.47Å; A385-Y389 WeakPolarHBondContact O-CB 3.5Å; A385-Y389 VanDerWaalsContact O-CD2 3.25Å; A385-Y389 WeakPolarHBondContact O-CD2 3.37Å; A385-Y389 PolarHBondContact O-N 2.83Å; Y386-Y389 PolarHBondContact O-N 2.59Å
390	L	91.7	Very high	89.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-35.6	-167.4	-66.6	174.4	0	0	0	113.8	F312 L316 L340 L343 F344 Y386 G392 F393 E394	F312-L390 HydrophobicContact CZ-CD2 3.94Å; L316-L390 HydrophobicContact CD1-CD2 4.21Å; L316-L390 HydrophobicContact CD2-CD2 3.66Å; L340-L390 HydrophobicContact CB-CD2 4.39Å; L340-L390 HydrophobicContact CD2-CD1 4.41Å; L340-L390 HydrophobicContact CD2-CD2 4.41Å; L340-L390 HydrophobicContact CD2-CG 4.32Å; L343-L390 HydrophobicContact CB-CD1 4.09Å; L343-L390 HydrophobicContact CD2-CD1 3.69Å; L343-L390 HydrophobicContact CG-CD1 3.64Å; F344-L390 HydrophobicContact CB-CD1 4.1Å; F344-L390 HydrophobicContact CB-CD2 4.35Å; F344-L390 HydrophobicContact CD2-CB 4.47Å; F344-L390 HydrophobicContact CD2-CD2 4.35Å; Y386-L390 HydrophobicContact CD1-CB 3.99Å; Y386-L390 HydrophobicContact CD2-CB 4.08Å; Y386-L390 HydrophobicContact CD2-CD1 3.65Å; Y386-L390 HydrophobicContact CD2-CG 4.49Å; Y386-L390 HydrophobicContact CE1-CB 3.8Å; Y386-L390 HydrophobicContact CE2-CB 3.89Å; Y386-L390 HydrophobicContact CE2-CD1 3.59Å; Y386-L390 HydrophobicContact CE2-CG 4.41Å; Y386-L390 HydrophobicContact CG-CB 4.12Å; Y386-L390 HydrophobicContact CG-CD1 4.37Å; Y386-L390 WeakPolarHBondContact O-CA 3.29Å; Y386-L390 PolarHBondContact O-N 2.87Å; L390-G392 PolarHBondContact O-N 3.18Å; L390-F393 CarbonylContact O-C 3.57Å; L390-F393 WeakPolarHBondContact O-CA 3.18Å; L390-F393 WeakPolarHBondContact O-CB 3.39Å; L390-F393 PolarHBondContact O-N 3.14Å; L390-E394 PolarHBondContact O-N 3.41Å
391	Y	90.4	Very high	89.1	Confident	49 Å²	49	36.5 Å²	36.5	19%	0.192	17%	0.171	C	C	.	.	H	α-helix	trans	-54.5	-48.3	-173.6	175.8	-99.5	0	0	0	114.3	F353 D354 Y386 F393 E394 E395	F353-Y391 HydrophobicContact CB-CD2 3.72Å; F353-Y391 HydrophobicContact CB-CE2 4.21Å; F353-Y391 AromaticContact CD1-CD2 3.52Å; F353-Y391 HydrophobicContact CD1-CD2 3.52Å; F353-Y391 AromaticContact CD1-CE2 3.61Å; F353-Y391 HydrophobicContact CD1-CE2 3.61Å; F353-Y391 HydrophobicContact CD2-CD2 4.41Å; F353-Y391 HydrophobicContact CE1-CD2 4.22Å; F353-Y391 HydrophobicContact CE1-CE2 4.31Å; F353-Y391 AromaticContact CG-CD2 3.63Å; F353-Y391 HydrophobicContact CG-CD2 3.63Å; F353-Y391 HydrophobicContact CG-CE2 4.14Å; D354-Y391 WeakPolarHBondContact OD1-CE2 3.31Å; Y386-Y391 PolarHBondContact O-N 2.84Å; Y391-F393 PolarHBondContact O-N 3.04Å; Y391-E394 WeakPolarHBondContact O-CB 3.09Å; Y391-E394 PolarHBondContact O-N 3.2Å; Y391-E395 PolarHBondContact O-N 2.97Å
392	G	87.6	Confident	88.7	Confident	2 Å²	2	34.4 Å²	34.4	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-65.2	-25.7	176.8	0	0	0	0	0	113.6	F319 L390 Y396	F319-G392 VanDerWaalsContact CE1-C 3.48Å; F319-G392 WeakPolarHBondContact CZ-O 3.22Å; L390-G392 PolarHBondContact O-N 3.18Å; G392-Y396 WeakPolarHBondContact O-CB 3.39Å; G392-Y396 PolarHBondContact O-N 2.82Å
393	F	89.7	Confident	88	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-80.6	-35.8	173.8	-175.2	-101.9	0	0	0	111.9	F312 Q315 L316 F319 L390 Y391 E395 Y396 C397 F404	F312-F393 AromaticContact CD2-CE1 3.76Å; F312-F393 HydrophobicContact CD2-CE1 3.76Å; F312-F393 AromaticContact CE2-CD1 3.88Å; F312-F393 HydrophobicContact CE2-CD1 3.88Å; F312-F393 AromaticContact CE2-CE1 3.46Å; F312-F393 HydrophobicContact CE2-CE1 3.46Å; F312-F393 VanDerWaalsContact CE2-CE1 3.46Å; F312-F393 HydrophobicContact CZ-CD1 4.35Å; F312-F393 HydrophobicContact CZ-CE1 4.24Å; Q315-F393 HydrophobicContact CB-CE2 4Å; Q315-F393 HydrophobicContact CB-CZ 3.88Å; L316-F393 HydrophobicContact CB-CE2 4.47Å; L316-F393 HydrophobicContact CB-CZ 4.46Å; L316-F393 HydrophobicContact CD1-CB 3.57Å; L316-F393 HydrophobicContact CD1-CD1 3.96Å; L316-F393 HydrophobicContact CD1-CD2 4.01Å; L316-F393 HydrophobicContact CD1-CG 3.56Å; F319-F393 HydrophobicContact CB-CD2 3.8Å; F319-F393 HydrophobicContact CB-CE2 4.2Å; F319-F393 HydrophobicContact CD1-CB 3.92Å; F319-F393 AromaticContact CD1-CD2 3.85Å; F319-F393 HydrophobicContact CD1-CD2 3.85Å; F319-F393 HydrophobicContact CD1-CG 4.39Å; F319-F393 HydrophobicContact CD2-CD2 4.38Å; F319-F393 HydrophobicContact CE1-CB 4.01Å; F319-F393 AromaticContact CG-CD2 3.75Å; F319-F393 HydrophobicContact CG-CD2 3.75Å; L390-F393 CarbonylContact O-C 3.57Å; L390-F393 WeakPolarHBondContact O-CA 3.18Å; L390-F393 WeakPolarHBondContact O-CB 3.39Å; L390-F393 PolarHBondContact O-N 3.14Å; Y391-F393 PolarHBondContact O-N 3.04Å; F393-E395 VanDerWaalsContact C-N 3.34Å; F393-Y396 HydrophobicContact CD2-CD1 4.11Å; F393-Y396 HydrophobicContact CE2-CD1 4.05Å; F393-Y396 HydrophobicContact CE2-CE1 4.49Å; F393-Y396 PolarHBondContact O-N 2.86Å; F393-C397 WeakPolarHBondContact CE1-SG 3.29Å; F393-C397 VanDerWaalsContact CZ-SG 3.56Å; F393-C397 PolarHBondContact O-N 2.97Å; F393-C397 PolarHBondContact O-SG 2.85Å; F393-F404 AromaticContact CE1-CE2 3.99Å; F393-F404 HydrophobicContact CE1-CE2 3.99Å; F393-F404 HydrophobicContact CE1-CZ 4.19Å; F393-F404 HydrophobicContact CZ-CE2 4.15Å; F393-F404 AromaticContact CZ-CZ 3.98Å; F393-F404 HydrophobicContact CZ-CZ 3.98Å
394	E	90.2	Very high	87.4	Confident	10 Å²	10	40.7 Å²	40.7	5%	0.047	19%	0.19	C	C	.	.	H	α-helix	trans	-56.4	-50	169.8	-168	-168.8	150.8	0	0	110	F344 G352 F353 Y386 L390 Y391 Y396 C397 R398	F344-E394 HydrophobicContact CE2-CB 3.92Å; F344-E394 HydrophobicContact CE2-CG 4.05Å; G352-E394 WeakPolarHBondContact CA-OE1 3.23Å; F353-E394 WeakPolarHBondContact CB-OE2 3.23Å; F353-E394 PolarHBondContact N-OE1 3.13Å; F353-E394 VanDerWaalsContact N-OE1 3.16Å; F353-E394 PolarHBondContact N-OE2 2.67Å; F353-E394 VanDerWaalsContact N-OE2 3.07Å; Y386-E394 VanDerWaalsContact CE1-OE2 3.22Å; Y386-E394 WeakPolarHBondContact CE1-OE2 3.46Å; Y386-E394 PolarHBondContact OH-OE2 2.86Å; L390-E394 PolarHBondContact O-N 3.41Å; Y391-E394 WeakPolarHBondContact O-CB 3.09Å; Y391-E394 PolarHBondContact O-N 3.2Å; E394-Y396 PolarHBondContact O-N 2.77Å; E394-C397 PolarHBondContact O-N 3.04Å; E394-C397 VanDerWaalsContact O-N 3.16Å; E394-R398 VanDerWaalsContact O-CB 3.26Å; E394-R398 WeakPolarHBondContact O-CB 3.34Å; E394-R398 PolarHBondContact O-N 3.41Å; E394-R398 IonicContact OE1-CZ 3.92Å; E394-R398 IonicContact OE1-NH2 3.17Å; E394-R398 PolarHBondContact OE1-NH2 2.9Å
395	E	87.2	Confident	86.5	Confident	22 Å²	22	44.4 Å²	44.4	10%	0.103	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-35.5	178.8	-170.8	53.5	-145.5	0	0	112.4	C198 D200 Y391 F393 R398 S399	C198-E395 HydrophobicContact CB-CG 3.97Å; C198-E395 VanDerWaalsContact CB-OE1 3.31Å; C198-E395 WeakPolarHBondContact CB-OE1 3.37Å; C198-E395 PolarHBondContact SG-OE1 2.69Å; D200-E395 HydrophobicContact CB-CG 4.22Å; Y391-E395 PolarHBondContact O-N 2.97Å; F393-E395 VanDerWaalsContact C-N 3.34Å; E395-R398 WeakPolarHBondContact OE2-CD 3.17Å; E395-R398 IonicContact OE2-CZ 3.95Å; E395-R398 IonicContact OE2-NE 2.81Å; E395-R398 IonicContact OE2-NH1 3.11Å; E395-R398 PolarHBondContact OE2-NH1 2.85Å; E395-S399 VanDerWaalsContact O-CB 3.27Å; E395-S399 WeakPolarHBondContact O-CB 3.39Å; E395-S399 PolarHBondContact O-N 2.86Å; E395-S399 PolarHBondContact O-OG 2.85Å
396	Y	86.5	Confident	85.6	Confident	1 Å²	1	44.9 Å²	44.9	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-61.5	-45.7	169	173.4	-112.6	0	0	0	111.9	V197 C201 R215 F222 W265 F319 G392 F393 E394 S399 A400 I402	V197-Y396 HydrophobicContact CB-CD2 4.46Å; V197-Y396 HydrophobicContact CG1-CD2 3.85Å; V197-Y396 HydrophobicContact CG1-CE2 3.7Å; C201-Y396 WeakPolarHBondContact SG-CA 3.34Å; R215-Y396 PolarHBondContact NH1-OH 2.8Å; F222-Y396 HydrophobicContact CE1-CD2 4.34Å; F222-Y396 HydrophobicContact CE1-CE2 4.35Å; F222-Y396 HydrophobicContact CZ-CD2 4.48Å; F222-Y396 HydrophobicContact CZ-CE2 4.49Å; W265-Y396 WeakPolarHBondContact CZ3-OH 3.4Å; F319-Y396 HydrophobicContact CD2-CD1 4.04Å; F319-Y396 AromaticContact CD2-CG 3.99Å; F319-Y396 HydrophobicContact CD2-CG 3.99Å; F319-Y396 HydrophobicContact CE2-CD1 4.34Å; F319-Y396 HydrophobicContact CE2-CD2 4.3Å; F319-Y396 AromaticContact CE2-CG 3.83Å; F319-Y396 HydrophobicContact CE2-CG 3.83Å; G392-Y396 WeakPolarHBondContact O-CB 3.39Å; G392-Y396 PolarHBondContact O-N 2.82Å; F393-Y396 HydrophobicContact CD2-CD1 4.11Å; F393-Y396 HydrophobicContact CE2-CD1 4.05Å; F393-Y396 HydrophobicContact CE2-CE1 4.49Å; F393-Y396 PolarHBondContact O-N 2.86Å; E394-Y396 PolarHBondContact O-N 2.77Å; Y396-S399 PolarHBondContact O-OG 2.8Å; Y396-A400 HydrophobicContact CD2-CB 4.46Å; Y396-A400 HydrophobicContact CE2-CB 4.18Å; Y396-A400 WeakPolarHBondContact O-CB 3.48Å; Y396-A400 PolarHBondContact O-N 2.65Å; Y396-I402 HydrophobicContact CD1-CD1 4.34Å; Y396-I402 HydrophobicContact CE1-CD1 3.6Å
397	C	88.1	Confident	84.1	Confident	7 Å²	7	48.4 Å²	48.4	5%	0.047	23%	0.232	C	C	.	.	H	α-helix	trans	-67.1	-44.2	-179.9	-64.2	0	0	0	0	111.9	F393 E394 A400 N401 I402	F393-C397 WeakPolarHBondContact CE1-SG 3.29Å; F393-C397 VanDerWaalsContact CZ-SG 3.56Å; F393-C397 PolarHBondContact O-N 2.97Å; F393-C397 PolarHBondContact O-SG 2.85Å; E394-C397 PolarHBondContact O-N 3.04Å; E394-C397 VanDerWaalsContact O-N 3.16Å; C397-A400 PolarHBondContact O-N 2.58Å; C397-N401 WeakPolarHBondContact O-CA 3.43Å; C397-N401 PolarHBondContact O-N 3.34Å; C397-I402 HydrophobicContact CB-CB 4.24Å; C397-I402 PolarHBondContact O-N 2.8Å
398	R	86.1	Confident	82.6	Confident	106 Å²	106	45.6 Å²	45.6	40%	0.4	22%	0.222	S	C	.	.	H	α-helix	trans	-55.8	-52.3	174.7	-171.3	-171.5	-65.3	172.2	-11.3	110.9	D354 E394 E395	D354-R398 IonicContact OD2-CZ 3.71Å; D354-R398 IonicContact OD2-NH1 4Å; D354-R398 PolarHBondContact OD2-NH1 3.25Å; D354-R398 IonicContact OD2-NH2 3.68Å; D354-R398 PolarHBondContact OD2-NH2 3.38Å; E394-R398 VanDerWaalsContact O-CB 3.26Å; E394-R398 WeakPolarHBondContact O-CB 3.34Å; E394-R398 PolarHBondContact O-N 3.41Å; E394-R398 IonicContact OE1-CZ 3.92Å; E394-R398 IonicContact OE1-NH2 3.17Å; E394-R398 PolarHBondContact OE1-NH2 2.9Å; E395-R398 WeakPolarHBondContact OE2-CD 3.17Å; E395-R398 IonicContact OE2-CZ 3.95Å; E395-R398 IonicContact OE2-NE 2.81Å; E395-R398 IonicContact OE2-NH1 3.11Å; E395-R398 PolarHBondContact OE2-NH1 2.85Å
399	S	84.7	Confident	80.7	Confident	6 Å²	6	43.4 Å²	43.4	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-79.7	-14.7	-178.5	65.7	0	0	0	0	115.1	L173 G174 C198 E395 Y396	L173-S399 CarbonylContact C-O 3.49Å; G174-S399 WeakPolarHBondContact CA-O 3Å; G174-S399 PolarHBondContact N-O 3.1Å; C198-S399 WeakPolarHBondContact CB-OG 3.23Å; C198-S399 PolarHBondContact N-OG 2.93Å; E395-S399 VanDerWaalsContact O-CB 3.27Å; E395-S399 WeakPolarHBondContact O-CB 3.39Å; E395-S399 PolarHBondContact O-N 2.86Å; E395-S399 PolarHBondContact O-OG 2.85Å; Y396-S399 PolarHBondContact O-OG 2.8Å
400	A	83.3	Confident	78.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-94.2	-7.4	173.5	0	0	0	0	0	113.8	L195 R259 Y396 C397 I402	L195-A400 HydrophobicContact CD2-CB 3.9Å; R259-A400 PolarHBondContact NH1-O 2.67Å; R259-A400 VanDerWaalsContact NH1-O 3.13Å; Y396-A400 HydrophobicContact CD2-CB 4.46Å; Y396-A400 HydrophobicContact CE2-CB 4.18Å; Y396-A400 WeakPolarHBondContact O-CB 3.48Å; Y396-A400 PolarHBondContact O-N 2.65Å; C397-A400 PolarHBondContact O-N 2.58Å; A400-I402 VanDerWaalsContact C-N 3.33Å; A400-I402 HydrophobicContact CB-CD1 3.52Å; A400-I402 HydrophobicContact CB-CG1 3.68Å
401	N	81.1	Confident	76.1	Confident	79 Å²	79	58.4 Å²	58.4	42%	0.422	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	51.6	-163.8	-54.4	98.5	0	0	0	112	C397	C397-N401 WeakPolarHBondContact O-CA 3.43Å; C397-N401 PolarHBondContact O-N 3.34Å
402	I	84.3	Confident	73.4	Confident	14 Å²	14	62.4 Å²	62.4	7%	0.072	32%	0.319	C	S	.	.			trans	-98.9	118.7	171.1	-63.2	165.9	0	0	0	107.5	F255 I261 Y396 C397 A400 F404	F255-I402 HydrophobicContact CE2-CD1 4.48Å; F255-I402 HydrophobicContact CE2-CG1 4.21Å; F255-I402 HydrophobicContact CZ-CG1 4.2Å; I261-I402 HydrophobicContact CD1-CB 4.43Å; I261-I402 HydrophobicContact CD1-CD1 3.67Å; I261-I402 HydrophobicContact CD1-CG1 3.9Å; I261-I402 HydrophobicContact CD1-CG2 3.65Å; I261-I402 HydrophobicContact CG1-CD1 4.44Å; Y396-I402 HydrophobicContact CD1-CD1 4.34Å; Y396-I402 HydrophobicContact CE1-CD1 3.6Å; C397-I402 HydrophobicContact CB-CB 4.24Å; C397-I402 PolarHBondContact O-N 2.8Å; A400-I402 VanDerWaalsContact C-N 3.33Å; A400-I402 HydrophobicContact CB-CD1 3.52Å; A400-I402 HydrophobicContact CB-CG1 3.68Å; I402-F404 HydrophobicContact CG2-CD2 4.43Å; I402-F404 HydrophobicContact CG2-CE2 3.78Å; I402-F404 HydrophobicContact CG2-CZ 3.96Å
403	E	79	Confident	70.9	Confident	176 Å²	176	68.1 Å²	68.1	82%	0.822	35%	0.354	S	S	*	.			trans	-110.6	148.1	176.8	-66.9	179.8	-170.6	0	0	110.4
404	F	78.9	Confident	68.1	Low	20 Å²	20	75.3 Å²	75.3	9%	0.088	39%	0.392	C	S	.	.			trans	-124.1	138.8	173.4	-62.3	-89.7	0	0	0	109.7	E308 F312 Q315 F344 F393 I402 M406	E308-F404 HydrophobicContact CG-CB 4.46Å; E308-F404 HydrophobicContact CG-CD1 4.1Å; E308-F404 WeakPolarHBondContact OE1-CA 3.38Å; F312-F404 HydrophobicContact CB-CD1 4.1Å; F312-F404 HydrophobicContact CB-CE1 3.85Å; F312-F404 HydrophobicContact CB-CZ 4.37Å; F312-F404 HydrophobicContact CD2-CD1 4.43Å; F312-F404 HydrophobicContact CD2-CD2 4.21Å; F312-F404 HydrophobicContact CD2-CE1 4.22Å; F312-F404 AromaticContact CD2-CE2 3.99Å; F312-F404 HydrophobicContact CD2-CE2 3.99Å; F312-F404 HydrophobicContact CD2-CG 4.42Å; F312-F404 AromaticContact CD2-CZ 3.99Å; F312-F404 HydrophobicContact CD2-CZ 3.99Å; Q315-F404 VanDerWaalsContact NE2-CE1 3.34Å; F344-F404 HydrophobicContact CE1-CD2 4.49Å; F393-F404 AromaticContact CE1-CE2 3.99Å; F393-F404 HydrophobicContact CE1-CE2 3.99Å; F393-F404 HydrophobicContact CE1-CZ 4.19Å; F393-F404 HydrophobicContact CZ-CE2 4.15Å; F393-F404 AromaticContact CZ-CZ 3.98Å; F393-F404 HydrophobicContact CZ-CZ 3.98Å; I402-F404 HydrophobicContact CG2-CD2 4.43Å; I402-F404 HydrophobicContact CG2-CE2 3.78Å; I402-F404 HydrophobicContact CG2-CZ 3.96Å; F404-M406 VanDerWaalsContact C-N 3.27Å; F404-M406 HydrophobicContact CB-CE 4.16Å; F404-M406 HydrophobicContact CB-CG 3.93Å; F404-M406 HydrophobicContact CB-SD 4.38Å; F404-M406 PolarHBondContact O-N 3.43Å
405	Q	73.3	Confident	65.6	Low	128 Å²	128	83.5 Å²	83.5	60%	0.598	43%	0.428	S	S	*	.			trans	-75.1	80.2	175.2	-38.8	-172.9	-7.8	0	0	110.4	E308 A407	E308-Q405 PolarHBondContact OE1-N 2.93Å; E308-Q405 WeakPolarHBondContact OE2-CA 3.38Å; E308-Q405 WeakPolarHBondContact OE2-CB 3.33Å; E308-Q405 WeakPolarHBondContact OE2-CG 3.26Å; E308-Q405 PolarHBondContact OE2-N 3.05Å; E308-Q405 VanDerWaalsContact OE2-N 3.16Å; Q405-A407 VanDerWaalsContact C-N 3.34Å
406	M	72.7	Confident	62.8	Low	22 Å²	22	89.8 Å²	89.8	11%	0.108	46%	0.457	C	S	.	.			trans	-89.7	1.7	-178.9	-66.9	175.5	-79.8	0	0	113.8	F341 F344 R345 H348 F404 L408	F341-M406 HydrophobicContact CE2-CG 4.23Å; F341-M406 HydrophobicContact CZ-CG 4.47Å; F344-M406 HydrophobicContact CD1-CE 4.34Å; F344-M406 HydrophobicContact CD1-SD 3.33Å; F344-M406 WeakPolarHBondContact CD1-SD 3.35Å; F344-M406 HydrophobicContact CE1-CE 3.79Å; F344-M406 HydrophobicContact CE1-SD 3.39Å; F344-M406 WeakPolarHBondContact CE1-SD 3.48Å; R345-M406 HydrophobicContact CB-CB 4.46Å; R345-M406 WeakPolarHBondContact CD-O 3.39Å; R345-M406 HydrophobicContact CG-CB 4.16Å; R345-M406 WeakPolarHBondContact CG-O 3.07Å; H348-M406 HydrophobicContact CB-CE 4.12Å; H348-M406 HydrophobicContact CB-SD 4.24Å; H348-M406 VanDerWaalsContact CG-CE 3.46Å; H348-M406 WeakPolarHBondContact ND1-CE 3.44Å; F404-M406 VanDerWaalsContact C-N 3.27Å; F404-M406 HydrophobicContact CB-CE 4.16Å; F404-M406 HydrophobicContact CB-CG 3.93Å; F404-M406 HydrophobicContact CB-SD 4.38Å; F404-M406 PolarHBondContact O-N 3.43Å; M406-L408 PolarHBondContact O-N 3.1Å
407	A	61.8	Low	59.9	Low	74 Å²	74	96.2 Å²	96.2	61%	0.612	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-72.3	123.4	-178.1	0	0	0	0	0	110.9	Q405	Q405-A407 VanDerWaalsContact C-N 3.34Å
408	L	59.4	Low	57.1	Low	70 Å²	70	103.9 Å²	103.9	37%	0.366	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-64.4	134.3	164.8	-69.6	173.9	0	0	0	108.9	P304 M406 E410	P304-L408 HydrophobicContact CG-CD2 3.74Å; M406-L408 PolarHBondContact O-N 3.1Å; L408-E410 PolarHBondContact O-N 3.47Å
409	P	50.3	Low	54.3	Low	83 Å²	83	107.6 Å²	107.6	54%	0.539	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-52.6	130.3	166.1	-24.9	33.3	0	0	0	109.7	P304 K411	P304-P409 VanDerWaalsContact CB-CD 3.42Å; P304-P409 HydrophobicContact CB-CG 3.83Å; P304-P409 HydrophobicContact CG-CG 4.45Å; P409-K411 PolarHBondContact O-N 2.94Å
410	E	42.7	Very low	51.4	Low	185 Å²	185	112.5 Å²	112.5	86%	0.864	59%	0.588	S	S	*	*			trans	-60.9	111.5	179.3	-75	-168.3	134.1	0	0	110	L408 V412	L408-E410 PolarHBondContact O-N 3.47Å; E410-V412 VanDerWaalsContact C-N 3.34Å; E410-V412 PolarHBondContact O-N 3.18Å
411	K	40.5	Very low	48.6	Very low	173 Å²	173	121.9 Å²	121.9	75%	0.752	63%	0.632	S	S	*	*			trans	-63.1	97.8	167.1	-75.9	-176.5	177.3	176	0	107.8	P409 V413	P409-K411 PolarHBondContact O-N 2.94Å; K411-V413 PolarHBondContact O-N 3.23Å
412	V	33.8	Very low	45.9	Very low	132 Å²	132	125.1 Å²	125.1	80%	0.8	65%	0.649	S	S	*	*			trans	-56.3	111.2	174.7	-174.1	0	0	0	0	108.3	E410 N414	E410-V412 VanDerWaalsContact C-N 3.34Å; E410-V412 PolarHBondContact O-N 3.18Å; V412-N414 VanDerWaalsContact C-N 3.27Å; V412-N414 PolarHBondContact O-N 2.74Å
413	V	36.3	Very low	43.4	Very low	122 Å²	122	131.4 Å²	131.4	74%	0.739	69%	0.688	S	S	*	*			trans	-72.5	83.7	-178.3	-177.8	0	0	0	0	109.4	K411 K415	K411-V413 PolarHBondContact O-N 3.23Å; V413-K415 HydrophobicContact CG1-CG 4.38Å; V413-K415 PolarHBondContact O-N 3.11Å
414	N	30.7	Very low	41	Very low	152 Å²	152	131.4 Å²	131.4	81%	0.813	69%	0.685	S	S	*	*			trans	-78.2	91.3	175.8	-165.7	14	0	0	0	110	V412 Q416	V412-N414 VanDerWaalsContact C-N 3.27Å; V412-N414 PolarHBondContact O-N 2.74Å; N414-Q416 PolarHBondContact O-N 3.19Å
415	K	37.7	Very low	38.6	Very low	182 Å²	182	138.6 Å²	138.6	79%	0.791	72%	0.719	S	S	*	*			trans	-70.9	111.2	172.6	-79.8	-175.6	175.7	178.4	0	110.7	V413	V413-K415 HydrophobicContact CG1-CG 4.38Å; V413-K415 PolarHBondContact O-N 3.11Å
416	Q	27.6	Very low	36.4	Very low	154 Å²	154	138.8 Å²	138.8	72%	0.72	72%	0.723	S	S	*	*			trans	-158.3	99.7	138.2	-121.3	171	24.3	0	0	113.5	N414	N414-Q416 PolarHBondContact O-N 3.19Å
417	C	26	Very low	34.1	Very low	135 Å²	135	147 Å²	147	91%	0.912	76%	0.758	S	S	*	*			trans	-81.9	141	146.1	-68.1	0	0	0	0	108.1
418	K	28.6	Very low	32.5	Very low	168 Å²	168	149.6 Å²	149.6	73%	0.73	77%	0.766	S	S	*	*			trans	-114.9	162.1	171.7	-74.1	-179.7	177.3	174.1	0	109.3
419	E	27.2	Very low	30.9	Very low	185 Å²	185	153.2 Å²	153.2	86%	0.864	78%	0.779	S	S	*	*			trans	87.1	129	-172	-59.7	-160.1	145	0	0	113.9
420	C	23.7	Very low	29.8	Very low	108 Å²	108	156.1 Å²	156.1	73%	0.73	79%	0.785	S	S	*	*			cis	-153.2	142.8	-0.9	-106.6	0	0	0	0	110.6
421	E	25.8	Very low	29	Very low	197 Å²	197	153.1 Å²	153.1	92%	0.921	77%	0.771	S	S	*	*				178.9	141.1	126.2	-100.3	-178	172.7	0	0	112.4
422	N	24.6	Very low	28.3	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	77%	0.766	S	S	*	*			trans	-92.5	141.3	171.3	-87	-74.3	0	0	0	109.7
423	V	31.2	Very low	28	Very low	146 Å²	146	152.6 Å²	152.6	89%	0.885	77%	0.766	S	S	*	*				-155.2	147.1	121.2	173.5	0	0	0	0	108.4
424	K	29.1	Very low	27.5	Very low	176 Å²	176	152.4 Å²	152.4	77%	0.765	77%	0.766	S	S	*	*			trans	-91.6	156.4	-180	-60	167.5	179.4	171.7	0	111.9
425	E	26.7	Very low	27.3	Very low	171 Å²	171	152.6 Å²	152.6	80%	0.799	76%	0.761	S	S	*	*				152.8	110	127.1	-80.7	-159.2	141.9	0	0	110.4
426	I	28.1	Very low	27	Very low	131 Å²	131	149.9 Å²	149.9	67%	0.672	75%	0.754	S	S	*	*				100.6	119.3	74.9	-84	175.3	0	0	0	112.5
427	K	25.4	Very low	27	Very low	195 Å²	195	150.4 Å²	150.4	85%	0.848	75%	0.754	S	S	*	*			trans	68.5	151.8	159.7	-81.5	171.6	-174.3	179.2	0	118
428	V	27.7	Very low	27	Very low	129 Å²	129	150.2 Å²	150.2	78%	0.782	74%	0.74	S	S	*	*			cis	-129.9	167.4	0.2	-164.2	0	0	0	0	111.2
429	K	24.5	Very low	26.9	Very low	146 Å²	146	149 Å²	149	64%	0.635	74%	0.74	S	S	*	*			trans	-56	177.1	155	-62.3	171.8	129.8	-123.5	0	113.1	E431	K429-E431 IonicContact NZ-OE1 3.7Å; K429-E431 PolarHBondContact NZ-OE1 3.36Å
430	E	27.2	Very low	26.9	Very low	143 Å²	143	149.1 Å²	149.1	67%	0.668	74%	0.738	S	S	*	*			cis	-156.9	130.2	35.4	-131	137.5	-144.2	0	0	108.1
431	E	27.1	Very low	27	Very low	123 Å²	123	151.2 Å²	151.2	58%	0.575	74%	0.738	S	S	*	*				76.6	142.5	96	-71.7	-168.6	-153	0	0	114.2	K429	K429-E431 IonicContact NZ-OE1 3.7Å; K429-E431 PolarHBondContact NZ-OE1 3.36Å
432	N	26.2	Very low	27.1	Very low	119 Å²	119	148.7 Å²	148.7	64%	0.636	73%	0.727	S	S	*	*			cis	-148.9	142	-8.5	-80.7	-33.5	0	0	0	106.2
433	E	26.4	Very low	27.2	Very low	175 Å²	175	149.4 Å²	149.4	82%	0.818	73%	0.725	S	S	*	*				63.2	149.6	79.3	-157.7	170.6	-144.7	0	0	115.7
434	T	25.8	Very low	27	Very low	118 Å²	118	148.6 Å²	148.6	72%	0.724	71%	0.712	S	S	*	*			trans	88.5	137.1	178.4	76.2	0	0	0	0	116.9
435	E	27.7	Very low	27	Very low	155 Å²	155	149.3 Å²	149.3	72%	0.724	71%	0.71	S	S	*	*			cis	-160.2	151.1	1	-123.5	173.7	166.4	0	0	113.9
436	I	30.8	Very low	26.9	Very low	125 Å²	125	148 Å²	148	64%	0.641	71%	0.709	S	S	*	*			trans	43.8	116.6	133.5	-71	173.8	0	0	0	118.8
437	K	26.8	Very low	26.9	Very low	165 Å²	165	149 Å²	149	72%	0.717	71%	0.713	S	S	*	*				61.2	148.6	84.7	-73.8	173.5	166.4	-118.2	0	113.5
438	E	27	Very low	27.1	Very low	132 Å²	132	147.1 Å²	147.1	62%	0.617	71%	0.711	S	S	*	*			cis	-170.4	175.2	7.5	-126	163.1	-147.9	0	0	109.7
439	I	26.3	Very low	27.6	Very low	141 Å²	141	145.8 Å²	145.8	72%	0.723	71%	0.705	S	S	*	*			trans	66.4	116.2	153.6	-64	154.7	0	0	0	117.6
440	K	26.5	Very low	27.7	Very low	189 Å²	189	148 Å²	148	82%	0.822	71%	0.71	S	S	*	*				76	132	60.8	-90.8	-168.2	176.8	-175.9	0	117.7
441	M	26.3	Very low	27.6	Very low	151 Å²	151	147.7 Å²	147.7	74%	0.744	71%	0.708	S	S	*	*			trans	92.1	143.6	161.4	-67.9	153.3	67.3	0	0	115.9
442	E	27	Very low	27.7	Very low	145 Å²	145	150.3 Å²	150.3	68%	0.678	72%	0.72	S	S	*	*			cis	-156.5	174.6	17.5	-137.3	156.7	-153.1	0	0	112.2
443	E	28.2	Very low	28	Very low	162 Å²	162	153.8 Å²	153.8	76%	0.757	73%	0.73	S	S	*	*			trans	0.4	156.6	153.8	-70.1	179.9	157.1	0	0	121.7
444	E	27.1	Very low	28.4	Very low	129 Å²	129	150.7 Å²	150.7	60%	0.603	72%	0.724	S	S	*	*			cis	-166.6	174.1	20.8	-139.1	-167.7	143.8	0	0	112.8
445	R	28.5	Very low	28.5	Very low	191 Å²	191	151.9 Å²	151.9	72%	0.721	73%	0.725	S	S	*	*			trans	77.3	98.6	151.2	-72.6	173.6	-145	-154.4	4.6	123.4
446	N	24.8	Very low	28.5	Very low	145 Å²	145	152.9 Å²	152.9	78%	0.775	73%	0.73	S	S	*	*				80	135	103.9	-98.3	-13.5	0	0	0	124.8
447	I	27.5	Very low	28.4	Very low	151 Å²	151	155 Å²	155	77%	0.774	74%	0.742	S	S	*	*			trans	97.7	107.2	147.8	-62.3	154.6	0	0	0	119.5
448	I	30.1	Very low	28.6	Very low	155 Å²	155	155.5 Å²	155.5	80%	0.795	75%	0.747	S	S	*	*			trans	-80	143.3	159.3	-62.8	153.7	0	0	0	106.6
449	P	37.4	Very low	28.9	Very low	101 Å²	101	157.1 Å²	157.1	66%	0.656	76%	0.758	S	S	*	*				-161.6	153.7	83.4	43.5	-21.2	0	0	0	122.2
450	R	26.5	Very low	29.1	Very low	194 Å²	194	157.4 Å²	157.4	73%	0.732	76%	0.757	S	S	*	*			trans	67.8	139.5	131.1	-77.5	173.3	175.8	-123.6	7	123.2
451	E	26.1	Very low	29.4	Very low	135 Å²	135	159.5 Å²	159.5	63%	0.631	76%	0.759	S	S	*	*			trans	71.4	143.3	139.1	-71.9	147.3	-162	0	0	116.4
452	E	27.8	Very low	29.6	Very low	178 Å²	178	159.9 Å²	159.9	83%	0.832	76%	0.757	S	S	*	*			cis	-155	160.7	16.4	-130	159.6	-161.1	0	0	111.1
453	K	33.4	Very low	29.9	Very low	193 Å²	193	159.8 Å²	159.8	84%	0.839	76%	0.757	S	S	*	*			trans	-88.4	161.7	160.4	-82	-172.3	179.6	-175.8	0	107.9
454	P	35.2	Very low	29.9	Very low	109 Å²	109	158.3 Å²	158.3	71%	0.708	75%	0.754	S	S	*	*				-163.3	-160.5	63.3	39.6	-12.9	0	0	0	117.9
455	I	26.7	Very low	30.2	Very low	143 Å²	143	160.1 Å²	160.1	73%	0.733	77%	0.766	S	S	*	*			trans	79.8	104.8	164	-57.9	150.4	0	0	0	114
456	E	29.4	Very low	30.3	Very low	176 Å²	176	160.3 Å²	160.3	82%	0.822	77%	0.772	S	S	*	*				71.3	115.9	61.6	-68.1	-174.6	171.1	0	0	114.8
457	D	27.8	Very low	31.6	Very low	170 Å²	170	158.5 Å²	158.5	91%	0.909	77%	0.768	S	S	*	*			trans	-165	134.3	134	-109.7	-26.4	0	0	0	110.3
458	E	32.1	Very low	31.6	Very low	175 Å²	175	156.9 Å²	156.9	82%	0.818	77%	0.77	S	S	*	*			trans	-83.2	168.8	172.9	-62.7	-176	120.4	0	0	111.6
459	I	32	Very low	31.8	Very low	167 Å²	167	157.4 Å²	157.4	86%	0.856	77%	0.774	S	S	*	*				-173.1	134	128	-95.5	151.4	0	0	0	111.1
460	E	31.6	Very low	31.4	Very low	147 Å²	147	155.8 Å²	155.8	69%	0.687	78%	0.776	S	S	*	*			trans	-78.3	163.1	179	-48.6	177	108.8	0	0	115
461	R	32.1	Very low	31.6	Very low	232 Å²	232	151 Å²	151	88%	0.875	77%	0.772	S	S	*	*				176.2	120.2	128.8	-88.9	146.3	-162.9	-139.5	4.8	108.7
462	K	31.5	Very low	32	Very low	159 Å²	159	153 Å²	153	69%	0.691	78%	0.778	S	S	*	*				56.2	133.6	80	-65.4	-168.9	-179.7	-173.1	0	113.1
463	E	31.9	Very low	32.3	Very low	144 Å²	144	152.8 Å²	152.8	67%	0.673	78%	0.775	S	S	*	*			cis	-165.7	160	14.1	-128.6	177	-135.4	0	0	113.2
464	N	28.1	Very low	32.1	Very low	131 Å²	131	150 Å²	150	70%	0.701	77%	0.769	S	S	*	*			trans	43.5	135.6	147.5	-71.5	-36.5	0	0	0	124.4
465	I	33.1	Very low	31.9	Very low	167 Å²	167	153 Å²	153	86%	0.856	78%	0.778	S	S	*	*				-178.8	143.5	108.9	-88.6	157.6	0	0	0	112.1
466	K	32.3	Very low	32.2	Very low	194 Å²	194	152.2 Å²	152.2	84%	0.843	78%	0.775	S	S	*	*			trans	-127.8	-178.8	172	-108.8	-176	-178.7	175.6	0	107
467	P	51.2	Low	32.4	Very low	108 Å²	108	152.3 Å²	152.3	70%	0.701	78%	0.775	S	S	*	*			cis	-138	-178.2	-31.9	39.8	-22.7	0	0	0	113.7
468	S	28.3	Very low	32.7	Very low	117 Å²	117	149.3 Å²	149.3	82%	0.818	77%	0.768	S	S	*	*			trans	-168.4	135.4	142.9	60.1	0	0	0	0	108.8
469	L	32.9	Very low	33.2	Very low	166 Å²	166	148.1 Å²	148.1	87%	0.869	77%	0.765	S	S	*	*			cis	101.5	93.2	12.9	-144.7	175.7	0	0	0	115.6
470	G	29.2	Very low	34.2	Very low	67 Å²	67	146 Å²	146	69%	0.691	76%	0.763	S	S	*	*			trans	101.8	163.5	148	0	0	0	0	0	118.3
471	S	31	Very low	35	Very low	94 Å²	94	144.5 Å²	144.5	66%	0.657	76%	0.763	S	S	*	*			cis	178.9	154.9	-15.7	-138.7	0	0	0	0	110.9
472	K	35	Very low	35.5	Very low	176 Å²	176	141.8 Å²	141.8	77%	0.765	76%	0.76	S	S	*	*			trans	73.6	154.2	152	-64.8	160.7	-172.7	170.7	0	117.1
473	K	33.7	Very low	36.3	Very low	173 Å²	173	142.8 Å²	142.8	75%	0.752	79%	0.787	S	S	*	*			cis	-162.4	157.3	1.6	-124.6	167.9	-175.7	-170.2	0	113.7
474	N	30.1	Very low	36.5	Very low	135 Å²	135	142.8 Å²	142.8	72%	0.722	79%	0.793	S	S	*	*			trans	-20.8	149.7	161.4	-48.2	-14.3	0	0	0	121.1
475	L	30.7	Very low	37	Very low	171 Å²	171	143.4 Å²	143.4	90%	0.895	80%	0.798	S	S	*	*				-168.8	174.4	116.7	-122.8	82.8	0	0	0	108.9
476	L	33.4	Very low	37.2	Very low	127 Å²	127	142.1 Å²	142.1	67%	0.665	80%	0.795	S	S	*	*				-173	145.7	-73.6	-163	150.9	0	0	0	105.5
477	E	31.9	Very low	37.5	Very low	179 Å²	179	139 Å²	139	84%	0.836	79%	0.792	S	S	*	*			trans	68.4	157.2	171.6	-99.2	159.1	179.5	0	0	117.8
478	S	34	Very low	36.6	Very low	107 Å²	107	140.9 Å²	140.9	75%	0.748	80%	0.798	S	S	*	*			cis	-155	162.1	10.8	39.5	0	0	0	0	113.7
479	I	43.3	Very low	37.2	Very low	149 Å²	149	142.5 Å²	142.5	76%	0.764	80%	0.796	S	S	*	*			trans	-79.9	156.6	167.4	-60.8	161.7	0	0	0	110
480	P	53.6	Low	37.5	Very low	124 Å²	124	140.9 Å²	140.9	81%	0.805	79%	0.791	S	S	*	*				-135.2	151.7	129	28.6	-12.5	0	0	0	115
481	T	47.9	Very low	38.1	Very low	114 Å²	114	146.5 Å²	146.5	70%	0.699	80%	0.799	S	S	*	*			trans	-86.8	154.7	177.1	46.4	0	0	0	0	113.1
482	H	41.5	Very low	38.7	Very low	176 Å²	176	150.9 Å²	150.9	82%	0.815	81%	0.811	S	S	*	*			trans	160.9	143.4	137.7	-95.9	-68.4	0	0	0	109.9
483	S	49.4	Very low	39	Very low	180 Å²	180	148.6 Å²	148.6	100%	1.259	82%	0.815	S	S	*	*			cis	-142	0	4.9	-75	0	0	0	0	111.2

Retrieved 483 of 483 residues in 129.3 ms (Link to these results)

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