A0A077Z8V5_TRITR Loading...

Rrna methyltransferase 3

AlphaFold DB , UniProt , Accession A0A077Z8V5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 463 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	39	Very low	42.6	Very low	244 Å²	244	165.8 Å²	165.8	100%	1.202	81%	0.811	S	S	*	*				0	115.5	0	-62.7	-162.5	-159.8	0	0	109
2	G	40.7	Very low	43.1	Very low	71 Å²	71	156.8 Å²	156.8	73%	0.732	77%	0.769	S	S	*	*			trans	-66.5	135.4	179.6	0	0	0	0	0	110.8	Q4	G2-Q4 VanDerWaalsContact C-N 3.27Å; G2-Q4 PolarHBondContact O-N 3.39Å
3	K	44.6	Very low	43.1	Very low	213 Å²	213	157.9 Å²	157.9	93%	0.926	77%	0.767	S	S	*	*			trans	-63	88.9	172.9	-72.2	-179.4	177.9	177.5	0	108.5	K5	K3-K5 PolarHBondContact O-N 3.23Å
4	Q	40.7	Very low	43.2	Very low	166 Å²	166	158 Å²	158	78%	0.776	76%	0.757	S	S	*	*			trans	-59	135.6	173.7	-80.9	178.8	-19.4	0	0	108.7	G2 I6	G2-Q4 VanDerWaalsContact C-N 3.27Å; G2-Q4 PolarHBondContact O-N 3.39Å; Q4-I6 VanDerWaalsContact C-N 3.34Å; Q4-I6 WeakPolarHBondContact O-CG1 3.33Å; Q4-I6 PolarHBondContact O-N 3.16Å
5	K	40.6	Very low	43.3	Very low	212 Å²	212	156.7 Å²	156.7	92%	0.922	74%	0.743	S	S	*	*			trans	-67.1	88.6	-179.3	-70.9	177.7	177.7	176.5	0	109.4	K3 G7	K3-K5 PolarHBondContact O-N 3.23Å; K5-G7 PolarHBondContact O-N 3.49Å
6	I	45	Very low	43.4	Very low	126 Å²	126	150.9 Å²	150.9	65%	0.646	73%	0.729	S	S	*	*			trans	-76	53.8	177.4	-57.9	149.1	0	0	0	109.6	Q4 R10	Q4-I6 VanDerWaalsContact C-N 3.34Å; Q4-I6 WeakPolarHBondContact O-CG1 3.33Å; Q4-I6 PolarHBondContact O-N 3.16Å; I6-R10 HydrophobicContact CG2-CB 4.44Å; I6-R10 HydrophobicContact CG2-CG 3.92Å
7	G	44.3	Very low	43.4	Very low	70 Å²	70	143.5 Å²	143.5	72%	0.722	69%	0.694	S	S	*	*	S	Bend	trans	-89.3	-26.6	-171.4	0	0	0	0	0	114.7	K5	K5-G7 PolarHBondContact O-N 3.49Å
8	K	41.3	Very low	43.5	Very low	181 Å²	181	138.8 Å²	138.8	79%	0.787	68%	0.682	S	S	*	*	S	Bend	trans	-119.1	-23.2	-171.4	-76.4	-176.5	176.8	178	0	115.5
9	Q	44.6	Very low	43.3	Very low	188 Å²	188	139.7 Å²	139.7	88%	0.879	68%	0.682	S	S	*	*	S	Bend	trans	-86.4	-21.6	-175.3	-77.3	177.9	-7.9	0	0	114.1	R11	Q9-R11 PolarHBondContact O-N 3.29Å; Q9-R11 VanDerWaalsContact O-N 3.08Å
10	R	42.9	Very low	43.5	Very low	171 Å²	171	137.5 Å²	137.5	65%	0.645	67%	0.67	S	S	*	*			trans	-83.4	44.8	167.8	-77.6	-169.6	73.4	-179	1.7	112.4	I6 D12	I6-R10 HydrophobicContact CG2-CB 4.44Å; I6-R10 HydrophobicContact CG2-CG 3.92Å; R10-D12 WeakPolarHBondContact CB-OD1 3.31Å; R10-D12 IonicContact CZ-OD2 2.77Å; R10-D12 IonicContact NE-OD1 3.1Å; R10-D12 PolarHBondContact NE-OD1 3.26Å; R10-D12 IonicContact NE-OD2 2.78Å; R10-D12 PolarHBondContact NE-OD2 3.07Å; R10-D12 IonicContact NH2-OD1 2.67Å; R10-D12 IonicContact NH2-OD2 3.89Å; R10-D12 PolarHBondContact NH2-OD2 2.82Å; R10-D12 PolarHBondContact O-N 3.26Å
11	R	44.9	Very low	43.4	Very low	182 Å²	182	133.1 Å²	133.1	69%	0.687	66%	0.657	S	S	*	*			trans	-69.2	72.7	151.1	-75.3	-179.2	176.4	166.8	-0.3	105.5	Q9	Q9-R11 PolarHBondContact O-N 3.29Å; Q9-R11 VanDerWaalsContact O-N 3.08Å
12	D	48.4	Very low	43.7	Very low	57 Å²	57	123.9 Å²	123.9	31%	0.305	61%	0.612	S	S	.	*			trans	-51.4	152.5	-179.6	-72	-12.6	0	0	0	107.7	R10 Y14 Y15	R10-D12 WeakPolarHBondContact CB-OD1 3.31Å; R10-D12 IonicContact CZ-OD2 2.77Å; R10-D12 IonicContact NE-OD1 3.1Å; R10-D12 PolarHBondContact NE-OD1 3.26Å; R10-D12 IonicContact NE-OD2 2.78Å; R10-D12 PolarHBondContact NE-OD2 3.07Å; R10-D12 IonicContact NH2-OD1 2.67Å; R10-D12 IonicContact NH2-OD2 3.89Å; R10-D12 PolarHBondContact NH2-OD2 2.82Å; R10-D12 PolarHBondContact O-N 3.26Å; D12-Y14 HydrophobicContact CB-CD2 3.92Å; D12-Y14 PolarHBondContact O-N 2.85Å; D12-Y15 WeakPolarHBondContact O-CB 3.36Å; D12-Y15 PolarHBondContact O-N 2.75Å
13	K	43.3	Very low	43.8	Very low	172 Å²	172	124 Å²	124	75%	0.748	59%	0.592	S	S	*	*	H	α-helix	trans	-41.2	-33.4	176.1	-164.3	177	-179	-177.1	0	112.5	A16 L17	K13-A16 PolarHBondContact O-N 3.44Å; K13-L17 WeakPolarHBondContact O-CD1 3.48Å; K13-L17 PolarHBondContact O-N 3.03Å
14	Y	44.4	Very low	43.5	Very low	159 Å²	159	117.9 Å²	117.9	62%	0.624	58%	0.576	S	S	*	*	H	α-helix	trans	-64.6	-31.9	175.8	-51.2	-66.5	0	0	0	115.6	D12 L17 A18	D12-Y14 HydrophobicContact CB-CD2 3.92Å; D12-Y14 PolarHBondContact O-N 2.85Å; Y14-L17 PolarHBondContact O-N 3Å; Y14-A18 WeakPolarHBondContact O-CB 3.06Å; Y14-A18 PolarHBondContact O-N 3.48Å
15	Y	45.3	Very low	43.5	Very low	139 Å²	139	112.2 Å²	112.2	55%	0.545	56%	0.555	S	S	.	*	H	α-helix	trans	-71.5	-34.2	179.7	-160.1	-87.6	0	0	0	111.9	D12 K19	D12-Y15 WeakPolarHBondContact O-CB 3.36Å; D12-Y15 PolarHBondContact O-N 2.75Å; Y15-K19 HydrophobicContact CE1-CD 4.46Å; Y15-K19 WeakPolarHBondContact O-CB 3.38Å; Y15-K19 PolarHBondContact O-N 3.14Å; Y15-K19 VanDerWaalsContact O-N 3.08Å
16	A	45.2	Very low	43.6	Very low	63 Å²	63	102.7 Å²	102.7	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-65.5	-45.9	172.9	0	0	0	0	0	110.7	K13 A18 K19 E20	K13-A16 PolarHBondContact O-N 3.44Å; A16-A18 PolarHBondContact O-N 3.16Å; A16-K19 CarbonylContact O-C 3.54Å; A16-K19 WeakPolarHBondContact O-CA 3.39Å; A16-K19 WeakPolarHBondContact O-CB 3.29Å; A16-K19 PolarHBondContact O-N 3.41Å; A16-K19 VanDerWaalsContact O-N 3.07Å; A16-E20 PolarHBondContact O-N 3.07Å
17	L	42.4	Very low	43.7	Very low	25 Å²	25	98.9 Å²	98.9	13%	0.131	49%	0.491	C	S	.	.	H	α-helix	trans	-65.2	-33.3	176	-76.5	153.7	0	0	0	113.9	K13 Y14 K19 A40	K13-L17 WeakPolarHBondContact O-CD1 3.48Å; K13-L17 PolarHBondContact O-N 3.03Å; Y14-L17 PolarHBondContact O-N 3Å; L17-K19 VanDerWaalsContact C-N 3.3Å; L17-A40 HydrophobicContact CD1-CB 3.3Å; L17-A40 HydrophobicContact CD2-CB 4.23Å; L17-A40 HydrophobicContact CG-CB 4.39Å
18	A	44.9	Very low	43.7	Very low	59 Å²	59	95.5 Å²	95.5	49%	0.488	46%	0.457	S	S	.	.	H	α-helix	trans	-72.5	-26.9	172.8	0	0	0	0	0	112.1	Y14 A16	Y14-A18 WeakPolarHBondContact O-CB 3.06Å; Y14-A18 PolarHBondContact O-N 3.48Å; A16-A18 PolarHBondContact O-N 3.16Å
19	K	41.3	Very low	44.3	Very low	156 Å²	156	88 Å²	88	68%	0.678	42%	0.424	S	S	*	.	H	α-helix	trans	-78.5	-31.1	173.6	-107.4	-166.9	173.8	-164.8	0	112.7	Y15 A16 L17 A21	Y15-K19 HydrophobicContact CE1-CD 4.46Å; Y15-K19 WeakPolarHBondContact O-CB 3.38Å; Y15-K19 PolarHBondContact O-N 3.14Å; Y15-K19 VanDerWaalsContact O-N 3.08Å; A16-K19 CarbonylContact O-C 3.54Å; A16-K19 WeakPolarHBondContact O-CA 3.39Å; A16-K19 WeakPolarHBondContact O-CB 3.29Å; A16-K19 PolarHBondContact O-N 3.41Å; A16-K19 VanDerWaalsContact O-N 3.07Å; L17-K19 VanDerWaalsContact C-N 3.3Å; K19-A21 VanDerWaalsContact C-N 3.27Å; K19-A21 PolarHBondContact O-N 2.9Å
20	E	45.7	Very low	44.8	Very low	95 Å²	95	79.2 Å²	79.2	44%	0.444	38%	0.383	S	S	.	.	S	Bend	trans	-59.1	102.7	158.3	-69.4	-173.3	179.3	0	0	105.6	A16 I22	A16-E20 PolarHBondContact O-N 3.07Å; E20-I22 HydrophobicContact CB-CD1 4.35Å; E20-I22 HydrophobicContact CB-CG1 4.38Å; E20-I22 PolarHBondContact O-N 3.31Å
21	A	43	Very low	44.9	Very low	47 Å²	47	71.7 Å²	71.7	39%	0.388	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	13.2	-167	0	0	0	0	0	115.1	K19 S25	K19-A21 VanDerWaalsContact C-N 3.27Å; K19-A21 PolarHBondContact O-N 2.9Å; A21-S25 PolarHBondContact O-OG 2.66Å
22	I	44.6	Very low	44.5	Very low	50 Å²	50	63.9 Å²	63.9	26%	0.256	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-49.4	-176.4	-57.2	-179.5	0	0	0	109.5	E20 F26 L61	E20-I22 HydrophobicContact CB-CD1 4.35Å; E20-I22 HydrophobicContact CB-CG1 4.38Å; E20-I22 PolarHBondContact O-N 3.31Å; I22-F26 WeakPolarHBondContact O-CD2 3.16Å; I22-F26 WeakPolarHBondContact O-CE2 3.35Å; I22-L61 HydrophobicContact CB-CD2 4.3Å; I22-L61 HydrophobicContact CD1-CD2 4.27Å; I22-L61 HydrophobicContact CG1-CD2 3.89Å; I22-L61 HydrophobicContact CG2-CD1 3.62Å; I22-L61 HydrophobicContact CG2-CD2 3.79Å; I22-L61 HydrophobicContact CG2-CG 4.28Å
23	F	41.8	Very low	43.8	Very low	73 Å²	73	62.4 Å²	62.4	32%	0.32	32%	0.324	S	S	.	.	S	Bend	trans	-88.6	-32.5	-171.9	-66.8	-79.1	0	0	0	114.6	S25 F26 F29	F23-S25 PolarHBondContact O-N 3.13Å; F23-S25 VanDerWaalsContact O-N 3.09Å; F23-F26 PolarHBondContact O-N 2.75Å; F23-F29 HydrophobicContact CD1-CD2 4.34Å; F23-F29 AromaticContact CD1-CE2 3.83Å; F23-F29 HydrophobicContact CD1-CE2 3.83Å; F23-F29 HydrophobicContact CD1-CZ 4.43Å; F23-F29 AromaticContact CE1-CE2 3.59Å; F23-F29 HydrophobicContact CE1-CE2 3.59Å; F23-F29 AromaticContact CE1-CZ 3.88Å; F23-F29 HydrophobicContact CE1-CZ 3.88Å
24	S	39.8	Very low	43.3	Very low	84 Å²	84	62.6 Å²	62.6	59%	0.587	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-10.8	-179.6	66.3	0	0	0	0	113.7
25	S	40	Very low	42.5	Very low	47 Å²	47	58.8 Å²	58.8	33%	0.329	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-4.2	-176.6	-54.8	0	0	0	0	112.9	A21 F23 D54	A21-S25 PolarHBondContact O-OG 2.66Å; F23-S25 PolarHBondContact O-N 3.13Å; F23-S25 VanDerWaalsContact O-N 3.09Å; S25-D54 VanDerWaalsContact O-OD2 3.1Å
26	F	43.4	Very low	41.7	Very low	12 Å²	12	56.3 Å²	56.3	5%	0.053	33%	0.328	C	S	.	.			trans	-103	125.3	-176.9	-68.1	-70.8	0	0	0	112.1	I22 F23 F29 I58 L61 T66	I22-F26 WeakPolarHBondContact O-CD2 3.16Å; I22-F26 WeakPolarHBondContact O-CE2 3.35Å; F23-F26 PolarHBondContact O-N 2.75Å; F26-F29 HydrophobicContact CD2-CD2 4.28Å; F26-I58 HydrophobicContact CD1-CD1 3.27Å; F26-I58 HydrophobicContact CE1-CD1 3.2Å; F26-I58 HydrophobicContact CE1-CG1 4.41Å; F26-I58 HydrophobicContact CE1-CG2 3.95Å; F26-I58 HydrophobicContact CG-CD1 4.36Å; F26-I58 HydrophobicContact CZ-CD1 4.26Å; F26-I58 HydrophobicContact CZ-CG2 4.04Å; F26-L61 HydrophobicContact CE2-CD1 3.68Å; F26-L61 HydrophobicContact CZ-CD1 3.52Å; F26-T66 HydrophobicContact CE1-CG2 4.03Å; F26-T66 HydrophobicContact CZ-CG2 4.06Å
27	R	45.5	Very low	41.1	Very low	46 Å²	46	56 Å²	56	17%	0.174	32%	0.321	C	S	.	.	S	Bend	trans	-81.6	-32.4	176.2	-161.3	149.9	168	122.2	-7.4	112.2	V53 D54 H94 D95 G96 S97	R27-V53 WeakPolarHBondContact CB-O 3.06Å; R27-V53 PolarHBondContact N-O 2.93Å; R27-D54 HydrophobicContact CB-CB 4.3Å; R27-D54 WeakPolarHBondContact CD-OD1 3.49Å; R27-H94 PolarHBondContact O-CD2 3.42Å; R27-D95 CarbonylContact O-C 3.5Å; R27-D95 PolarHBondContact O-N 3.48Å; R27-G96 PolarHBondContact O-N 2.78Å; R27-S97 PolarHBondContact NH1-O 2.91Å; R27-S97 VanDerWaalsContact NH2-C 3.33Å; R27-S97 PolarHBondContact NH2-O 2.87Å
28	C	46.3	Very low	40.6	Very low	0 Å²	0	59 Å²	59	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	128	168.8	-166.6	0	0	0	0	109.2	G52 V53 I71 L93	C28-G52 WeakPolarHBondContact O-CA 3.49Å; C28-V53 HydrophobicContact CB-CB 4.33Å; C28-V53 PolarHBondContact N-O 3.49Å; C28-V53 VanDerWaalsContact N-O 3.11Å; C28-V53 PolarHBondContact O-N 3.28Å; C28-I71 HydrophobicContact CB-CG2 4.22Å; C28-L93 CarbonylContact C-O 3.5Å; C28-L93 VanDerWaalsContact CA-O 3.29Å; C28-L93 WeakPolarHBondContact CA-O 3.27Å
29	F	53.7	Low	39.8	Very low	24 Å²	24	62.7 Å²	62.7	11%	0.105	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.9	-179.9	-176.3	-86.9	0	0	0	108.9	F23 F26 V50 V92 L93	F23-F29 HydrophobicContact CD1-CD2 4.34Å; F23-F29 AromaticContact CD1-CE2 3.83Å; F23-F29 HydrophobicContact CD1-CE2 3.83Å; F23-F29 HydrophobicContact CD1-CZ 4.43Å; F23-F29 AromaticContact CE1-CE2 3.59Å; F23-F29 HydrophobicContact CE1-CE2 3.59Å; F23-F29 AromaticContact CE1-CZ 3.88Å; F23-F29 HydrophobicContact CE1-CZ 3.88Å; F26-F29 HydrophobicContact CD2-CD2 4.28Å; F29-V50 HydrophobicContact CD2-CG1 4.06Å; F29-V50 HydrophobicContact CE1-CG1 4.35Å; F29-V50 HydrophobicContact CE2-CB 4.5Å; F29-V50 HydrophobicContact CE2-CG1 3.17Å; F29-V50 HydrophobicContact CZ-CB 4.31Å; F29-V50 HydrophobicContact CZ-CG1 3.34Å; F29-V50 HydrophobicContact CZ-CG2 4.08Å; F29-V92 CarbonylContact O-C 3.55Å; F29-V92 VanDerWaalsContact O-CA 3.31Å; F29-V92 WeakPolarHBondContact O-CA 3.33Å; F29-L93 HydrophobicContact CB-CB 4.01Å; F29-L93 HydrophobicContact CB-CD1 4.25Å; F29-L93 HydrophobicContact CB-CG 4.34Å; F29-L93 HydrophobicContact CD1-CD1 3.78Å; F29-L93 HydrophobicContact CD1-CG 4.15Å; F29-L93 HydrophobicContact CE1-CD1 4.46Å; F29-L93 HydrophobicContact CG-CD1 4.2Å; F29-L93 PolarHBondContact N-O 3.33Å; F29-L93 PolarHBondContact O-N 3.28Å
30	V	53.7	Low	39.4	Very low	3 Å²	3	57.2 Å²	57.2	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	109.6	177.8	-174.4	0	0	0	0	107.1	G51 L84 A89 V92 I125	V30-G51 PolarHBondContact N-O 3.44Å; V30-G51 PolarHBondContact O-N 2.91Å; V30-L84 HydrophobicContact CG1-CD1 4.35Å; V30-L84 HydrophobicContact CG1-CD2 4.18Å; V30-A89 HydrophobicContact CG1-CB 3.35Å; V30-V92 HydrophobicContact CG2-CG2 4.45Å; V30-I125 HydrophobicContact CG1-CD1 3.97Å; V30-I125 HydrophobicContact CG2-CD1 3.68Å
31	G	46.1	Very low	39	Very low	12 Å²	12	56.9 Å²	56.9	12%	0.124	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	130.1	174.9	0	0	0	0	0	111	D90 C91	G31-D90 PolarHBondContact O-N 3.08Å; G31-C91 PolarHBondContact N-O 2.8Å; G31-C91 PolarHBondContact O-N 2.75Å; G31-C91 VanDerWaalsContact O-N 3.17Å
32	L	35.9	Very low	38.5	Very low	19 Å²	19	58.5 Å²	58.5	10%	0.099	33%	0.331	C	S	.	.			trans	-106.4	121.1	167.9	-66.3	167.8	0	0	0	108.5	Y48 A49 L84 W87 N88 D90	L32-Y48 WeakPolarHBondContact O-CD1 3.3Å; L32-A49 WeakPolarHBondContact CB-O 3.45Å; L32-A49 HydrophobicContact CD1-CB 3.53Å; L32-A49 WeakPolarHBondContact CD1-O 3.34Å; L32-L84 HydrophobicContact CD1-CD2 3.71Å; L32-L84 HydrophobicContact CD2-CD2 4.29Å; L32-L84 HydrophobicContact CG-CD2 4.25Å; L32-W87 HydrophobicContact CD1-CB 4.4Å; L32-W87 HydrophobicContact CD2-CB 4.25Å; L32-N88 VanDerWaalsContact CD2-C 3.46Å; L32-N88 WeakPolarHBondContact CD2-O 3.47Å; L32-D90 VanDerWaalsContact CA-OD2 3.27Å; L32-D90 WeakPolarHBondContact CA-OD2 3.44Å
33	S	34.9	Very low	38.1	Very low	25 Å²	25	61.5 Å²	61.5	18%	0.175	35%	0.352	C	S	.	.			trans	-170.6	143.8	172.7	67.6	0	0	0	0	112	S35 D90	S33-S35 PolarHBondContact O-N 2.79Å; S33-S35 VanDerWaalsContact O-N 3.08Å; S33-S35 PolarHBondContact OG-O 2.93Å; S33-D90 PolarHBondContact N-OD2 2.9Å; S33-D90 WeakPolarHBondContact O-CB 3.5Å
34	E	31.3	Very low	38	Very low	176 Å²	176	67.2 Å²	67.2	82%	0.822	38%	0.38	S	S	*	.	S	Bend	trans	-66.9	-9.8	173.5	-69.1	-171.2	149.9	0	0	115.1
35	S	27.2	Very low	37.7	Very low	80 Å²	80	66 Å²	66	56%	0.559	37%	0.371	S	S	*	.	S	Bend	trans	-124.7	151.4	-170.8	-63.1	0	0	0	0	114.3	S33 C37	S33-S35 PolarHBondContact O-N 2.79Å; S33-S35 VanDerWaalsContact O-N 3.08Å; S33-S35 PolarHBondContact OG-O 2.93Å; S35-C37 PolarHBondContact O-N 2.85Å
36	S	30.4	Very low	37.5	Very low	87 Å²	87	73.1 Å²	73.1	61%	0.608	40%	0.399	S	S	*	.	S	Bend	trans	-49.2	122.6	-173.5	57.4	0	0	0	0	115
37	C	30.9	Very low	37.4	Very low	55 Å²	55	79.2 Å²	79.2	37%	0.372	43%	0.432	S	S	.	.	S	Bend	trans	35.8	106.9	154.2	55.3	0	0	0	0	118.5	S35 Q39 W131	S35-C37 PolarHBondContact O-N 2.85Å; C37-Q39 PolarHBondContact O-N 3.01Å; C37-Q39 VanDerWaalsContact O-N 3.13Å; C37-W131 HydrophobicContact CB-CE3 3.96Å; C37-W131 HydrophobicContact CB-CH2 4.29Å; C37-W131 HydrophobicContact CB-CZ3 3.75Å; C37-W131 VanDerWaalsContact SG-CZ3 3.56Å
38	V	33.2	Very low	37.5	Very low	88 Å²	88	80 Å²	80	53%	0.533	44%	0.435	S	S	.	.			trans	51.7	47.1	143.3	-159.3	0	0	0	0	114.1	A40 L93	V38-A40 PolarHBondContact O-N 3.28Å; V38-L93 HydrophobicContact CG2-CD1 4.16Å
39	Q	26.7	Very low	38	Very low	137 Å²	137	82 Å²	82	64%	0.64	45%	0.452	S	S	*	.			trans	-70.9	111.6	151.4	-75.2	-174.5	-13.6	0	0	106.7	C37 Y41	C37-Q39 PolarHBondContact O-N 3.01Å; C37-Q39 VanDerWaalsContact O-N 3.13Å; Q39-Y41 HydrophobicContact CB-CE2 4.37Å; Q39-Y41 WeakPolarHBondContact O-CD2 3.45Å; Q39-Y41 WeakPolarHBondContact O-CE2 2.99Å; Q39-Y41 PolarHBondContact O-N 3.4Å; Q39-Y41 VanDerWaalsContact O-N 3.13Å
40	A	32.7	Very low	38.3	Very low	41 Å²	41	82.4 Å²	82.4	34%	0.339	46%	0.456	S	S	.	.			trans	-15.1	105.9	154.5	0	0	0	0	0	114.5	L17 V38	L17-A40 HydrophobicContact CD1-CB 3.3Å; L17-A40 HydrophobicContact CD2-CB 4.23Å; L17-A40 HydrophobicContact CG-CB 4.39Å; V38-A40 PolarHBondContact O-N 3.28Å
41	Y	37.6	Very low	39.2	Very low	89 Å²	89	83 Å²	83	35%	0.349	46%	0.464	S	S	.	.			trans	-112.1	102.4	174.6	-72.8	-67.3	0	0	0	110.8	Q39 Y48	Q39-Y41 HydrophobicContact CB-CE2 4.37Å; Q39-Y41 WeakPolarHBondContact O-CD2 3.45Å; Q39-Y41 WeakPolarHBondContact O-CE2 2.99Å; Q39-Y41 PolarHBondContact O-N 3.4Å; Q39-Y41 VanDerWaalsContact O-N 3.13Å; Y41-Y48 AromaticContact CD1-CD2 3.97Å; Y41-Y48 HydrophobicContact CD1-CD2 3.97Å; Y41-Y48 AromaticContact CD1-CE2 3.75Å; Y41-Y48 HydrophobicContact CD1-CE2 3.75Å; Y41-Y48 HydrophobicContact CD2-CD2 4.04Å; Y41-Y48 HydrophobicContact CD2-CE2 4.2Å; Y41-Y48 HydrophobicContact CE1-CD2 4Å; Y41-Y48 AromaticContact CE1-CE2 3.33Å; Y41-Y48 HydrophobicContact CE1-CE2 3.33Å; Y41-Y48 HydrophobicContact CE2-CD2 4.06Å; Y41-Y48 AromaticContact CE2-CE2 3.83Å; Y41-Y48 HydrophobicContact CE2-CE2 3.83Å; Y41-Y48 HydrophobicContact CE2-CG 4.5Å; Y41-Y48 HydrophobicContact CG-CD2 4.02Å; Y41-Y48 HydrophobicContact CG-CE2 4.19Å; Y41-Y48 AromaticContact CZ-CE2 3.38Å; Y41-Y48 AromaticContact CZ-CZ 3.65Å; Y41-Y48 PolarHBondContact OH-OH 2.81Å
42	T	33.2	Very low	40.7	Very low	80 Å²	80	82.5 Å²	82.5	49%	0.491	46%	0.458	S	S	.	.			trans	-142.4	59	157.1	56.9	0	0	0	0	107.7
43	T	37	Very low	43	Very low	113 Å²	113	81.7 Å²	81.7	69%	0.693	45%	0.454	S	S	*	.	S	Bend	trans	-175.7	108.6	165.2	21.8	0	0	0	0	109.3	S45	T43-S45 PolarHBondContact O-N 3.47Å
44	E	37.7	Very low	45.3	Very low	193 Å²	193	81.7 Å²	81.7	90%	0.902	45%	0.452	S	S	*	.	S	Bend	trans	76.7	15.3	145.4	-64.7	-179.1	162.4	0	0	123
45	S	34	Very low	47.7	Very low	58 Å²	58	77 Å²	77	41%	0.406	43%	0.432	S	S	.	.			trans	-115.5	112.8	172.8	-160.4	0	0	0	0	112.6	T43 L47 Y48	T43-S45 PolarHBondContact O-N 3.47Å; S45-L47 PolarHBondContact O-N 3.33Å; S45-L47 VanDerWaalsContact O-N 3.07Å; S45-Y48 WeakPolarHBondContact OG-CE2 3.34Å
46	E	36.6	Very low	50.4	Low	197 Å²	197	77.5 Å²	77.5	92%	0.921	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	14.9	-171.7	-65.7	-174.9	146.8	0	0	115.5
47	L	41	Very low	52.7	Low	141 Å²	141	77.7 Å²	77.7	74%	0.738	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138	31.1	-172.5	-145.9	82	0	0	0	115.5	S45	S45-L47 PolarHBondContact O-N 3.33Å; S45-L47 VanDerWaalsContact O-N 3.07Å
48	Y	47.3	Very low	54.9	Low	61 Å²	61	76.2 Å²	76.2	24%	0.239	42%	0.419	C	S	.	.			trans	-116.3	100.9	173.5	-55.5	-56.6	0	0	0	110.4	L32 Y41 S45 V50	L32-Y48 WeakPolarHBondContact O-CD1 3.3Å; Y41-Y48 AromaticContact CD1-CD2 3.97Å; Y41-Y48 HydrophobicContact CD1-CD2 3.97Å; Y41-Y48 AromaticContact CD1-CE2 3.75Å; Y41-Y48 HydrophobicContact CD1-CE2 3.75Å; Y41-Y48 HydrophobicContact CD2-CD2 4.04Å; Y41-Y48 HydrophobicContact CD2-CE2 4.2Å; Y41-Y48 HydrophobicContact CE1-CD2 4Å; Y41-Y48 AromaticContact CE1-CE2 3.33Å; Y41-Y48 HydrophobicContact CE1-CE2 3.33Å; Y41-Y48 HydrophobicContact CE2-CD2 4.06Å; Y41-Y48 AromaticContact CE2-CE2 3.83Å; Y41-Y48 HydrophobicContact CE2-CE2 3.83Å; Y41-Y48 HydrophobicContact CE2-CG 4.5Å; Y41-Y48 HydrophobicContact CG-CD2 4.02Å; Y41-Y48 HydrophobicContact CG-CE2 4.19Å; Y41-Y48 AromaticContact CZ-CE2 3.38Å; Y41-Y48 AromaticContact CZ-CZ 3.65Å; Y41-Y48 PolarHBondContact OH-OH 2.81Å; S45-Y48 WeakPolarHBondContact OG-CE2 3.34Å; Y48-V50 PolarHBondContact O-N 3.38Å
49	A	56.4	Low	57.1	Low	43 Å²	43	81.6 Å²	81.6	36%	0.355	43%	0.43	S	S	.	.			trans	-80.4	104.4	169	0	0	0	0	0	108.7	L32	L32-A49 WeakPolarHBondContact CB-O 3.45Å; L32-A49 HydrophobicContact CD1-CB 3.53Å; L32-A49 WeakPolarHBondContact CD1-O 3.34Å
50	V	61.5	Low	59.5	Low	32 Å²	32	80.8 Å²	80.8	19%	0.194	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.3	174.6	171.5	0	0	0	0	108.5	F29 Y48 A64 I65	F29-V50 HydrophobicContact CD2-CG1 4.06Å; F29-V50 HydrophobicContact CE1-CG1 4.35Å; F29-V50 HydrophobicContact CE2-CB 4.5Å; F29-V50 HydrophobicContact CE2-CG1 3.17Å; F29-V50 HydrophobicContact CZ-CB 4.31Å; F29-V50 HydrophobicContact CZ-CG1 3.34Å; F29-V50 HydrophobicContact CZ-CG2 4.08Å; Y48-V50 PolarHBondContact O-N 3.38Å; V50-A64 HydrophobicContact CB-CB 4.04Å; V50-A64 HydrophobicContact CG1-CB 4.05Å; V50-A64 CarbonylContact O-C 3.52Å; V50-A64 VanDerWaalsContact O-CA 3.31Å; V50-A64 WeakPolarHBondContact O-CA 3.41Å; V50-I65 PolarHBondContact O-N 3.07Å
51	G	71.7	Confident	61.4	Low	17 Å²	17	80.5 Å²	80.5	18%	0.175	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.2	175.2	0	0	0	0	0	111	V30 I65	V30-G51 PolarHBondContact N-O 3.44Å; V30-G51 PolarHBondContact O-N 2.91Å; G51-I65 CarbonylContact C-O 3.49Å; G51-I65 WeakPolarHBondContact CA-O 3.36Å
52	G	78.3	Confident	63	Low	1 Å²	1	81.7 Å²	81.7	1%	0.01	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	136.5	177.6	0	0	0	0	0	113.2	C28 I65 T66 I67	C28-G52 WeakPolarHBondContact O-CA 3.49Å; G52-I65 PolarHBondContact N-O 3.45Å; G52-T66 CarbonylContact O-C 3.49Å; G52-T66 WeakPolarHBondContact O-CA 3.47Å; G52-I67 PolarHBondContact O-N 2.89Å
53	V	83	Confident	64.7	Low	2 Å²	2	84.9 Å²	84.9	1%	0.012	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.2	-177.2	-173.7	0	0	0	0	110.1	R27 C28 I67 I71 C76 V80	R27-V53 WeakPolarHBondContact CB-O 3.06Å; R27-V53 PolarHBondContact N-O 2.93Å; C28-V53 HydrophobicContact CB-CB 4.33Å; C28-V53 PolarHBondContact N-O 3.49Å; C28-V53 VanDerWaalsContact N-O 3.11Å; C28-V53 PolarHBondContact O-N 3.28Å; V53-I67 WeakPolarHBondContact CA-O 3.49Å; V53-I67 HydrophobicContact CG2-CB 4.32Å; V53-I71 HydrophobicContact CB-CG2 4.33Å; V53-I71 HydrophobicContact CG1-CG2 3.81Å; V53-C76 WeakPolarHBondContact CG1-SG 3.43Å; V53-V80 HydrophobicContact CG2-CG2 3.57Å
54	D	83.1	Confident	66.3	Low	25 Å²	25	80.6 Å²	80.6	13%	0.134	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	157.4	168.8	-164	8	0	0	0	111.5	S25 R27 V56 I58 I67 Q68 G69	S25-D54 VanDerWaalsContact O-OD2 3.1Å; R27-D54 HydrophobicContact CB-CB 4.3Å; R27-D54 WeakPolarHBondContact CD-OD1 3.49Å; D54-V56 VanDerWaalsContact C-N 3.29Å; D54-I58 HydrophobicContact CB-CD1 3.66Å; D54-I58 HydrophobicContact CB-CG1 3.97Å; D54-I67 PolarHBondContact N-O 3.41Å; D54-Q68 CarbonylContact O-C 3.6Å; D54-Q68 WeakPolarHBondContact O-CA 3.37Å; D54-G69 CarbonylContact C-O 3.49Å; D54-G69 PolarHBondContact O-N 2.96Å
55	L	81.9	Confident	68.3	Low	76 Å²	76	74.1 Å²	74.1	40%	0.398	41%	0.409	S	S	.	.	S	Bend	trans	-66	-35.7	171.5	-69.4	171.5	0	0	0	111.3	Q68 D70	L55-Q68 PolarHBondContact O-NE2 3.5Å; L55-Q68 VanDerWaalsContact O-NE2 3.14Å; L55-D70 VanDerWaalsContact CD2-CA 3.48Å; L55-D70 HydrophobicContact CD2-CB 3.4Å; L55-D70 VanDerWaalsContact CD2-CB 3.4Å
56	V	83.4	Confident	70.5	Confident	92 Å²	92	73.5 Å²	73.5	56%	0.558	40%	0.403	S	S	*	.	S	Bend	trans	-87.6	140.8	-179.4	-180	0	0	0	0	109.3	D54 I58	D54-V56 VanDerWaalsContact C-N 3.29Å; V56-I58 PolarHBondContact O-N 2.85Å
57	P	80.1	Confident	72.7	Confident	90 Å²	90	65.3 Å²	65.3	58%	0.584	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-60.9	126.1	177.1	25.3	-35	0	0	0	110.9
58	I	76.5	Confident	74.8	Confident	25 Å²	25	64.6 Å²	64.6	13%	0.128	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-94.2	134.8	179.4	-48.4	179.8	0	0	0	107.6	F26 D54 V56 L61 T66	F26-I58 HydrophobicContact CD1-CD1 3.27Å; F26-I58 HydrophobicContact CE1-CD1 3.2Å; F26-I58 HydrophobicContact CE1-CG1 4.41Å; F26-I58 HydrophobicContact CE1-CG2 3.95Å; F26-I58 HydrophobicContact CG-CD1 4.36Å; F26-I58 HydrophobicContact CZ-CD1 4.26Å; F26-I58 HydrophobicContact CZ-CG2 4.04Å; D54-I58 HydrophobicContact CB-CD1 3.66Å; D54-I58 HydrophobicContact CB-CG1 3.97Å; V56-I58 PolarHBondContact O-N 2.85Å; I58-L61 HydrophobicContact CG2-CD1 4.41Å; I58-T66 HydrophobicContact CB-CG2 4.1Å; I58-T66 HydrophobicContact CG2-CG2 3.92Å
59	R	80.5	Confident	76.5	Confident	200 Å²	200	62.6 Å²	62.6	76%	0.755	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-60.6	134.7	173.2	-70.3	-166.6	-65.9	-107.1	-0.6	109	L61	R59-L61 PolarHBondContact O-N 3.38Å
60	P	75.2	Confident	77.9	Confident	120 Å²	120	63.2 Å²	63.2	78%	0.779	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-53.1	130.4	177.5	-26.9	34.4	0	0	0	111
61	L	73.2	Confident	79	Confident	35 Å²	35	61.9 Å²	61.9	18%	0.183	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-112.4	137.4	-177.9	-76	162.5	0	0	0	109.3	I22 F26 I58 R59 N63 A64	I22-L61 HydrophobicContact CB-CD2 4.3Å; I22-L61 HydrophobicContact CD1-CD2 4.27Å; I22-L61 HydrophobicContact CG1-CD2 3.89Å; I22-L61 HydrophobicContact CG2-CD1 3.62Å; I22-L61 HydrophobicContact CG2-CD2 3.79Å; I22-L61 HydrophobicContact CG2-CG 4.28Å; F26-L61 HydrophobicContact CE2-CD1 3.68Å; F26-L61 HydrophobicContact CZ-CD1 3.52Å; I58-L61 HydrophobicContact CG2-CD1 4.41Å; R59-L61 PolarHBondContact O-N 3.38Å; L61-N63 PolarHBondContact O-N 3.42Å; L61-A64 HydrophobicContact CB-CB 3.85Å; L61-A64 PolarHBondContact O-N 2.97Å
62	P	70.7	Confident	79.5	Confident	115 Å²	115	63.8 Å²	63.8	75%	0.747	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	134.2	177.1	25.8	-32.5	0	0	0	109.6	A64	P62-A64 PolarHBondContact O-N 3.44Å; P62-A64 VanDerWaalsContact O-N 3.16Å
63	N	69.4	Low	80	Confident	146 Å²	146	66.4 Å²	66.4	78%	0.781	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	18.8	-179.2	-53.1	-26.4	0	0	0	115.3	L61	L61-N63 PolarHBondContact O-N 3.42Å
64	A	71.9	Confident	80.2	Confident	23 Å²	23	71.5 Å²	71.5	19%	0.19	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	134.2	175.2	0	0	0	0	0	111.5	V50 L61 P62	V50-A64 HydrophobicContact CB-CB 4.04Å; V50-A64 HydrophobicContact CG1-CB 4.05Å; V50-A64 CarbonylContact O-C 3.52Å; V50-A64 VanDerWaalsContact O-CA 3.31Å; V50-A64 WeakPolarHBondContact O-CA 3.41Å; L61-A64 HydrophobicContact CB-CB 3.85Å; L61-A64 PolarHBondContact O-N 2.97Å; P62-A64 PolarHBondContact O-N 3.44Å; P62-A64 VanDerWaalsContact O-N 3.16Å
65	I	78.4	Confident	80.5	Confident	58 Å²	58	74 Å²	74	30%	0.297	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	113.3	176.3	-59.5	170.9	0	0	0	107.8	V50 G51 G52 I67 Q83	V50-I65 PolarHBondContact O-N 3.07Å; G51-I65 CarbonylContact C-O 3.49Å; G51-I65 WeakPolarHBondContact CA-O 3.36Å; G52-I65 PolarHBondContact N-O 3.45Å; I65-I67 HydrophobicContact CG2-CG1 4.44Å; I65-Q83 HydrophobicContact CG2-CB 4.17Å; I65-Q83 HydrophobicContact CG2-CG 3.78Å
66	T	80.2	Confident	80.6	Confident	45 Å²	45	70.6 Å²	70.6	28%	0.276	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.4	177.5	58.8	0	0	0	0	110.4	F26 G52 I58	F26-T66 HydrophobicContact CE1-CG2 4.03Å; F26-T66 HydrophobicContact CZ-CG2 4.06Å; G52-T66 CarbonylContact O-C 3.49Å; G52-T66 WeakPolarHBondContact O-CA 3.47Å; I58-T66 HydrophobicContact CB-CG2 4.1Å; I58-T66 HydrophobicContact CG2-CG2 3.92Å
67	I	83.1	Confident	80.8	Confident	24 Å²	24	67.6 Å²	67.6	12%	0.123	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.7	175.8	-55.8	174.3	0	0	0	107.9	G52 V53 D54 I65 A79 V80 Q83	G52-I67 PolarHBondContact O-N 2.89Å; V53-I67 WeakPolarHBondContact CA-O 3.49Å; V53-I67 HydrophobicContact CG2-CB 4.32Å; D54-I67 PolarHBondContact N-O 3.41Å; I65-I67 HydrophobicContact CG2-CG1 4.44Å; I67-A79 HydrophobicContact CD1-CB 4.38Å; I67-A79 HydrophobicContact CG2-CB 4.13Å; I67-V80 HydrophobicContact CD1-CB 4.4Å; I67-V80 HydrophobicContact CD1-CG2 3.83Å; I67-Q83 HydrophobicContact CD1-CB 4.43Å; I67-Q83 HydrophobicContact CD1-CG 3.76Å; I67-Q83 HydrophobicContact CG1-CG 4.32Å
68	Q	84.7	Confident	81.1	Confident	127 Å²	127	68 Å²	68	59%	0.593	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	120.9	167.7	-170.5	-175.7	-2.6	0	0	109	D54 L55	D54-Q68 CarbonylContact O-C 3.6Å; D54-Q68 WeakPolarHBondContact O-CA 3.37Å; L55-Q68 PolarHBondContact O-NE2 3.5Å; L55-Q68 VanDerWaalsContact O-NE2 3.14Å
69	G	84	Confident	81.6	Confident	19 Å²	19	68.4 Å²	68.4	20%	0.196	39%	0.389	C	S	.	.	S	Bend	trans	178.9	159.4	-179	0	0	0	0	0	114	D54	D54-G69 CarbonylContact C-O 3.49Å; D54-G69 PolarHBondContact O-N 2.96Å
70	D	85.5	Confident	81.8	Confident	55 Å²	55	59.1 Å²	59.1	29%	0.294	36%	0.355	S	S	.	.			trans	-88.9	118	172.6	-171.6	-21.5	0	0	0	110	L55 T72 T73 C76	L55-D70 VanDerWaalsContact CD2-CA 3.48Å; L55-D70 HydrophobicContact CD2-CB 3.4Å; L55-D70 VanDerWaalsContact CD2-CB 3.4Å; D70-T72 PolarHBondContact O-N 3.08Å; D70-T72 WeakPolarHBondContact OD1-CB 3.49Å; D70-T72 WeakPolarHBondContact OD1-CG2 3.36Å; D70-T72 PolarHBondContact OD1-N 2.85Å; D70-T72 PolarHBondContact OD1-OG1 2.86Å; D70-T72 PolarHBondContact OD2-OG1 3.25Å; D70-T72 VanDerWaalsContact OD2-OG1 3.07Å; D70-T73 HydrophobicContact CB-CG2 3.87Å; D70-T73 WeakPolarHBondContact O-CB 3.46Å; D70-T73 PolarHBondContact O-N 3.13Å; D70-T73 PolarHBondContact O-OG1 3.08Å; D70-C76 WeakPolarHBondContact O-CB 3.12Å
71	I	83.8	Confident	82.3	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.4	178	62.4	169.6	0	0	0	113.7	C28 V53 T73 L114 A118	C28-I71 HydrophobicContact CB-CG2 4.22Å; V53-I71 HydrophobicContact CB-CG2 4.33Å; V53-I71 HydrophobicContact CG1-CG2 3.81Å; I71-T73 VanDerWaalsContact C-N 3.3Å; I71-L114 HydrophobicContact CD1-CD1 3.7Å; I71-L114 HydrophobicContact CD1-CG 4.2Å; I71-L114 HydrophobicContact CG1-CD1 3.9Å; I71-A118 HydrophobicContact CD1-CB 4.08Å
72	T	83.5	Confident	82.9	Confident	57 Å²	57	63.6 Å²	63.6	35%	0.35	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-19	176	70.5	0	0	0	0	112.7	D70 L114 Q117	D70-T72 PolarHBondContact O-N 3.08Å; D70-T72 WeakPolarHBondContact OD1-CB 3.49Å; D70-T72 WeakPolarHBondContact OD1-CG2 3.36Å; D70-T72 PolarHBondContact OD1-N 2.85Å; D70-T72 PolarHBondContact OD1-OG1 2.86Å; D70-T72 PolarHBondContact OD2-OG1 3.25Å; D70-T72 VanDerWaalsContact OD2-OG1 3.07Å; T72-L114 HydrophobicContact CG2-CD1 3.89Å; T72-Q117 HydrophobicContact CG2-CB 4.41Å; T72-Q117 HydrophobicContact CG2-CG 4.26Å
73	T	87.4	Confident	83.4	Confident	57 Å²	57	62.6 Å²	62.6	35%	0.35	35%	0.346	S	S	.	.	S	Bend	trans	-88	143.4	179.6	67.3	0	0	0	0	111.9	D70 I71 A75 C76 K77	D70-T73 HydrophobicContact CB-CG2 3.87Å; D70-T73 WeakPolarHBondContact O-CB 3.46Å; D70-T73 PolarHBondContact O-N 3.13Å; D70-T73 PolarHBondContact O-OG1 3.08Å; I71-T73 VanDerWaalsContact C-N 3.3Å; T73-A75 VanDerWaalsContact C-N 3.29Å; T73-A75 PolarHBondContact O-N 3.36Å; T73-C76 PolarHBondContact O-N 3.32Å; T73-C76 WeakPolarHBondContact OG1-CB 2.88Å; T73-C76 PolarHBondContact OG1-N 2.7Å; T73-K77 PolarHBondContact O-N 2.93Å
74	D	87.1	Confident	83.8	Confident	109 Å²	109	56.4 Å²	56.4	58%	0.583	31%	0.313	S	S	*	.	H	α-helix	trans	-70.8	-27	178.2	-65.4	-39.1	0	0	0	112.6	C76 K77 V78	D74-C76 VanDerWaalsContact C-N 3.29Å; D74-C76 PolarHBondContact O-N 3Å; D74-K77 WeakPolarHBondContact O-CB 3.47Å; D74-K77 PolarHBondContact O-N 3.11Å; D74-K77 VanDerWaalsContact O-N 3.12Å; D74-K77 IonicContact OD1-NZ 3.56Å; D74-K77 PolarHBondContact OD1-NZ 3.09Å; D74-V78 WeakPolarHBondContact O-CG2 3.44Å; D74-V78 PolarHBondContact O-N 3.18Å
75	A	89.2	Confident	84.1	Confident	76 Å²	76	62.8 Å²	62.8	63%	0.628	34%	0.339	S	S	*	.	H	α-helix	trans	-57.1	-42.9	172.8	0	0	0	0	0	111.7	T73 V78 A79	T73-A75 VanDerWaalsContact C-N 3.29Å; T73-A75 PolarHBondContact O-N 3.36Å; A75-V78 PolarHBondContact O-N 2.8Å; A75-A79 WeakPolarHBondContact O-CB 3.43Å; A75-A79 PolarHBondContact O-N 2.84Å
76	C	85.6	Confident	84	Confident	5 Å²	5	65.9 Å²	65.9	3%	0.034	36%	0.361	C	S	.	.	H	α-helix	trans	-64.6	-40.5	175.9	-173.1	0	0	0	0	112	V53 D70 T73 D74 V78 A79 V80	V53-C76 WeakPolarHBondContact CG1-SG 3.43Å; D70-C76 WeakPolarHBondContact O-CB 3.12Å; T73-C76 PolarHBondContact O-N 3.32Å; T73-C76 WeakPolarHBondContact OG1-CB 2.88Å; T73-C76 PolarHBondContact OG1-N 2.7Å; D74-C76 VanDerWaalsContact C-N 3.29Å; D74-C76 PolarHBondContact O-N 3Å; C76-V78 PolarHBondContact O-N 2.76Å; C76-A79 PolarHBondContact O-N 3.17Å; C76-V80 VanDerWaalsContact O-CG2 3.3Å; C76-V80 WeakPolarHBondContact O-CG2 3.31Å; C76-V80 PolarHBondContact O-N 2.86Å
77	K	86.1	Confident	84	Confident	30 Å²	30	71.3 Å²	71.3	13%	0.13	38%	0.376	C	S	.	.	H	α-helix	trans	-63.4	-42.6	177.8	-57.5	179.7	-171.2	151.2	0	111.6	T73 D74 V80 K81 L121	T73-K77 PolarHBondContact O-N 2.93Å; D74-K77 WeakPolarHBondContact O-CB 3.47Å; D74-K77 PolarHBondContact O-N 3.11Å; D74-K77 VanDerWaalsContact O-N 3.12Å; D74-K77 IonicContact OD1-NZ 3.56Å; D74-K77 PolarHBondContact OD1-NZ 3.09Å; K77-V80 PolarHBondContact O-N 3.09Å; K77-K81 WeakPolarHBondContact O-CB 3.29Å; K77-K81 WeakPolarHBondContact O-CG 3.43Å; K77-K81 PolarHBondContact O-N 2.78Å; K77-L121 HydrophobicContact CB-CD1 4.17Å; K77-L121 HydrophobicContact CG-CD1 4.05Å
78	V	88.2	Confident	84	Confident	98 Å²	98	74.2 Å²	74.2	59%	0.594	39%	0.392	S	S	*	.	H	α-helix	trans	-64.4	-42.2	175.8	174.6	0	0	0	0	110.6	D74 A75 C76 K81 K82	D74-V78 WeakPolarHBondContact O-CG2 3.44Å; D74-V78 PolarHBondContact O-N 3.18Å; A75-V78 PolarHBondContact O-N 2.8Å; C76-V78 PolarHBondContact O-N 2.76Å; V78-K81 PolarHBondContact O-N 3.22Å; V78-K82 VanDerWaalsContact O-CB 3.29Å; V78-K82 WeakPolarHBondContact O-CB 3.45Å; V78-K82 PolarHBondContact O-N 3.07Å
79	A	86.5	Confident	84	Confident	33 Å²	33	68.1 Å²	68.1	27%	0.273	36%	0.363	S	S	.	.	H	α-helix	trans	-60.6	-46.6	176.3	0	0	0	0	0	111.9	I67 A75 C76 K82 Q83	I67-A79 HydrophobicContact CD1-CB 4.38Å; I67-A79 HydrophobicContact CG2-CB 4.13Å; A75-A79 WeakPolarHBondContact O-CB 3.43Å; A75-A79 PolarHBondContact O-N 2.84Å; C76-A79 PolarHBondContact O-N 3.17Å; A79-K82 PolarHBondContact O-N 2.97Å; A79-Q83 WeakPolarHBondContact O-CG 3.37Å; A79-Q83 PolarHBondContact O-N 2.78Å; A79-Q83 VanDerWaalsContact O-N 3.07Å
80	V	85	Confident	83.9	Confident	6 Å²	6	68.1 Å²	68.1	4%	0.036	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-48.2	176.6	173.1	0	0	0	0	111	V53 I67 C76 K77 K82 Q83 L84 L121 I125	V53-V80 HydrophobicContact CG2-CG2 3.57Å; I67-V80 HydrophobicContact CD1-CB 4.4Å; I67-V80 HydrophobicContact CD1-CG2 3.83Å; C76-V80 VanDerWaalsContact O-CG2 3.3Å; C76-V80 WeakPolarHBondContact O-CG2 3.31Å; C76-V80 PolarHBondContact O-N 2.86Å; K77-V80 PolarHBondContact O-N 3.09Å; V80-K82 VanDerWaalsContact C-N 3.32Å; V80-K82 PolarHBondContact O-N 2.77Å; V80-Q83 PolarHBondContact O-N 2.84Å; V80-Q83 VanDerWaalsContact O-N 3.16Å; V80-L84 HydrophobicContact CG1-CD1 4.04Å; V80-L84 WeakPolarHBondContact O-CG 3.45Å; V80-L84 PolarHBondContact O-N 3.47Å; V80-L121 HydrophobicContact CB-CD1 4.38Å; V80-L121 HydrophobicContact CG1-CD1 4.3Å; V80-I125 HydrophobicContact CG1-CD1 4.28Å; V80-I125 HydrophobicContact CG1-CG2 4.36Å
81	K	84.5	Confident	83.8	Confident	88 Å²	88	66.1 Å²	66.1	38%	0.383	35%	0.349	S	S	.	.	H	α-helix	trans	-61.2	-40	177.6	-74.1	-178.9	-178.7	-178.5	0	112.4	K77 V78 Q83 L84 Q85 D124 I125	K77-K81 WeakPolarHBondContact O-CB 3.29Å; K77-K81 WeakPolarHBondContact O-CG 3.43Å; K77-K81 PolarHBondContact O-N 2.78Å; V78-K81 PolarHBondContact O-N 3.22Å; K81-Q83 VanDerWaalsContact C-N 3.28Å; K81-Q83 PolarHBondContact O-N 2.67Å; K81-L84 PolarHBondContact O-N 2.92Å; K81-Q85 PolarHBondContact O-N 3.12Å; K81-D124 WeakPolarHBondContact CE-OD2 3.17Å; K81-D124 IonicContact NZ-OD2 3.37Å; K81-D124 PolarHBondContact NZ-OD2 3.16Å; K81-I125 HydrophobicContact CG-CG2 4.27Å
82	K	85.1	Confident	84	Confident	161 Å²	161	66 Å²	66	70%	0.7	35%	0.348	S	S	*	.	H	α-helix	trans	-61.6	-37.8	176.4	-175.2	179	178.1	-178.7	0	111.8	V78 A79 V80 Q85	V78-K82 VanDerWaalsContact O-CB 3.29Å; V78-K82 WeakPolarHBondContact O-CB 3.45Å; V78-K82 PolarHBondContact O-N 3.07Å; A79-K82 PolarHBondContact O-N 2.97Å; V80-K82 VanDerWaalsContact C-N 3.32Å; V80-K82 PolarHBondContact O-N 2.77Å; K82-Q85 WeakPolarHBondContact O-CG 3.36Å; K82-Q85 PolarHBondContact O-N 3.29Å
83	Q	81.2	Confident	84.2	Confident	93 Å²	93	65.4 Å²	65.4	44%	0.435	34%	0.343	S	S	.	.	H	α-helix	trans	-72.5	-36.4	177	-66.5	-59.6	-16.8	0	0	112.8	I65 I67 A79 V80 K81 Q85	I65-Q83 HydrophobicContact CG2-CB 4.17Å; I65-Q83 HydrophobicContact CG2-CG 3.78Å; I67-Q83 HydrophobicContact CD1-CB 4.43Å; I67-Q83 HydrophobicContact CD1-CG 3.76Å; I67-Q83 HydrophobicContact CG1-CG 4.32Å; A79-Q83 WeakPolarHBondContact O-CG 3.37Å; A79-Q83 PolarHBondContact O-N 2.78Å; A79-Q83 VanDerWaalsContact O-N 3.07Å; V80-Q83 PolarHBondContact O-N 2.84Å; V80-Q83 VanDerWaalsContact O-N 3.16Å; K81-Q83 VanDerWaalsContact C-N 3.28Å; K81-Q83 PolarHBondContact O-N 2.67Å; Q83-Q85 VanDerWaalsContact C-N 3.25Å; Q83-Q85 PolarHBondContact O-N 3.44Å
84	L	78.3	Confident	84.2	Confident	17 Å²	17	63 Å²	63	9%	0.089	33%	0.327	C	S	.	.	H	α-helix	trans	-72.9	-18.9	175.8	-65.5	175.1	0	0	0	112.8	V30 L32 V80 K81 T86 W87 I125	V30-L84 HydrophobicContact CG1-CD1 4.35Å; V30-L84 HydrophobicContact CG1-CD2 4.18Å; L32-L84 HydrophobicContact CD1-CD2 3.71Å; L32-L84 HydrophobicContact CD2-CD2 4.29Å; L32-L84 HydrophobicContact CG-CD2 4.25Å; V80-L84 HydrophobicContact CG1-CD1 4.04Å; V80-L84 WeakPolarHBondContact O-CG 3.45Å; V80-L84 PolarHBondContact O-N 3.47Å; K81-L84 PolarHBondContact O-N 2.92Å; L84-T86 PolarHBondContact O-N 2.78Å; L84-W87 WeakPolarHBondContact O-CA 3.33Å; L84-W87 WeakPolarHBondContact O-CB 3.35Å; L84-W87 PolarHBondContact O-N 3.05Å; L84-I125 HydrophobicContact CD1-CB 3.68Å; L84-I125 HydrophobicContact CD1-CD1 4.25Å; L84-I125 HydrophobicContact CD1-CG1 4.47Å; L84-I125 HydrophobicContact CD1-CG2 3.7Å
85	Q	78	Confident	84.1	Confident	156 Å²	156	61.5 Å²	61.5	73%	0.729	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	-108.7	179.5	-59.4	-179.8	-7.5	0	0	111.8	K81 K82 Q83	K81-Q85 PolarHBondContact O-N 3.12Å; K82-Q85 WeakPolarHBondContact O-CG 3.36Å; K82-Q85 PolarHBondContact O-N 3.29Å; Q83-Q85 VanDerWaalsContact C-N 3.25Å; Q83-Q85 PolarHBondContact O-N 3.44Å
86	T	76.1	Confident	83.6	Confident	123 Å²	123	57.9 Å²	57.9	76%	0.755	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-7.9	177.7	52.6	0	0	0	0	113.5	L84	L84-T86 PolarHBondContact O-N 2.78Å
87	W	81.9	Confident	83.4	Confident	160 Å²	160	59.6 Å²	59.6	61%	0.606	30%	0.302	S	S	*	.			trans	-85.4	145.7	-175.8	-64.4	88	0	0	0	111.7	L32 L84	L32-W87 HydrophobicContact CD1-CB 4.4Å; L32-W87 HydrophobicContact CD2-CB 4.25Å; L84-W87 WeakPolarHBondContact O-CA 3.33Å; L84-W87 WeakPolarHBondContact O-CB 3.35Å; L84-W87 PolarHBondContact O-N 3.05Å
88	N	83.4	Confident	83.1	Confident	84 Å²	84	58.8 Å²	58.8	45%	0.449	30%	0.3	S	S	.	.			trans	-107	143	171.8	-73	106.7	0	0	0	110.3	L32 I125 R127	L32-N88 VanDerWaalsContact CD2-C 3.46Å; L32-N88 WeakPolarHBondContact CD2-O 3.47Å; N88-I125 CarbonylContact C-O 3.41Å; N88-I125 WeakPolarHBondContact CA-O 3.46Å; N88-I125 WeakPolarHBondContact CB-O 3.5Å; N88-I125 PolarHBondContact ND2-O 3.35Å; N88-R127 HydrophobicContact CB-CB 3.82Å
89	A	83.2	Confident	82.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	140.3	178.6	0	0	0	0	0	112.8	V30 V92 I125 L126 R127	V30-A89 HydrophobicContact CG1-CB 3.35Å; A89-V92 HydrophobicContact CB-CG2 4.12Å; A89-I125 HydrophobicContact CB-CB 4.37Å; A89-I125 HydrophobicContact CB-CD1 4.32Å; A89-I125 HydrophobicContact CB-CG1 3.99Å; A89-I125 PolarHBondContact N-O 3.26Å; A89-L126 HydrophobicContact CB-CD2 4.34Å; A89-L126 WeakPolarHBondContact O-CA 3.48Å; A89-R127 PolarHBondContact O-N 2.79Å
90	D	81.8	Confident	82	Confident	19 Å²	19	64.9 Å²	64.9	10%	0.102	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-39.8	174.4	-64.3	-82.6	0	0	0	111.6	G31 L32 S33 R127 G130 W131	G31-D90 PolarHBondContact O-N 3.08Å; L32-D90 VanDerWaalsContact CA-OD2 3.27Å; L32-D90 WeakPolarHBondContact CA-OD2 3.44Å; S33-D90 PolarHBondContact N-OD2 2.9Å; S33-D90 WeakPolarHBondContact O-CB 3.5Å; D90-R127 WeakPolarHBondContact OD1-CD 3.43Å; D90-R127 IonicContact OD1-CZ 2.67Å; D90-R127 IonicContact OD1-NE 2.7Å; D90-R127 PolarHBondContact OD1-NE 3.17Å; D90-R127 IonicContact OD1-NH1 3.09Å; D90-R127 PolarHBondContact OD1-NH1 3.07Å; D90-R127 VanDerWaalsContact OD1-NH1 3.09Å; D90-R127 IonicContact OD1-NH2 3Å; D90-R127 PolarHBondContact OD1-NH2 2.84Å; D90-G130 CarbonylContact O-C 3.56Å; D90-G130 VanDerWaalsContact O-CA 3.25Å; D90-G130 WeakPolarHBondContact O-CA 3.33Å; D90-W131 PolarHBondContact O-N 2.95Å
91	C	84.3	Confident	81.4	Confident	13 Å²	13	66.9 Å²	66.9	9%	0.088	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	136.3	179.1	-171.6	0	0	0	0	111.1	G31 L93 W131	G31-C91 PolarHBondContact N-O 2.8Å; G31-C91 PolarHBondContact O-N 2.75Å; G31-C91 VanDerWaalsContact O-N 3.17Å; C91-L93 WeakPolarHBondContact SG-CD2 3.49Å; C91-W131 CarbonylContact C-O 3.56Å; C91-W131 VanDerWaalsContact CA-O 3.29Å; C91-W131 WeakPolarHBondContact CA-O 2.8Å; C91-W131 HydrophobicContact CB-CB 4.25Å
92	V	88	Confident	80.6	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.7	170.1	176.1	0	0	0	0	108.3	F29 V30 A89 A122 I125 L126 W131 F132 V133	F29-V92 CarbonylContact O-C 3.55Å; F29-V92 VanDerWaalsContact O-CA 3.31Å; F29-V92 WeakPolarHBondContact O-CA 3.33Å; V30-V92 HydrophobicContact CG2-CG2 4.45Å; A89-V92 HydrophobicContact CB-CG2 4.12Å; V92-A122 HydrophobicContact CB-CB 4.1Å; V92-A122 HydrophobicContact CG1-CB 3.94Å; V92-A122 HydrophobicContact CG2-CB 4.23Å; V92-I125 HydrophobicContact CG2-CD1 3.72Å; V92-I125 HydrophobicContact CG2-CG1 3.93Å; V92-L126 HydrophobicContact CB-CD2 4.3Å; V92-L126 HydrophobicContact CG2-CD1 4.49Å; V92-L126 HydrophobicContact CG2-CD2 3.71Å; V92-L126 HydrophobicContact CG2-CG 3.87Å; V92-W131 PolarHBondContact N-O 3.14Å; V92-F132 HydrophobicContact CB-CD2 4Å; V92-F132 HydrophobicContact CG1-CD2 3.94Å; V92-F132 HydrophobicContact CG1-CE2 4.04Å; V92-F132 WeakPolarHBondContact O-CA 3.38Å; V92-V133 PolarHBondContact O-N 2.66Å
93	L	87.5	Confident	80.3	Confident	45 Å²	45	68.5 Å²	68.5	24%	0.236	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	134.3	173.1	-42.7	171.1	0	0	0	108.7	C28 F29 V38 C91 V133	C28-L93 CarbonylContact C-O 3.5Å; C28-L93 VanDerWaalsContact CA-O 3.29Å; C28-L93 WeakPolarHBondContact CA-O 3.27Å; F29-L93 HydrophobicContact CB-CB 4.01Å; F29-L93 HydrophobicContact CB-CD1 4.25Å; F29-L93 HydrophobicContact CB-CG 4.34Å; F29-L93 HydrophobicContact CD1-CD1 3.78Å; F29-L93 HydrophobicContact CD1-CG 4.15Å; F29-L93 HydrophobicContact CE1-CD1 4.46Å; F29-L93 HydrophobicContact CG-CD1 4.2Å; F29-L93 PolarHBondContact N-O 3.33Å; F29-L93 PolarHBondContact O-N 3.28Å; V38-L93 HydrophobicContact CG2-CD1 4.16Å; C91-L93 WeakPolarHBondContact SG-CD2 3.49Å; L93-V133 CarbonylContact C-O 3.57Å; L93-V133 WeakPolarHBondContact CA-O 3.4Å; L93-V133 HydrophobicContact CD2-CB 3.61Å; L93-V133 HydrophobicContact CD2-CG1 4.45Å; L93-V133 HydrophobicContact CD2-CG2 3.72Å
94	H	86.8	Confident	80.1	Confident	6 Å²	6	70 Å²	70	3%	0.028	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	115.2	178.4	172	-103.5	0	0	0	110.2	R27 G96 A118 F132 V133 T134 K135	R27-H94 PolarHBondContact O-CD2 3.42Å; H94-G96 WeakPolarHBondContact NE2-CA 3.31Å; H94-G96 PolarHBondContact NE2-N 2.88Å; H94-A118 HydrophobicContact CB-CB 4.08Å; H94-A118 WeakPolarHBondContact CD2-CB 3.48Å; H94-F132 HydrophobicContact CB-CE2 4.27Å; H94-F132 HydrophobicContact CB-CZ 4.41Å; H94-V133 PolarHBondContact N-O 3.47Å; H94-T134 PolarHBondContact ND1-OG1 2.82Å; H94-T134 WeakPolarHBondContact O-CA 3.19Å; H94-K135 PolarHBondContact O-N 3.13Å
95	D	84.8	Confident	80.1	Confident	78 Å²	78	75.7 Å²	75.7	42%	0.417	39%	0.392	S	S	.	.			trans	-116.3	46.6	172.9	-164.6	20.8	0	0	0	110.8	R27 K135	R27-D95 CarbonylContact O-C 3.5Å; R27-D95 PolarHBondContact O-N 3.48Å; D95-K135 WeakPolarHBondContact OD1-CD 3.42Å
96	G	79.2	Confident	80.3	Confident	0 Å²	0	73 Å²	73	0%	0	38%	0.38	C	S	.	.			trans	-84.4	125.9	173.2	0	0	0	0	0	113.3	R27 H94	R27-G96 PolarHBondContact O-N 2.78Å; H94-G96 WeakPolarHBondContact NE2-CA 3.31Å; H94-G96 PolarHBondContact NE2-N 2.88Å
97	S	81.2	Confident	80.6	Confident	42 Å²	42	67.9 Å²	67.9	29%	0.294	35%	0.348	S	S	.	.			trans	-123.3	135.5	164.5	83	0	0	0	0	111.7	R27	R27-S97 PolarHBondContact NH1-O 2.91Å; R27-S97 VanDerWaalsContact NH2-C 3.33Å; R27-S97 PolarHBondContact NH2-O 2.87Å
98	P	80.8	Confident	80.7	Confident	12 Å²	12	60.4 Å²	60.4	8%	0.078	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-61.5	166.5	171.2	30.6	-36	0	0	0	110.7	V100 D107 Q110 Q111	P98-V100 PolarHBondContact O-N 2.92Å; P98-D107 WeakPolarHBondContact CG-O 3.35Å; P98-Q110 HydrophobicContact CB-CB 3.82Å; P98-Q110 HydrophobicContact CG-CB 3.94Å; P98-Q111 HydrophobicContact CG-CB 3.98Å
99	N	79.6	Confident	80.8	Confident	147 Å²	147	59.7 Å²	59.7	79%	0.786	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-64.5	117.8	169.7	-69.1	-20.5	0	0	0	108.1	G101	N99-G101 PolarHBondContact O-N 3.49Å
100	V	71.9	Confident	80.9	Confident	112 Å²	112	63 Å²	63	68%	0.679	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-63.8	126.8	-178.7	-67.7	0	0	0	0	110.2	P98	P98-V100 PolarHBondContact O-N 2.92Å
101	G	72.2	Confident	81.2	Confident	48 Å²	48	62.1 Å²	62.1	50%	0.495	32%	0.324	S	S	.	.			trans	-107	-162.7	179.8	0	0	0	0	0	112.3	N99 D107	N99-G101 PolarHBondContact O-N 3.49Å; G101-D107 VanDerWaalsContact N-CG 3.29Å; G101-D107 PolarHBondContact N-OD1 3.31Å; G101-D107 PolarHBondContact N-OD2 2.81Å
102	K	66.7	Low	81.3	Confident	224 Å²	224	61.7 Å²	61.7	97%	0.974	32%	0.321	S	S	*	.	S	Bend	trans	-83.2	-23.5	178	-65.6	-177.5	-178.5	177	0	113.1
103	S	78.9	Confident	81.3	Confident	60 Å²	60	64.9 Å²	64.9	42%	0.42	34%	0.336	S	S	.	.			trans	-108.7	110.6	-173.8	-178.7	0	0	0	0	111.2	H105 H106 D107	S103-H105 PolarHBondContact O-N 2.84Å; S103-H106 PolarHBondContact O-N 3.34Å; S103-H106 VanDerWaalsContact O-N 3.15Å; S103-D107 PolarHBondContact O-N 2.92Å; S103-D107 VanDerWaalsContact O-N 3.08Å
104	W	76.7	Confident	81.4	Confident	123 Å²	123	63.5 Å²	63.5	47%	0.466	33%	0.329	S	S	.	.	H	α-helix	trans	-56.7	-35.8	179.1	-177.1	80.3	0	0	0	113.6	A108 R138 A169	W104-A108 WeakPolarHBondContact O-CB 3.29Å; W104-A108 PolarHBondContact O-N 3.23Å; W104-R138 WeakPolarHBondContact CH2-O 3.36Å; W104-R138 WeakPolarHBondContact CZ2-O 3.25Å; W104-A169 HydrophobicContact CZ2-CB 4.29Å
105	H	79.8	Confident	81.5	Confident	138 Å²	138	63.2 Å²	63.2	64%	0.639	33%	0.327	S	S	*	.	H	α-helix	trans	-66.5	-42.2	179	-68.7	-70.7	0	0	0	112.2	S103 F109	S103-H105 PolarHBondContact O-N 2.84Å; H105-F109 WeakPolarHBondContact O-CB 3.48Å; H105-F109 PolarHBondContact O-N 3.05Å; H105-F109 VanDerWaalsContact O-N 3.07Å
106	H	81.8	Confident	81.7	Confident	100 Å²	100	59.6 Å²	59.6	46%	0.463	31%	0.308	S	S	.	.	H	α-helix	trans	-69.1	-44.6	179.5	178.3	-98.7	0	0	0	111	S103 A108 F109 Q110	S103-H106 PolarHBondContact O-N 3.34Å; S103-H106 VanDerWaalsContact O-N 3.15Å; H106-A108 VanDerWaalsContact C-N 3.32Å; H106-A108 PolarHBondContact O-N 3.49Å; H106-F109 PolarHBondContact O-N 2.84Å; H106-Q110 VanDerWaalsContact CE1-CD 3.42Å; H106-Q110 PolarHBondContact CE1-NE2 3.29Å; H106-Q110 PolarHBondContact NE2-NE2 3.42Å; H106-Q110 WeakPolarHBondContact O-CG 3.34Å; H106-Q110 PolarHBondContact O-N 3.44Å
107	D	82.6	Confident	82.2	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.08	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-39.7	178.7	-62.4	-5.7	0	0	0	111.6	P98 G101 S103 Q110 Q111	P98-D107 WeakPolarHBondContact CG-O 3.35Å; G101-D107 VanDerWaalsContact N-CG 3.29Å; G101-D107 PolarHBondContact N-OD1 3.31Å; G101-D107 PolarHBondContact N-OD2 2.81Å; S103-D107 PolarHBondContact O-N 2.92Å; S103-D107 VanDerWaalsContact O-N 3.08Å; D107-Q110 PolarHBondContact O-N 3.24Å; D107-Q111 PolarHBondContact O-N 3.17Å
108	A	83.4	Confident	82.6	Confident	3 Å²	3	58.9 Å²	58.9	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-43.9	175	0	0	0	0	0	112.3	W104 H106 Q111 A112	W104-A108 WeakPolarHBondContact O-CB 3.29Å; W104-A108 PolarHBondContact O-N 3.23Å; H106-A108 VanDerWaalsContact C-N 3.32Å; H106-A108 PolarHBondContact O-N 3.49Å; A108-Q111 PolarHBondContact O-N 2.96Å; A108-A112 WeakPolarHBondContact O-CB 3.48Å; A108-A112 PolarHBondContact O-N 3.18Å
109	F	85.3	Confident	83	Confident	69 Å²	69	58.3 Å²	58.3	30%	0.303	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-43.4	176.5	180	-97.6	0	0	0	111.6	H105 H106 Q111 A112 Q113 Y190 F194	H105-F109 WeakPolarHBondContact O-CB 3.48Å; H105-F109 PolarHBondContact O-N 3.05Å; H105-F109 VanDerWaalsContact O-N 3.07Å; H106-F109 PolarHBondContact O-N 2.84Å; F109-Q111 VanDerWaalsContact C-N 3.34Å; F109-Q111 PolarHBondContact O-N 2.73Å; F109-A112 WeakPolarHBondContact O-CB 3.12Å; F109-A112 PolarHBondContact O-N 3.18Å; F109-Q113 PolarHBondContact O-N 3.19Å; F109-Y190 HydrophobicContact CZ-CD2 4.16Å; F109-F194 HydrophobicContact CD2-CD2 4.28Å; F109-F194 HydrophobicContact CD2-CE2 4.44Å; F109-F194 AromaticContact CE2-CD2 3.55Å; F109-F194 HydrophobicContact CE2-CD2 3.55Å; F109-F194 AromaticContact CE2-CE2 3.96Å; F109-F194 HydrophobicContact CE2-CE2 3.96Å; F109-F194 HydrophobicContact CE2-CG 4.31Å; F109-F194 HydrophobicContact CZ-CD2 4.32Å
110	Q	86.1	Confident	83.5	Confident	68 Å²	68	53.6 Å²	53.6	32%	0.318	27%	0.268	S	S	.	.	H	α-helix	trans	-62.6	-39.8	176.4	-73.2	-166.9	-13	0	0	112.4	P98 H106 D107 A112 Q113 L114	P98-Q110 HydrophobicContact CB-CB 3.82Å; P98-Q110 HydrophobicContact CG-CB 3.94Å; H106-Q110 VanDerWaalsContact CE1-CD 3.42Å; H106-Q110 PolarHBondContact CE1-NE2 3.29Å; H106-Q110 PolarHBondContact NE2-NE2 3.42Å; H106-Q110 WeakPolarHBondContact O-CG 3.34Å; H106-Q110 PolarHBondContact O-N 3.44Å; D107-Q110 PolarHBondContact O-N 3.24Å; Q110-A112 VanDerWaalsContact C-N 3.33Å; Q110-Q113 PolarHBondContact O-N 2.74Å; Q110-L114 WeakPolarHBondContact O-CB 3.12Å; Q110-L114 PolarHBondContact O-N 3.26Å
111	Q	86.7	Confident	84.2	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.009	24%	0.236	C	C	.	.	H	α-helix	trans	-66.5	-38.6	175.2	-167.7	-177.7	37.4	0	0	111.7	P98 D107 A108 F109 Q113 L114 T115 F137	P98-Q111 HydrophobicContact CG-CB 3.98Å; D107-Q111 PolarHBondContact O-N 3.17Å; A108-Q111 PolarHBondContact O-N 2.96Å; F109-Q111 VanDerWaalsContact C-N 3.34Å; F109-Q111 PolarHBondContact O-N 2.73Å; Q111-Q113 VanDerWaalsContact C-N 3.34Å; Q111-L114 PolarHBondContact O-N 2.9Å; Q111-T115 WeakPolarHBondContact O-CB 3.48Å; Q111-T115 PolarHBondContact O-N 3.17Å; Q111-T115 PolarHBondContact O-OG1 2.96Å; Q111-F137 HydrophobicContact CB-CD2 4.45Å; Q111-F137 VanDerWaalsContact OE1-CB 3.23Å
112	A	87.5	Confident	85	Confident	3 Å²	3	46 Å²	46	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-44.1	175.3	0	0	0	0	0	111.1	A108 F109 Q110 T115 L116 D141 L145 F194	A108-A112 WeakPolarHBondContact O-CB 3.48Å; A108-A112 PolarHBondContact O-N 3.18Å; F109-A112 WeakPolarHBondContact O-CB 3.12Å; F109-A112 PolarHBondContact O-N 3.18Å; Q110-A112 VanDerWaalsContact C-N 3.33Å; A112-T115 PolarHBondContact O-N 3.01Å; A112-L116 PolarHBondContact O-N 3.5Å; A112-D141 HydrophobicContact CB-CB 4.41Å; A112-L145 HydrophobicContact CB-CD1 3.72Å; A112-F194 HydrophobicContact CB-CE1 4.31Å; A112-F194 HydrophobicContact CB-CE2 4.4Å; A112-F194 HydrophobicContact CB-CZ 3.68Å
113	Q	87.7	Confident	86.1	Confident	67 Å²	67	36.1 Å²	36.1	31%	0.313	17%	0.171	S	C	.	.	H	α-helix	trans	-60.8	-45.1	173.5	179.4	178.1	-27.1	0	0	112.1	F109 Q110 Q111 L116 Q117	F109-Q113 PolarHBondContact O-N 3.19Å; Q110-Q113 PolarHBondContact O-N 2.74Å; Q111-Q113 VanDerWaalsContact C-N 3.34Å; Q113-L116 PolarHBondContact O-N 2.86Å; Q113-Q117 WeakPolarHBondContact O-CG 2.94Å; Q113-Q117 PolarHBondContact O-N 2.9Å; Q113-Q117 VanDerWaalsContact O-N 3.09Å
114	L	88.9	Confident	86.5	Confident	17 Å²	17	37.2 Å²	37.2	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-44.1	178.3	-173.4	65.7	0	0	0	111.4	I71 T72 Q110 Q111 L116 Q117 A118	I71-L114 HydrophobicContact CD1-CD1 3.7Å; I71-L114 HydrophobicContact CD1-CG 4.2Å; I71-L114 HydrophobicContact CG1-CD1 3.9Å; T72-L114 HydrophobicContact CG2-CD1 3.89Å; Q110-L114 WeakPolarHBondContact O-CB 3.12Å; Q110-L114 PolarHBondContact O-N 3.26Å; Q111-L114 PolarHBondContact O-N 2.9Å; L114-L116 VanDerWaalsContact C-N 3.3Å; L114-L116 PolarHBondContact O-N 3.33Å; L114-Q117 PolarHBondContact O-N 2.91Å; L114-Q117 VanDerWaalsContact O-N 3.16Å; L114-A118 PolarHBondContact O-N 3.35Å
115	T	89.8	Confident	86.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-38.2	177.2	-56.6	0	0	0	0	111.8	Q111 A112 Q117 A118 L119 T134 L136 F149	Q111-T115 WeakPolarHBondContact O-CB 3.48Å; Q111-T115 PolarHBondContact O-N 3.17Å; Q111-T115 PolarHBondContact O-OG1 2.96Å; A112-T115 PolarHBondContact O-N 3.01Å; T115-Q117 VanDerWaalsContact C-N 3.33Å; T115-Q117 PolarHBondContact O-N 2.89Å; T115-A118 PolarHBondContact O-N 3.37Å; T115-L119 WeakPolarHBondContact O-CB 3.43Å; T115-L119 PolarHBondContact O-N 3.28Å; T115-T134 HydrophobicContact CG2-CG2 3.73Å; T115-T134 WeakPolarHBondContact CG2-OG1 3.33Å; T115-L136 HydrophobicContact CG2-CD2 3.79Å; T115-L136 HydrophobicContact CG2-CG 4.33Å; T115-L136 VanDerWaalsContact OG1-CD2 3.25Å; T115-L136 WeakPolarHBondContact OG1-CD2 3.48Å; T115-F149 HydrophobicContact CG2-CZ 3.86Å
116	L	89.3	Confident	87.4	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-66.6	-35	176.2	-171.2	64.2	0	0	0	112.2	A112 Q113 L114 L119 K120 L145 L188	A112-L116 PolarHBondContact O-N 3.5Å; Q113-L116 PolarHBondContact O-N 2.86Å; L114-L116 VanDerWaalsContact C-N 3.3Å; L114-L116 PolarHBondContact O-N 3.33Å; L116-L119 HydrophobicContact CD1-CD2 4.19Å; L116-L119 PolarHBondContact O-N 2.83Å; L116-K120 WeakPolarHBondContact O-CG 3.42Å; L116-K120 PolarHBondContact O-N 3.39Å; L116-L145 HydrophobicContact CD1-CD2 4.47Å; L116-L188 HydrophobicContact CD1-CD2 4.12Å; L116-L188 VanDerWaalsContact CD2-O 3.29Å; L116-L188 WeakPolarHBondContact CD2-O 3.44Å
117	Q	88.9	Confident	87.7	Confident	27 Å²	27	25 Å²	25	13%	0.126	12%	0.117	C	C	.	.	H	α-helix	trans	-69.9	-41.1	173.5	-65.4	-67.1	-8.6	0	0	111.7	T72 Q113 L114 T115 L119 K120 L121	T72-Q117 HydrophobicContact CG2-CB 4.41Å; T72-Q117 HydrophobicContact CG2-CG 4.26Å; Q113-Q117 WeakPolarHBondContact O-CG 2.94Å; Q113-Q117 PolarHBondContact O-N 2.9Å; Q113-Q117 VanDerWaalsContact O-N 3.09Å; L114-Q117 PolarHBondContact O-N 2.91Å; L114-Q117 VanDerWaalsContact O-N 3.16Å; T115-Q117 VanDerWaalsContact C-N 3.33Å; T115-Q117 PolarHBondContact O-N 2.89Å; Q117-L119 VanDerWaalsContact C-N 3.29Å; Q117-L119 PolarHBondContact O-N 2.87Å; Q117-K120 WeakPolarHBondContact O-CB 3.44Å; Q117-K120 PolarHBondContact O-N 3.19Å; Q117-L121 PolarHBondContact O-N 3.31Å
118	A	89.6	Confident	88	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.2	-40.9	172.4	0	0	0	0	0	111.6	I71 H94 L114 T115 K120 L121 A122 F132	I71-A118 HydrophobicContact CD1-CB 4.08Å; H94-A118 HydrophobicContact CB-CB 4.08Å; H94-A118 WeakPolarHBondContact CD2-CB 3.48Å; L114-A118 PolarHBondContact O-N 3.35Å; T115-A118 PolarHBondContact O-N 3.37Å; A118-K120 PolarHBondContact O-N 2.9Å; A118-L121 PolarHBondContact O-N 3.41Å; A118-A122 WeakPolarHBondContact O-CB 3.38Å; A118-A122 PolarHBondContact O-N 2.99Å; A118-F132 HydrophobicContact CB-CZ 4.45Å
119	L	90.2	Very high	88.2	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-41.4	174.5	179.8	66.9	0	0	0	111.9	T115 L116 Q117 A122 V123 F132 V148 F149 L152 F153 L188	T115-L119 WeakPolarHBondContact O-CB 3.43Å; T115-L119 PolarHBondContact O-N 3.28Å; L116-L119 HydrophobicContact CD1-CD2 4.19Å; L116-L119 PolarHBondContact O-N 2.83Å; Q117-L119 VanDerWaalsContact C-N 3.29Å; Q117-L119 PolarHBondContact O-N 2.87Å; L119-A122 WeakPolarHBondContact O-CB 3.43Å; L119-A122 PolarHBondContact O-N 2.84Å; L119-V123 HydrophobicContact CD1-CG2 4.37Å; L119-V123 HydrophobicContact CG-CG2 4.4Å; L119-V123 WeakPolarHBondContact O-CB 3.38Å; L119-V123 VanDerWaalsContact O-CG2 3.24Å; L119-V123 WeakPolarHBondContact O-CG2 3.28Å; L119-V123 PolarHBondContact O-N 3.36Å; L119-F132 HydrophobicContact CB-CE1 4.44Å; L119-F132 HydrophobicContact CB-CZ 4.33Å; L119-F132 HydrophobicContact CD1-CD1 4.08Å; L119-F132 HydrophobicContact CD1-CE1 4.03Å; L119-F132 HydrophobicContact CD1-CZ 4.5Å; L119-V148 HydrophobicContact CD2-CG1 3.79Å; L119-F149 HydrophobicContact CB-CE1 4.37Å; L119-F149 HydrophobicContact CD1-CD1 3.98Å; L119-F149 HydrophobicContact CD1-CE1 3.93Å; L119-F149 HydrophobicContact CD2-CD1 3.85Å; L119-F149 HydrophobicContact CD2-CE1 3.67Å; L119-F149 HydrophobicContact CG-CD1 4.49Å; L119-F149 HydrophobicContact CG-CE1 4.19Å; L119-L152 HydrophobicContact CD1-CD1 4.16Å; L119-L152 HydrophobicContact CD2-CD1 3.86Å; L119-L152 HydrophobicContact CG-CD1 4.25Å; L119-F153 HydrophobicContact CD1-CE2 3.88Å; L119-F153 HydrophobicContact CD1-CZ 4.37Å; L119-L188 HydrophobicContact CD2-CD2 3.81Å; L119-L188 HydrophobicContact CG-CD2 4.49Å
120	K	88.9	Confident	88.3	Confident	47 Å²	47	27.1 Å²	27.1	20%	0.204	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-45.7	174.9	-74.2	171.9	-175.7	173.4	0	112	L116 Q117 A118 A122 V123 D124 L188	L116-K120 WeakPolarHBondContact O-CG 3.42Å; L116-K120 PolarHBondContact O-N 3.39Å; Q117-K120 WeakPolarHBondContact O-CB 3.44Å; Q117-K120 PolarHBondContact O-N 3.19Å; A118-K120 PolarHBondContact O-N 2.9Å; K120-A122 VanDerWaalsContact C-N 3.3Å; K120-A122 PolarHBondContact O-N 3.47Å; K120-V123 PolarHBondContact O-N 2.87Å; K120-D124 PolarHBondContact O-N 3.09Å; K120-L188 HydrophobicContact CD-CB 4.4Å; K120-L188 WeakPolarHBondContact CE-O 3.48Å; K120-L188 HydrophobicContact CG-CB 3.94Å; K120-L188 HydrophobicContact CG-CD1 3.78Å; K120-L188 HydrophobicContact CG-CG 4.44Å; K120-L188 PolarHBondContact NZ-O 3.16Å; K120-L188 VanDerWaalsContact NZ-O 3.07Å
121	L	87.4	Confident	88.6	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.3	-43.2	175.1	176.1	64.4	0	0	0	110.7	K77 V80 Q117 A118 D124 I125	K77-L121 HydrophobicContact CB-CD1 4.17Å; K77-L121 HydrophobicContact CG-CD1 4.05Å; V80-L121 HydrophobicContact CB-CD1 4.38Å; V80-L121 HydrophobicContact CG1-CD1 4.3Å; Q117-L121 PolarHBondContact O-N 3.31Å; A118-L121 PolarHBondContact O-N 3.41Å; L121-D124 PolarHBondContact O-N 3.05Å; L121-I125 HydrophobicContact CD1-CG2 4.36Å; L121-I125 HydrophobicContact CG-CD1 4.32Å; L121-I125 WeakPolarHBondContact O-CG1 3.45Å; L121-I125 PolarHBondContact O-N 3.39Å
122	A	89	Confident	88.9	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.9	-45.6	178.9	0	0	0	0	0	111.9	V92 A118 L119 K120 D124 I125 L126 F132	V92-A122 HydrophobicContact CB-CB 4.1Å; V92-A122 HydrophobicContact CG1-CB 3.94Å; V92-A122 HydrophobicContact CG2-CB 4.23Å; A118-A122 WeakPolarHBondContact O-CB 3.38Å; A118-A122 PolarHBondContact O-N 2.99Å; L119-A122 WeakPolarHBondContact O-CB 3.43Å; L119-A122 PolarHBondContact O-N 2.84Å; K120-A122 VanDerWaalsContact C-N 3.3Å; K120-A122 PolarHBondContact O-N 3.47Å; A122-D124 PolarHBondContact O-N 3.44Å; A122-I125 PolarHBondContact O-N 3.49Å; A122-L126 HydrophobicContact CB-CD1 3.78Å; A122-L126 HydrophobicContact CB-CG 4.31Å; A122-L126 WeakPolarHBondContact O-CB 3.41Å; A122-L126 WeakPolarHBondContact O-CD1 3.24Å; A122-L126 WeakPolarHBondContact O-CG 3.4Å; A122-L126 PolarHBondContact O-N 2.86Å; A122-F132 HydrophobicContact CB-CD2 3.62Å; A122-F132 HydrophobicContact CB-CE2 3.8Å; A122-F132 HydrophobicContact CB-CG 4.45Å
123	V	89	Confident	89	Confident	18 Å²	18	28.2 Å²	28.2	11%	0.109	15%	0.15	C	C	.	.	H	α-helix	trans	-56	-36.5	177	163.1	0	0	0	0	112	L119 K120 L152 F178 V183 L188	L119-V123 HydrophobicContact CD1-CG2 4.37Å; L119-V123 HydrophobicContact CG-CG2 4.4Å; L119-V123 WeakPolarHBondContact O-CB 3.38Å; L119-V123 VanDerWaalsContact O-CG2 3.24Å; L119-V123 WeakPolarHBondContact O-CG2 3.28Å; L119-V123 PolarHBondContact O-N 3.36Å; K120-V123 PolarHBondContact O-N 2.87Å; V123-L152 HydrophobicContact CG2-CD1 4.2Å; V123-F178 HydrophobicContact CB-CE2 4.48Å; V123-F178 HydrophobicContact CB-CZ 4.2Å; V123-F178 HydrophobicContact CG1-CZ 4.08Å; V123-F178 HydrophobicContact CG2-CE2 3.92Å; V123-F178 HydrophobicContact CG2-CZ 4.13Å; V123-V183 HydrophobicContact CG1-CB 4.37Å; V123-V183 HydrophobicContact CG1-CG1 3.64Å; V123-V183 HydrophobicContact CG1-CG2 3.73Å; V123-L188 HydrophobicContact CG2-CD1 4.47Å
124	D	87	Confident	89.2	Confident	82 Å²	82	25.1 Å²	25.1	44%	0.439	14%	0.135	S	C	.	.	H	α-helix	trans	-75.9	-28.3	-178.6	-82	0.5	0	0	0	113.9	K81 K120 L121 A122	K81-D124 WeakPolarHBondContact CE-OD2 3.17Å; K81-D124 IonicContact NZ-OD2 3.37Å; K81-D124 PolarHBondContact NZ-OD2 3.16Å; K120-D124 PolarHBondContact O-N 3.09Å; L121-D124 PolarHBondContact O-N 3.05Å; A122-D124 PolarHBondContact O-N 3.44Å
125	I	86.9	Confident	89.1	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-108.1	-24.7	-173.2	68.1	-176.5	0	0	0	113.2	V30 V80 K81 L84 N88 A89 V92 L121 A122	V30-I125 HydrophobicContact CG1-CD1 3.97Å; V30-I125 HydrophobicContact CG2-CD1 3.68Å; V80-I125 HydrophobicContact CG1-CD1 4.28Å; V80-I125 HydrophobicContact CG1-CG2 4.36Å; K81-I125 HydrophobicContact CG-CG2 4.27Å; L84-I125 HydrophobicContact CD1-CB 3.68Å; L84-I125 HydrophobicContact CD1-CD1 4.25Å; L84-I125 HydrophobicContact CD1-CG1 4.47Å; L84-I125 HydrophobicContact CD1-CG2 3.7Å; N88-I125 CarbonylContact C-O 3.41Å; N88-I125 WeakPolarHBondContact CA-O 3.46Å; N88-I125 WeakPolarHBondContact CB-O 3.5Å; N88-I125 PolarHBondContact ND2-O 3.35Å; A89-I125 HydrophobicContact CB-CB 4.37Å; A89-I125 HydrophobicContact CB-CD1 4.32Å; A89-I125 HydrophobicContact CB-CG1 3.99Å; A89-I125 PolarHBondContact N-O 3.26Å; V92-I125 HydrophobicContact CG2-CD1 3.72Å; V92-I125 HydrophobicContact CG2-CG1 3.93Å; L121-I125 HydrophobicContact CD1-CG2 4.36Å; L121-I125 HydrophobicContact CG-CD1 4.32Å; L121-I125 WeakPolarHBondContact O-CG1 3.45Å; L121-I125 PolarHBondContact O-N 3.39Å; A122-I125 PolarHBondContact O-N 3.49Å
126	L	89.6	Confident	88.9	Confident	8 Å²	8	26 Å²	26	4%	0.042	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136.4	-175.3	-80	170.8	0	0	0	112.4	A89 V92 A122 F132 F153 F178	A89-L126 HydrophobicContact CB-CD2 4.34Å; A89-L126 WeakPolarHBondContact O-CA 3.48Å; V92-L126 HydrophobicContact CB-CD2 4.3Å; V92-L126 HydrophobicContact CG2-CD1 4.49Å; V92-L126 HydrophobicContact CG2-CD2 3.71Å; V92-L126 HydrophobicContact CG2-CG 3.87Å; A122-L126 HydrophobicContact CB-CD1 3.78Å; A122-L126 HydrophobicContact CB-CG 4.31Å; A122-L126 WeakPolarHBondContact O-CB 3.41Å; A122-L126 WeakPolarHBondContact O-CD1 3.24Å; A122-L126 WeakPolarHBondContact O-CG 3.4Å; A122-L126 PolarHBondContact O-N 2.86Å; L126-F132 HydrophobicContact CD1-CB 4.21Å; L126-F153 HydrophobicContact CD1-CE1 4.23Å; L126-F153 HydrophobicContact CD1-CZ 4.13Å; L126-F178 HydrophobicContact CB-CD1 3.73Å; L126-F178 HydrophobicContact CB-CE1 4.09Å; L126-F178 HydrophobicContact CB-CG 4.23Å; L126-F178 HydrophobicContact CD1-CG 4.41Å
127	R	86.9	Confident	88.8	Confident	93 Å²	93	27.2 Å²	27.2	35%	0.351	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	155.5	168.5	76.9	172.3	-171.7	-177.7	-12.6	111.2	N88 A89 D90 G129 G130	N88-R127 HydrophobicContact CB-CB 3.82Å; A89-R127 PolarHBondContact O-N 2.79Å; D90-R127 WeakPolarHBondContact OD1-CD 3.43Å; D90-R127 IonicContact OD1-CZ 2.67Å; D90-R127 IonicContact OD1-NE 2.7Å; D90-R127 PolarHBondContact OD1-NE 3.17Å; D90-R127 IonicContact OD1-NH1 3.09Å; D90-R127 PolarHBondContact OD1-NH1 3.07Å; D90-R127 VanDerWaalsContact OD1-NH1 3.09Å; D90-R127 IonicContact OD1-NH2 3Å; D90-R127 PolarHBondContact OD1-NH2 2.84Å; R127-G129 PolarHBondContact O-N 2.88Å; R127-G130 WeakPolarHBondContact O-CA 3.41Å; R127-G130 PolarHBondContact O-N 3.49Å
128	P	89.4	Confident	88.4	Confident	92 Å²	92	30.4 Å²	30.4	60%	0.597	15%	0.154	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-55.2	131.7	168.6	-16	26.7	0	0	0	110.6	G130 P180	P128-G130 VanDerWaalsContact C-N 3.29Å; P128-P180 HydrophobicContact CB-CG 4.01Å; P128-P180 HydrophobicContact CG-CG 3.91Å
129	G	88.6	Confident	87.9	Confident	38 Å²	38	31.3 Å²	31.3	39%	0.392	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	84.1	-3.2	-174.1	0	0	0	0	0	115	R127 F178	R127-G129 PolarHBondContact O-N 2.88Å; G129-F178 PolarHBondContact N-O 3.44Å
130	G	87.9	Confident	87.4	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	168.5	178.2	0	0	0	0	0	114.4	D90 R127 P128 G177 F178	D90-G130 CarbonylContact O-C 3.56Å; D90-G130 VanDerWaalsContact O-CA 3.25Å; D90-G130 WeakPolarHBondContact O-CA 3.33Å; R127-G130 WeakPolarHBondContact O-CA 3.41Å; R127-G130 PolarHBondContact O-N 3.49Å; P128-G130 VanDerWaalsContact C-N 3.29Å; G130-G177 PolarHBondContact O-N 3.05Å; G130-F178 PolarHBondContact O-N 3.45Å
131	W	91	Very high	87	Confident	66 Å²	66	37.5 Å²	37.5	25%	0.25	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.6	-172.6	-68.6	42.4	0	0	0	110.6	C37 D90 C91 V92 C175 Q176	C37-W131 HydrophobicContact CB-CE3 3.96Å; C37-W131 HydrophobicContact CB-CH2 4.29Å; C37-W131 HydrophobicContact CB-CZ3 3.75Å; C37-W131 VanDerWaalsContact SG-CZ3 3.56Å; D90-W131 PolarHBondContact O-N 2.95Å; C91-W131 CarbonylContact C-O 3.56Å; C91-W131 VanDerWaalsContact CA-O 3.29Å; C91-W131 WeakPolarHBondContact CA-O 2.8Å; C91-W131 HydrophobicContact CB-CB 4.25Å; V92-W131 PolarHBondContact N-O 3.14Å; W131-C175 WeakPolarHBondContact CA-O 3.47Å; W131-Q176 HydrophobicContact CD2-CG 4.41Å; W131-Q176 HydrophobicContact CZ2-CG 4.12Å
132	F	92.7	Very high	86.9	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.6	173	178.8	-111.3	0	0	0	109.4	V92 H94 A118 L119 A122 L126 T134 F149 F153 C175	V92-F132 HydrophobicContact CB-CD2 4Å; V92-F132 HydrophobicContact CG1-CD2 3.94Å; V92-F132 HydrophobicContact CG1-CE2 4.04Å; V92-F132 WeakPolarHBondContact O-CA 3.38Å; H94-F132 HydrophobicContact CB-CE2 4.27Å; H94-F132 HydrophobicContact CB-CZ 4.41Å; A118-F132 HydrophobicContact CB-CZ 4.45Å; L119-F132 HydrophobicContact CB-CE1 4.44Å; L119-F132 HydrophobicContact CB-CZ 4.33Å; L119-F132 HydrophobicContact CD1-CD1 4.08Å; L119-F132 HydrophobicContact CD1-CE1 4.03Å; L119-F132 HydrophobicContact CD1-CZ 4.5Å; A122-F132 HydrophobicContact CB-CD2 3.62Å; A122-F132 HydrophobicContact CB-CE2 3.8Å; A122-F132 HydrophobicContact CB-CG 4.45Å; L126-F132 HydrophobicContact CD1-CB 4.21Å; F132-T134 HydrophobicContact CD1-CG2 4.41Å; F132-T134 HydrophobicContact CE1-CG2 3.66Å; F132-T134 HydrophobicContact CZ-CG2 4.19Å; F132-F149 HydrophobicContact CD1-CE1 4.31Å; F132-F149 AromaticContact CE1-CE1 3.8Å; F132-F149 HydrophobicContact CE1-CE1 3.8Å; F132-F149 HydrophobicContact CE1-CZ 4.14Å; F132-F153 HydrophobicContact CB-CE1 3.71Å; F132-F153 HydrophobicContact CB-CE2 4.18Å; F132-F153 HydrophobicContact CB-CZ 3.38Å; F132-F153 HydrophobicContact CD1-CE2 4.48Å; F132-F153 HydrophobicContact CD1-CZ 4.42Å; F132-F153 HydrophobicContact CG-CZ 4.16Å; F132-C175 HydrophobicContact CB-CB 4.14Å; F132-C175 PolarHBondContact N-O 2.7Å; F132-C175 WeakPolarHBondContact O-CA 3.41Å; F132-C175 VanDerWaalsContact O-CB 3.28Å; F132-C175 WeakPolarHBondContact O-CB 3.45Å; F132-C175 PolarHBondContact O-N 3.5Å
133	V	90.9	Very high	86.8	Confident	31 Å²	31	42.7 Å²	42.7	19%	0.188	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.7	177.8	-175	0	0	0	0	108.2	V92 L93 H94 V173 V174	V92-V133 PolarHBondContact O-N 2.66Å; L93-V133 CarbonylContact C-O 3.57Å; L93-V133 WeakPolarHBondContact CA-O 3.4Å; L93-V133 HydrophobicContact CD2-CB 3.61Å; L93-V133 HydrophobicContact CD2-CG1 4.45Å; L93-V133 HydrophobicContact CD2-CG2 3.72Å; H94-V133 PolarHBondContact N-O 3.47Å; V133-V173 WeakPolarHBondContact CA-O 3.26Å; V133-V174 HydrophobicContact CG1-CG2 4.22Å; V133-V174 HydrophobicContact CG2-CG1 4.3Å
134	T	90.5	Very high	86.6	Confident	1 Å²	1	42 Å²	42	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.2	179.6	-172.7	0	0	0	0	111.7	H94 T115 F132 L136 F149 V173	H94-T134 PolarHBondContact ND1-OG1 2.82Å; H94-T134 WeakPolarHBondContact O-CA 3.19Å; T115-T134 HydrophobicContact CG2-CG2 3.73Å; T115-T134 WeakPolarHBondContact CG2-OG1 3.33Å; F132-T134 HydrophobicContact CD1-CG2 4.41Å; F132-T134 HydrophobicContact CE1-CG2 3.66Å; F132-T134 HydrophobicContact CZ-CG2 4.19Å; T134-L136 HydrophobicContact CG2-CD1 4.38Å; T134-L136 HydrophobicContact CG2-CG 4.28Å; T134-F149 HydrophobicContact CG2-CE2 4.18Å; T134-F149 HydrophobicContact CG2-CZ 3.93Å; T134-V173 HydrophobicContact CG2-CB 4.27Å; T134-V173 PolarHBondContact N-O 3.38Å; T134-V173 PolarHBondContact O-N 2.96Å
135	K	87.2	Confident	86.6	Confident	31 Å²	31	38.2 Å²	38.2	14%	0.135	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	137.3	168.9	-169.9	176.2	178.1	-174.3	0	110.6	H94 D95 E170 F172	H94-K135 PolarHBondContact O-N 3.13Å; D95-K135 WeakPolarHBondContact OD1-CD 3.42Å; K135-E170 WeakPolarHBondContact CE-OE1 3.44Å; K135-E170 IonicContact NZ-OE1 3.45Å; K135-E170 PolarHBondContact NZ-OE1 3.3Å; K135-F172 HydrophobicContact CB-CD1 4.22Å; K135-F172 HydrophobicContact CB-CE1 3.99Å; K135-F172 HydrophobicContact CD-CE1 4.15Å; K135-F172 HydrophobicContact CD-CZ 4.19Å; K135-F172 HydrophobicContact CG-CD1 4.4Å; K135-F172 HydrophobicContact CG-CE1 3.95Å; K135-F172 HydrophobicContact CG-CZ 4.2Å
136	L	86.7	Confident	86.8	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	143.3	178.9	-77.3	177.2	0	0	0	111.5	T115 T134 L145 F149 A171 V173	T115-L136 HydrophobicContact CG2-CD2 3.79Å; T115-L136 HydrophobicContact CG2-CG 4.33Å; T115-L136 VanDerWaalsContact OG1-CD2 3.25Å; T115-L136 WeakPolarHBondContact OG1-CD2 3.48Å; T134-L136 HydrophobicContact CG2-CD1 4.38Å; T134-L136 HydrophobicContact CG2-CG 4.28Å; L136-L145 HydrophobicContact CD1-CB 4.45Å; L136-L145 HydrophobicContact CD1-CD1 4.21Å; L136-L145 HydrophobicContact CD2-CD1 3.74Å; L136-F149 HydrophobicContact CD1-CE2 3.83Å; L136-F149 HydrophobicContact CD1-CZ 4.36Å; L136-A171 PolarHBondContact N-O 2.93Å; L136-A171 PolarHBondContact O-N 3.16Å; L136-V173 HydrophobicContact CD1-CG2 3.8Å
137	F	85.9	Confident	86.7	Confident	29 Å²	29	41.7 Å²	41.7	13%	0.127	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	139.3	164.8	-62.6	-28.3	0	0	0	110.1	Q111 S139 A169 E170	Q111-F137 HydrophobicContact CB-CD2 4.45Å; Q111-F137 VanDerWaalsContact OE1-CB 3.23Å; F137-S139 PolarHBondContact O-N 2.88Å; F137-A169 HydrophobicContact CB-CB 4.37Å; F137-E170 HydrophobicContact CD1-CB 4.43Å; F137-E170 HydrophobicContact CD1-CG 3.49Å; F137-E170 VanDerWaalsContact CD1-CG 3.49Å; F137-E170 HydrophobicContact CE1-CG 3.32Å
138	R	80.3	Confident	86.8	Confident	93 Å²	93	37.8 Å²	37.8	35%	0.351	20%	0.199	S	C	.	.			trans	-66.8	101.5	170.4	-70.4	-174.5	-161	72.9	23.3	108.9	W104 S168 A169 E170 A171	W104-R138 WeakPolarHBondContact CH2-O 3.36Å; W104-R138 WeakPolarHBondContact CZ2-O 3.25Å; R138-S168 PolarHBondContact NH1-O 3.26Å; R138-A169 WeakPolarHBondContact CG-O 3.5Å; R138-A169 PolarHBondContact N-O 3.38Å; R138-A169 PolarHBondContact NH1-O 3.36Å; R138-E170 PolarHBondContact NH1-O 3.37Å; R138-E170 PolarHBondContact NH2-O 2.88Å; R138-A171 HydrophobicContact CG-CB 4.32Å
139	S	80.8	Confident	86.9	Confident	20 Å²	20	33.4 Å²	33.4	14%	0.14	17%	0.171	C	C	.	.	S	Bend	trans	-127.7	-177.8	176.4	71.3	0	0	0	0	111.2	F137 D141 H142	F137-S139 PolarHBondContact O-N 2.88Å; S139-D141 PolarHBondContact O-N 2.78Å; S139-D141 PolarHBondContact OG-N 3.02Å; S139-H142 WeakPolarHBondContact O-CB 3.32Å; S139-H142 PolarHBondContact O-N 3.03Å
140	K	80	Confident	87	Confident	149 Å²	149	38.3 Å²	38.3	65%	0.648	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.4	171.9	-169.6	-173.8	177	-166.7	0	111.6	P143	K140-P143 WeakPolarHBondContact O-CD 3.47Å
141	D	80.2	Confident	87.1	Confident	27 Å²	27	43.5 Å²	43.5	14%	0.144	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-10.7	-174.4	-56.3	-33.2	0	0	0	113.4	A112 S139 A144 L145 F194	A112-D141 HydrophobicContact CB-CB 4.41Å; S139-D141 PolarHBondContact O-N 2.78Å; S139-D141 PolarHBondContact OG-N 3.02Å; D141-A144 VanDerWaalsContact O-CB 3.26Å; D141-A144 WeakPolarHBondContact O-CB 3.14Å; D141-A144 PolarHBondContact O-N 2.83Å; D141-L145 PolarHBondContact O-N 2.79Å; D141-F194 HydrophobicContact CB-CD1 3.74Å; D141-F194 HydrophobicContact CB-CE1 3.56Å; D141-F194 HydrophobicContact CB-CZ 4.38Å
142	H	84.7	Confident	87.1	Confident	31 Å²	31	40.4 Å²	40.4	14%	0.144	19%	0.188	C	C	.	.	H	α-helix	trans	-58.4	-47.3	-178.3	172.4	-78.6	0	0	0	113.2	S139 A144 L145 V146	S139-H142 WeakPolarHBondContact O-CB 3.32Å; S139-H142 PolarHBondContact O-N 3.03Å; H142-A144 VanDerWaalsContact C-N 3.27Å; H142-A144 PolarHBondContact O-N 2.86Å; H142-L145 PolarHBondContact O-N 2.79Å; H142-V146 VanDerWaalsContact O-CG2 3.31Å; H142-V146 WeakPolarHBondContact O-CG2 3.17Å; H142-V146 PolarHBondContact O-N 3.41Å; H142-V146 VanDerWaalsContact O-N 3.09Å
143	P	85.9	Confident	87.1	Confident	78 Å²	78	40.5 Å²	40.5	51%	0.506	19%	0.188	S	C	.	.	H	α-helix	trans	-58.8	-37.6	176.3	-22.9	35.1	0	0	0	113.1	K140 V146 E147	K140-P143 WeakPolarHBondContact O-CD 3.47Å; P143-V146 PolarHBondContact O-N 2.96Å; P143-E147 PolarHBondContact O-N 3.15Å
144	A	85.9	Confident	87.1	Confident	5 Å²	5	43.1 Å²	43.1	4%	0.041	21%	0.205	C	C	.	.	H	α-helix	trans	-59.2	-50.5	178.4	0	0	0	0	0	111.7	D141 H142 E147 V148 V193 F194 L197	D141-A144 VanDerWaalsContact O-CB 3.26Å; D141-A144 WeakPolarHBondContact O-CB 3.14Å; D141-A144 PolarHBondContact O-N 2.83Å; H142-A144 VanDerWaalsContact C-N 3.27Å; H142-A144 PolarHBondContact O-N 2.86Å; A144-E147 PolarHBondContact O-N 2.86Å; A144-V148 WeakPolarHBondContact O-CG2 3.5Å; A144-V148 PolarHBondContact O-N 2.8Å; A144-V193 HydrophobicContact CB-CG1 4.15Å; A144-F194 HydrophobicContact CB-CD1 4.17Å; A144-F194 HydrophobicContact CB-CE1 4.31Å; A144-L197 VanDerWaalsContact CA-CD1 3.49Å; A144-L197 HydrophobicContact CB-CD1 3.2Å
145	L	87.5	Confident	87.2	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-65.1	-40.7	179.5	-72.4	179.2	0	0	0	112	A112 L116 L136 D141 H142 E147 V148 F149 F194	A112-L145 HydrophobicContact CB-CD1 3.72Å; L116-L145 HydrophobicContact CD1-CD2 4.47Å; L136-L145 HydrophobicContact CD1-CB 4.45Å; L136-L145 HydrophobicContact CD1-CD1 4.21Å; L136-L145 HydrophobicContact CD2-CD1 3.74Å; D141-L145 PolarHBondContact O-N 2.79Å; H142-L145 PolarHBondContact O-N 2.79Å; L145-E147 VanDerWaalsContact C-N 3.26Å; L145-E147 PolarHBondContact O-N 3Å; L145-V148 WeakPolarHBondContact O-CB 3.25Å; L145-V148 PolarHBondContact O-N 3.13Å; L145-F149 HydrophobicContact CB-CE2 4.2Å; L145-F149 HydrophobicContact CB-CZ 4.42Å; L145-F149 WeakPolarHBondContact O-CD2 3.4Å; L145-F149 VanDerWaalsContact O-CG 3.24Å; L145-F149 WeakPolarHBondContact O-CG 3.39Å; L145-F149 PolarHBondContact O-N 2.99Å; L145-F194 HydrophobicContact CD2-CE1 4.18Å; L145-F194 HydrophobicContact CD2-CZ 4.06Å; L145-F194 HydrophobicContact CG-CE1 4.1Å; L145-F194 HydrophobicContact CG-CZ 4.3Å
146	V	89.7	Confident	87.5	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.03	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-38.2	177	174.2	0	0	0	0	111	H142 P143 F149 R150 V156 V158	H142-V146 VanDerWaalsContact O-CG2 3.31Å; H142-V146 WeakPolarHBondContact O-CG2 3.17Å; H142-V146 PolarHBondContact O-N 3.41Å; H142-V146 VanDerWaalsContact O-N 3.09Å; P143-V146 PolarHBondContact O-N 2.96Å; V146-F149 PolarHBondContact O-N 2.96Å; V146-R150 WeakPolarHBondContact O-CG 3.4Å; V146-R150 PolarHBondContact O-N 3.23Å; V146-V156 HydrophobicContact CG1-CG1 4.28Å; V146-V158 HydrophobicContact CG1-CG2 4.09Å; V146-V158 HydrophobicContact CG2-CG2 3.75Å
147	E	88.2	Confident	87.8	Confident	80 Å²	80	53.7 Å²	53.7	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-67.7	-40.9	176.3	-168.7	54.5	-149.5	0	0	112.4	P143 A144 L145 F149 R150 K151	P143-E147 PolarHBondContact O-N 3.15Å; A144-E147 PolarHBondContact O-N 2.86Å; L145-E147 VanDerWaalsContact C-N 3.26Å; L145-E147 PolarHBondContact O-N 3Å; E147-F149 VanDerWaalsContact C-N 3.28Å; E147-F149 PolarHBondContact O-N 3.43Å; E147-R150 PolarHBondContact O-N 2.96Å; E147-R150 IonicContact OE2-NH1 2.74Å; E147-R150 PolarHBondContact OE2-NH1 3.19Å; E147-K151 WeakPolarHBondContact O-CG 3.48Å; E147-K151 PolarHBondContact O-N 3.22Å; E147-K151 VanDerWaalsContact O-N 3.12Å
148	V	88.9	Confident	88	Confident	11 Å²	11	55.4 Å²	55.4	7%	0.067	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-43.2	170.7	169.1	0	0	0	0	110.9	L119 A144 L145 K151 L152 V186 L188 V193	L119-V148 HydrophobicContact CD2-CG1 3.79Å; A144-V148 WeakPolarHBondContact O-CG2 3.5Å; A144-V148 PolarHBondContact O-N 2.8Å; L145-V148 WeakPolarHBondContact O-CB 3.25Å; L145-V148 PolarHBondContact O-N 3.13Å; V148-K151 PolarHBondContact O-N 3.08Å; V148-L152 HydrophobicContact CG1-CD1 4.37Å; V148-L152 PolarHBondContact O-N 3.42Å; V148-V186 HydrophobicContact CG1-CG1 3.98Å; V148-V186 HydrophobicContact CG2-CG1 4.49Å; V148-L188 HydrophobicContact CG1-CD2 4.1Å; V148-V193 HydrophobicContact CG2-CG1 3.78Å; V148-V193 HydrophobicContact CG2-CG2 4.05Å
149	F	91.4	Very high	88.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.5	-41.7	176.5	-58.9	-40.3	0	0	0	112.5	T115 L119 F132 T134 L136 L145 V146 E147 K151 L152 F153 V156 V173	T115-F149 HydrophobicContact CG2-CZ 3.86Å; L119-F149 HydrophobicContact CB-CE1 4.37Å; L119-F149 HydrophobicContact CD1-CD1 3.98Å; L119-F149 HydrophobicContact CD1-CE1 3.93Å; L119-F149 HydrophobicContact CD2-CD1 3.85Å; L119-F149 HydrophobicContact CD2-CE1 3.67Å; L119-F149 HydrophobicContact CG-CD1 4.49Å; L119-F149 HydrophobicContact CG-CE1 4.19Å; F132-F149 HydrophobicContact CD1-CE1 4.31Å; F132-F149 AromaticContact CE1-CE1 3.8Å; F132-F149 HydrophobicContact CE1-CE1 3.8Å; F132-F149 HydrophobicContact CE1-CZ 4.14Å; T134-F149 HydrophobicContact CG2-CE2 4.18Å; T134-F149 HydrophobicContact CG2-CZ 3.93Å; L136-F149 HydrophobicContact CD1-CE2 3.83Å; L136-F149 HydrophobicContact CD1-CZ 4.36Å; L145-F149 HydrophobicContact CB-CE2 4.2Å; L145-F149 HydrophobicContact CB-CZ 4.42Å; L145-F149 WeakPolarHBondContact O-CD2 3.4Å; L145-F149 VanDerWaalsContact O-CG 3.24Å; L145-F149 WeakPolarHBondContact O-CG 3.39Å; L145-F149 PolarHBondContact O-N 2.99Å; V146-F149 PolarHBondContact O-N 2.96Å; E147-F149 VanDerWaalsContact C-N 3.28Å; E147-F149 PolarHBondContact O-N 3.43Å; F149-K151 PolarHBondContact O-N 2.91Å; F149-L152 PolarHBondContact O-N 3.44Å; F149-F153 HydrophobicContact CB-CD2 4.47Å; F149-F153 WeakPolarHBondContact O-CD2 3.4Å; F149-F153 PolarHBondContact O-N 3.07Å; F149-V156 HydrophobicContact CB-CG1 4.13Å; F149-V156 HydrophobicContact CB-CG2 3.9Å; F149-V173 HydrophobicContact CD2-CG1 3.86Å; F149-V173 HydrophobicContact CE2-CB 4.43Å; F149-V173 HydrophobicContact CE2-CG1 4.17Å
150	R	91.2	Very high	88.2	Confident	141 Å²	141	56.6 Å²	56.6	53%	0.532	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-30.2	178.4	-75.2	177.5	-173.6	140.4	-2.2	112.7	V146 E147 L152 F153 V156	V146-R150 WeakPolarHBondContact O-CG 3.4Å; V146-R150 PolarHBondContact O-N 3.23Å; E147-R150 PolarHBondContact O-N 2.96Å; E147-R150 IonicContact OE2-NH1 2.74Å; E147-R150 PolarHBondContact OE2-NH1 3.19Å; R150-L152 VanDerWaalsContact C-N 3.35Å; R150-F153 VanDerWaalsContact O-O 3.12Å; R150-V156 HydrophobicContact CG-CB 3.97Å; R150-V156 HydrophobicContact CG-CG2 3.99Å
151	K	90.1	Very high	88.1	Confident	110 Å²	110	51.7 Å²	51.7	48%	0.478	26%	0.261	S	S	.	.	H	α-helix	trans	-71.7	-28.9	174.3	-67.9	175.2	-177.8	177.6	0	112.8	E147 V148 F149 S182 V186	E147-K151 WeakPolarHBondContact O-CG 3.48Å; E147-K151 PolarHBondContact O-N 3.22Å; E147-K151 VanDerWaalsContact O-N 3.12Å; V148-K151 PolarHBondContact O-N 3.08Å; F149-K151 PolarHBondContact O-N 2.91Å; K151-S182 WeakPolarHBondContact O-CB 3.24Å; K151-S182 PolarHBondContact O-OG 3.37Å; K151-V186 HydrophobicContact CB-CG2 3.56Å; K151-V186 HydrophobicContact CD-CG2 3.96Å; K151-V186 HydrophobicContact CG-CG2 4.36Å
152	L	89.6	Confident	87.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-97.9	-21.8	-176.2	-65.1	175.3	0	0	0	114.3	L119 V123 V148 F149 R150 Q179 V183 V186 L188	L119-L152 HydrophobicContact CD1-CD1 4.16Å; L119-L152 HydrophobicContact CD2-CD1 3.86Å; L119-L152 HydrophobicContact CG-CD1 4.25Å; V123-L152 HydrophobicContact CG2-CD1 4.2Å; V148-L152 HydrophobicContact CG1-CD1 4.37Å; V148-L152 PolarHBondContact O-N 3.42Å; F149-L152 PolarHBondContact O-N 3.44Å; R150-L152 VanDerWaalsContact C-N 3.35Å; L152-Q179 PolarHBondContact O-N 3.3Å; L152-V183 HydrophobicContact CD2-CB 4.44Å; L152-V183 HydrophobicContact CD2-CG2 4Å; L152-V186 HydrophobicContact CD2-CB 4.32Å; L152-V186 HydrophobicContact CD2-CG2 4.12Å; L152-V186 HydrophobicContact CG-CG2 4.47Å; L152-L188 HydrophobicContact CD1-CD2 4.18Å
153	F	94	Very high	87.2	Confident	3 Å²	3	63.5 Å²	63.5	1%	0.013	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143.4	-174.3	-64.7	-92.6	0	0	0	111.3	L119 L126 F132 F149 R150 K155 V156 C175 F178	L119-F153 HydrophobicContact CD1-CE2 3.88Å; L119-F153 HydrophobicContact CD1-CZ 4.37Å; L126-F153 HydrophobicContact CD1-CE1 4.23Å; L126-F153 HydrophobicContact CD1-CZ 4.13Å; F132-F153 HydrophobicContact CB-CE1 3.71Å; F132-F153 HydrophobicContact CB-CE2 4.18Å; F132-F153 HydrophobicContact CB-CZ 3.38Å; F132-F153 HydrophobicContact CD1-CE2 4.48Å; F132-F153 HydrophobicContact CD1-CZ 4.42Å; F132-F153 HydrophobicContact CG-CZ 4.16Å; F149-F153 HydrophobicContact CB-CD2 4.47Å; F149-F153 WeakPolarHBondContact O-CD2 3.4Å; F149-F153 PolarHBondContact O-N 3.07Å; R150-F153 VanDerWaalsContact O-O 3.12Å; F153-K155 VanDerWaalsContact C-N 3.34Å; F153-K155 PolarHBondContact O-N 3.28Å; F153-V156 HydrophobicContact CB-CG2 4.06Å; F153-C175 HydrophobicContact CB-CB 3.99Å; F153-C175 HydrophobicContact CD1-CB 3.69Å; F153-C175 HydrophobicContact CD2-CB 3.65Å; F153-C175 HydrophobicContact CE1-CB 4.02Å; F153-C175 HydrophobicContact CE2-CB 3.99Å; F153-C175 HydrophobicContact CG-CB 3.51Å; F153-C175 HydrophobicContact CZ-CB 4.19Å; F153-F178 HydrophobicContact CD1-CB 3.94Å; F153-F178 HydrophobicContact CD1-CD2 4.34Å; F153-F178 HydrophobicContact CE1-CB 3.65Å; F153-F178 AromaticContact CE1-CD2 3.84Å; F153-F178 HydrophobicContact CE1-CD2 3.84Å; F153-F178 HydrophobicContact CE1-CG 4.14Å; F153-F178 HydrophobicContact CE2-CD2 4.42Å; F153-F178 HydrophobicContact CZ-CB 4.48Å; F153-F178 AromaticContact CZ-CD2 3.86Å; F153-F178 HydrophobicContact CZ-CD2 3.86Å
154	T	91.4	Very high	86.4	Confident	86 Å²	86	60.9 Å²	60.9	53%	0.528	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	-38.1	-177.2	-51.4	0	0	0	0	112.3	Q176 G177 Q179	T154-Q176 PolarHBondContact N-O 3.39Å; T154-Q176 VanDerWaalsContact N-O 3.13Å; T154-G177 PolarHBondContact N-O 2.95Å; T154-G177 PolarHBondContact OG1-O 3.12Å; T154-Q179 PolarHBondContact OG1-NE2 3.39Å
155	K	92.7	Very high	85.8	Confident	121 Å²	121	70.4 Å²	70.4	53%	0.526	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134.8	177.6	-64.2	179.6	-178.9	175.7	0	110.1	F153 C175 Q176	F153-K155 VanDerWaalsContact C-N 3.34Å; F153-K155 PolarHBondContact O-N 3.28Å; K155-C175 WeakPolarHBondContact O-CA 3.48Å; K155-Q176 HydrophobicContact CB-CB 4.3Å; K155-Q176 PolarHBondContact N-O 3.45Å; K155-Q176 PolarHBondContact O-N 2.79Å
156	V	93.5	Very high	84.9	Confident	23 Å²	23	79.2 Å²	79.2	14%	0.139	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	117.2	177.3	-179.8	0	0	0	0	109	V146 F149 R150 F153 V173 V174 C175	V146-V156 HydrophobicContact CG1-CG1 4.28Å; F149-V156 HydrophobicContact CB-CG1 4.13Å; F149-V156 HydrophobicContact CB-CG2 3.9Å; R150-V156 HydrophobicContact CG-CB 3.97Å; R150-V156 HydrophobicContact CG-CG2 3.99Å; F153-V156 HydrophobicContact CB-CG2 4.06Å; V156-V173 HydrophobicContact CG1-CG1 3.55Å; V156-V174 WeakPolarHBondContact CA-O 3.29Å; V156-C175 HydrophobicContact CG2-CB 4.41Å
157	H	91.4	Very high	83.9	Confident	113 Å²	113	88 Å²	88	52%	0.523	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	118.6	178.1	-66.8	-72.1	0	0	0	110	V173 V174	H157-V173 WeakPolarHBondContact O-CA 3.34Å; H157-V174 PolarHBondContact N-O 3.03Å; H157-V174 PolarHBondContact O-N 2.78Å
158	V	89.8	Confident	83	Confident	65 Å²	65	85.5 Å²	85.5	39%	0.394	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	117.3	169	-174.6	0	0	0	0	107.8	V146 A171 V173	V146-V158 HydrophobicContact CG1-CG2 4.09Å; V146-V158 HydrophobicContact CG2-CG2 3.75Å; V158-A171 HydrophobicContact CG1-CB 4.13Å; V158-V173 HydrophobicContact CB-CG2 4.47Å; V158-V173 HydrophobicContact CG1-CG2 4.22Å; V158-V173 HydrophobicContact CG2-CG1 4.32Å; V158-V173 HydrophobicContact CG2-CG2 3.95Å
159	T	85.5	Confident	82.3	Confident	69 Å²	69	86.3 Å²	86.3	42%	0.423	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	143.7	-178.6	-172.5	0	0	0	0	111.4	F172	T159-F172 HydrophobicContact CG2-CB 4.29Å; T159-F172 PolarHBondContact N-O 3.27Å; T159-F172 PolarHBondContact O-N 2.93Å; T159-F172 VanDerWaalsContact O-O 3.12Å
160	K	81.8	Confident	81.8	Confident	70 Å²	70	88.6 Å²	88.6	30%	0.304	44%	0.443	S	S	.	.			trans	-108.7	107.3	167.7	-167.9	-178.1	-161	163.9	0	107.4	S164 R165 Q166 S168	K160-S164 WeakPolarHBondContact CE-OG 3.42Å; K160-S164 WeakPolarHBondContact CG-OG 3.29Å; K160-R165 WeakPolarHBondContact CE-O 3.34Å; K160-R165 PolarHBondContact NZ-O 3.27Å; K160-Q166 PolarHBondContact NZ-O 3.49Å; K160-S168 PolarHBondContact NZ-O 3.19Å
161	P	76.5	Confident	81.5	Confident	46 Å²	46	81.9 Å²	81.9	30%	0.299	42%	0.418	S	S	.	.			trans	-64.8	146.8	-179.1	25.9	-32.6	0	0	0	110.3	A163 S164 F172	P161-A163 PolarHBondContact O-N 3.39Å; P161-A163 VanDerWaalsContact O-N 3.14Å; P161-S164 WeakPolarHBondContact O-CB 3Å; P161-S164 PolarHBondContact O-N 2.87Å; P161-S164 PolarHBondContact O-OG 3.37Å; P161-F172 HydrophobicContact CG-CD2 3.7Å; P161-F172 HydrophobicContact CG-CE2 3.76Å
162	Q	74.4	Confident	81.4	Confident	204 Å²	204	79.7 Å²	79.7	95%	0.953	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.6	177.7	-68.3	-175	-23.1	0	0	113	S164	Q162-S164 VanDerWaalsContact C-N 3.26Å; Q162-S164 PolarHBondContact O-N 3.02Å
163	A	71.6	Confident	81.5	Confident	102 Å²	102	79.7 Å²	79.7	84%	0.843	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-21.2	174.8	0	0	0	0	0	113.3	P161	P161-A163 PolarHBondContact O-N 3.39Å; P161-A163 VanDerWaalsContact O-N 3.14Å
164	S	69.6	Low	81.4	Confident	23 Å²	23	81.4 Å²	81.4	16%	0.161	42%	0.419	C	S	.	.	S	Bend	trans	-77.8	142.8	177	70.5	0	0	0	0	111	K160 P161 Q162 Q166	K160-S164 WeakPolarHBondContact CE-OG 3.42Å; K160-S164 WeakPolarHBondContact CG-OG 3.29Å; P161-S164 WeakPolarHBondContact O-CB 3Å; P161-S164 PolarHBondContact O-N 2.87Å; P161-S164 PolarHBondContact O-OG 3.37Å; Q162-S164 VanDerWaalsContact C-N 3.26Å; Q162-S164 PolarHBondContact O-N 3.02Å; S164-Q166 PolarHBondContact O-N 3.32Å
165	R	73	Confident	81.5	Confident	204 Å²	204	77.3 Å²	77.3	77%	0.77	39%	0.394	S	S	*	.			trans	-61.8	137.4	176.5	-62.1	-178.5	-178	-179	1.2	109.8	K160 E167 S168	K160-R165 WeakPolarHBondContact CE-O 3.34Å; K160-R165 PolarHBondContact NZ-O 3.27Å; R165-E167 PolarHBondContact O-N 2.88Å; R165-S168 WeakPolarHBondContact O-CB 3.49Å; R165-S168 PolarHBondContact O-N 3.41Å
166	Q	68.8	Low	81.5	Confident	187 Å²	187	74.8 Å²	74.8	87%	0.874	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-36.5	178.1	-74.4	-174.7	-11.2	0	0	111.8	K160 S164 S168	K160-Q166 PolarHBondContact NZ-O 3.49Å; S164-Q166 PolarHBondContact O-N 3.32Å; Q166-S168 VanDerWaalsContact C-N 3.34Å; Q166-S168 PolarHBondContact O-N 3.03Å
167	E	68.5	Low	81.4	Confident	189 Å²	189	74.2 Å²	74.2	88%	0.883	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-18.7	179	-62.6	173.6	-178.5	0	0	114.3	R165	R165-E167 PolarHBondContact O-N 2.88Å
168	S	69	Low	81.4	Confident	29 Å²	29	69.2 Å²	69.2	20%	0.203	36%	0.359	C	S	.	.			trans	-69.6	138.1	-178.8	179.5	0	0	0	0	111.1	R138 K160 R165 Q166 E170	R138-S168 PolarHBondContact NH1-O 3.26Å; K160-S168 PolarHBondContact NZ-O 3.19Å; R165-S168 WeakPolarHBondContact O-CB 3.49Å; R165-S168 PolarHBondContact O-N 3.41Å; Q166-S168 VanDerWaalsContact C-N 3.34Å; Q166-S168 PolarHBondContact O-N 3.03Å; S168-E170 PolarHBondContact O-N 3.13Å; S168-E170 WeakPolarHBondContact OG-CB 3.45Å; S168-E170 VanDerWaalsContact OG-CD 3.3Å; S168-E170 VanDerWaalsContact OG-CG 3.26Å; S168-E170 WeakPolarHBondContact OG-CG 3.18Å; S168-E170 PolarHBondContact OG-N 3.19Å; S168-E170 VanDerWaalsContact OG-N 3.13Å; S168-E170 PolarHBondContact OG-OE2 3.1Å
169	A	74	Confident	81.4	Confident	28 Å²	28	70 Å²	70	23%	0.231	36%	0.358	C	S	.	.			trans	-70.2	-7.6	171.8	0	0	0	0	0	112.5	W104 F137 R138	W104-A169 HydrophobicContact CZ2-CB 4.29Å; F137-A169 HydrophobicContact CB-CB 4.37Å; R138-A169 WeakPolarHBondContact CG-O 3.5Å; R138-A169 PolarHBondContact N-O 3.38Å; R138-A169 PolarHBondContact NH1-O 3.36Å
170	E	81.4	Confident	81.3	Confident	48 Å²	48	69.6 Å²	69.6	22%	0.224	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	140.3	-175.4	-68.2	163.7	155.4	0	0	113.5	K135 F137 R138 S168	K135-E170 WeakPolarHBondContact CE-OE1 3.44Å; K135-E170 IonicContact NZ-OE1 3.45Å; K135-E170 PolarHBondContact NZ-OE1 3.3Å; F137-E170 HydrophobicContact CD1-CB 4.43Å; F137-E170 HydrophobicContact CD1-CG 3.49Å; F137-E170 VanDerWaalsContact CD1-CG 3.49Å; F137-E170 HydrophobicContact CE1-CG 3.32Å; R138-E170 PolarHBondContact NH1-O 3.37Å; R138-E170 PolarHBondContact NH2-O 2.88Å; S168-E170 PolarHBondContact O-N 3.13Å; S168-E170 WeakPolarHBondContact OG-CB 3.45Å; S168-E170 VanDerWaalsContact OG-CD 3.3Å; S168-E170 VanDerWaalsContact OG-CG 3.26Å; S168-E170 WeakPolarHBondContact OG-CG 3.18Å; S168-E170 PolarHBondContact OG-N 3.19Å; S168-E170 VanDerWaalsContact OG-N 3.13Å; S168-E170 PolarHBondContact OG-OE2 3.1Å
171	A	85.3	Confident	81.2	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	151.6	168.9	0	0	0	0	0	108.2	L136 R138 V158	L136-A171 PolarHBondContact N-O 2.93Å; L136-A171 PolarHBondContact O-N 3.16Å; R138-A171 HydrophobicContact CG-CB 4.32Å; V158-A171 HydrophobicContact CG1-CB 4.13Å
172	F	88.7	Confident	81.4	Confident	63 Å²	63	74.4 Å²	74.4	28%	0.276	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	138.5	172	-69.1	-92.2	0	0	0	108.5	K135 T159 P161	K135-F172 HydrophobicContact CB-CD1 4.22Å; K135-F172 HydrophobicContact CB-CE1 3.99Å; K135-F172 HydrophobicContact CD-CE1 4.15Å; K135-F172 HydrophobicContact CD-CZ 4.19Å; K135-F172 HydrophobicContact CG-CD1 4.4Å; K135-F172 HydrophobicContact CG-CE1 3.95Å; K135-F172 HydrophobicContact CG-CZ 4.2Å; T159-F172 HydrophobicContact CG2-CB 4.29Å; T159-F172 PolarHBondContact N-O 3.27Å; T159-F172 PolarHBondContact O-N 2.93Å; T159-F172 VanDerWaalsContact O-O 3.12Å; P161-F172 HydrophobicContact CG-CD2 3.7Å; P161-F172 HydrophobicContact CG-CE2 3.76Å
173	V	91	Very high	81.4	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	122.8	175.1	-174.4	0	0	0	0	108.2	V133 T134 L136 F149 V156 H157 V158	V133-V173 WeakPolarHBondContact CA-O 3.26Å; T134-V173 HydrophobicContact CG2-CB 4.27Å; T134-V173 PolarHBondContact N-O 3.38Å; T134-V173 PolarHBondContact O-N 2.96Å; L136-V173 HydrophobicContact CD1-CG2 3.8Å; F149-V173 HydrophobicContact CD2-CG1 3.86Å; F149-V173 HydrophobicContact CE2-CB 4.43Å; F149-V173 HydrophobicContact CE2-CG1 4.17Å; V156-V173 HydrophobicContact CG1-CG1 3.55Å; H157-V173 WeakPolarHBondContact O-CA 3.34Å; V158-V173 HydrophobicContact CB-CG2 4.47Å; V158-V173 HydrophobicContact CG1-CG2 4.22Å; V158-V173 HydrophobicContact CG2-CG1 4.32Å; V158-V173 HydrophobicContact CG2-CG2 3.95Å
174	V	92.1	Very high	81.4	Confident	40 Å²	40	71.4 Å²	71.4	24%	0.242	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.8	177.2	-179.1	0	0	0	0	107.6	V133 V156 H157	V133-V174 HydrophobicContact CG1-CG2 4.22Å; V133-V174 HydrophobicContact CG2-CG1 4.3Å; V156-V174 WeakPolarHBondContact CA-O 3.29Å; H157-V174 PolarHBondContact N-O 3.03Å; H157-V174 PolarHBondContact O-N 2.78Å
175	C	93.7	Very high	81.3	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.2	178.5	-55.2	0	0	0	0	109.2	W131 F132 F153 K155 V156	W131-C175 WeakPolarHBondContact CA-O 3.47Å; F132-C175 HydrophobicContact CB-CB 4.14Å; F132-C175 PolarHBondContact N-O 2.7Å; F132-C175 WeakPolarHBondContact O-CA 3.41Å; F132-C175 VanDerWaalsContact O-CB 3.28Å; F132-C175 WeakPolarHBondContact O-CB 3.45Å; F132-C175 PolarHBondContact O-N 3.5Å; F153-C175 HydrophobicContact CB-CB 3.99Å; F153-C175 HydrophobicContact CD1-CB 3.69Å; F153-C175 HydrophobicContact CD2-CB 3.65Å; F153-C175 HydrophobicContact CE1-CB 4.02Å; F153-C175 HydrophobicContact CE2-CB 3.99Å; F153-C175 HydrophobicContact CG-CB 3.51Å; F153-C175 HydrophobicContact CZ-CB 4.19Å; K155-C175 WeakPolarHBondContact O-CA 3.48Å; V156-C175 HydrophobicContact CG2-CB 4.41Å
176	Q	92.7	Very high	81.4	Confident	68 Å²	68	67.4 Å²	67.4	32%	0.318	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.4	-177.1	-178.1	-174.7	20.8	0	0	110.5	W131 T154 K155	W131-Q176 HydrophobicContact CD2-CG 4.41Å; W131-Q176 HydrophobicContact CZ2-CG 4.12Å; T154-Q176 PolarHBondContact N-O 3.39Å; T154-Q176 VanDerWaalsContact N-O 3.13Å; K155-Q176 HydrophobicContact CB-CB 4.3Å; K155-Q176 PolarHBondContact N-O 3.45Å; K155-Q176 PolarHBondContact O-N 2.79Å
177	G	89.9	Confident	81.7	Confident	11 Å²	11	60.8 Å²	60.8	11%	0.113	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80	66.9	170.4	0	0	0	0	0	112.3	G130 T154 Q179	G130-G177 PolarHBondContact O-N 3.05Å; T154-G177 PolarHBondContact N-O 2.95Å; T154-G177 PolarHBondContact OG1-O 3.12Å; G177-Q179 PolarHBondContact O-N 3.48Å
178	F	92.2	Very high	81.9	Confident	7 Å²	7	53 Å²	53	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	131.2	177.7	-180	-125.3	0	0	0	112.4	V123 L126 G129 G130 F153 P180 V183	V123-F178 HydrophobicContact CB-CE2 4.48Å; V123-F178 HydrophobicContact CB-CZ 4.2Å; V123-F178 HydrophobicContact CG1-CZ 4.08Å; V123-F178 HydrophobicContact CG2-CE2 3.92Å; V123-F178 HydrophobicContact CG2-CZ 4.13Å; L126-F178 HydrophobicContact CB-CD1 3.73Å; L126-F178 HydrophobicContact CB-CE1 4.09Å; L126-F178 HydrophobicContact CB-CG 4.23Å; L126-F178 HydrophobicContact CD1-CG 4.41Å; G129-F178 PolarHBondContact N-O 3.44Å; G130-F178 PolarHBondContact O-N 3.45Å; F153-F178 HydrophobicContact CD1-CB 3.94Å; F153-F178 HydrophobicContact CD1-CD2 4.34Å; F153-F178 HydrophobicContact CE1-CB 3.65Å; F153-F178 AromaticContact CE1-CD2 3.84Å; F153-F178 HydrophobicContact CE1-CD2 3.84Å; F153-F178 HydrophobicContact CE1-CG 4.14Å; F153-F178 HydrophobicContact CE2-CD2 4.42Å; F153-F178 HydrophobicContact CZ-CB 4.48Å; F153-F178 AromaticContact CZ-CD2 3.86Å; F153-F178 HydrophobicContact CZ-CD2 3.86Å; F178-P180 HydrophobicContact CD1-CG 4.17Å; F178-P180 HydrophobicContact CE1-CB 4.36Å; F178-P180 HydrophobicContact CE1-CG 3.93Å; F178-P180 WeakPolarHBondContact O-CD 3.49Å; F178-V183 HydrophobicContact CE2-CG2 4.06Å; F178-V183 HydrophobicContact CZ-CG2 3.82Å
179	Q	89.4	Confident	82.2	Confident	81 Å²	81	56.8 Å²	56.8	38%	0.379	30%	0.295	S	S	.	.			trans	-114.9	99.9	-179.9	-62.6	-174.1	-5.2	0	0	110.8	L152 T154 G177 K181 S182	L152-Q179 PolarHBondContact O-N 3.3Å; T154-Q179 PolarHBondContact OG1-NE2 3.39Å; G177-Q179 PolarHBondContact O-N 3.48Å; Q179-K181 PolarHBondContact O-N 3.2Å; Q179-K181 VanDerWaalsContact O-N 3.16Å; Q179-S182 PolarHBondContact O-N 3.02Å; Q179-S182 PolarHBondContact OE1-OG 3.32Å
180	P	83.6	Confident	82.1	Confident	61 Å²	61	59.2 Å²	59.2	40%	0.396	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-61.8	-27	-177.9	-22.6	30.7	0	0	0	114.2	P128 F178 S182 V183	P128-P180 HydrophobicContact CB-CG 4.01Å; P128-P180 HydrophobicContact CG-CG 3.91Å; F178-P180 HydrophobicContact CD1-CG 4.17Å; F178-P180 HydrophobicContact CE1-CB 4.36Å; F178-P180 HydrophobicContact CE1-CG 3.93Å; F178-P180 WeakPolarHBondContact O-CD 3.49Å; P180-S182 VanDerWaalsContact C-N 3.3Å; P180-S182 PolarHBondContact O-N 3.12Å; P180-V183 WeakPolarHBondContact O-CB 3.46Å; P180-V183 WeakPolarHBondContact O-CG2 3.03Å; P180-V183 PolarHBondContact O-N 3.01Å
181	K	80.3	Confident	81.8	Confident	192 Å²	192	63.4 Å²	63.4	84%	0.835	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-63.5	-35.8	-178.8	-63.7	-177.8	-178.7	179.5	0	112.2	Q179 V183	Q179-K181 PolarHBondContact O-N 3.2Å; Q179-K181 VanDerWaalsContact O-N 3.16Å; K181-V183 VanDerWaalsContact C-N 3.27Å; K181-V183 PolarHBondContact O-N 3.21Å
182	S	79.3	Confident	81.2	Confident	25 Å²	25	68.7 Å²	68.7	18%	0.175	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-76.7	-14.3	-176	-50.5	0	0	0	0	113.3	K151 Q179 P180 K184 T185	K151-S182 WeakPolarHBondContact O-CB 3.24Å; K151-S182 PolarHBondContact O-OG 3.37Å; Q179-S182 PolarHBondContact O-N 3.02Å; Q179-S182 PolarHBondContact OE1-OG 3.32Å; P180-S182 VanDerWaalsContact C-N 3.3Å; P180-S182 PolarHBondContact O-N 3.12Å; S182-K184 PolarHBondContact O-N 3.47Å; S182-T185 WeakPolarHBondContact O-CB 3.35Å; S182-T185 PolarHBondContact O-N 3.02Å
183	V	75.9	Confident	80.3	Confident	40 Å²	40	66.3 Å²	66.3	24%	0.242	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-58.1	-38	-178.8	177.9	0	0	0	0	111.5	V123 L152 F178 P180 K181 T185 V186	V123-V183 HydrophobicContact CG1-CB 4.37Å; V123-V183 HydrophobicContact CG1-CG1 3.64Å; V123-V183 HydrophobicContact CG1-CG2 3.73Å; L152-V183 HydrophobicContact CD2-CB 4.44Å; L152-V183 HydrophobicContact CD2-CG2 4Å; F178-V183 HydrophobicContact CE2-CG2 4.06Å; F178-V183 HydrophobicContact CZ-CG2 3.82Å; P180-V183 WeakPolarHBondContact O-CB 3.46Å; P180-V183 WeakPolarHBondContact O-CG2 3.03Å; P180-V183 PolarHBondContact O-N 3.01Å; K181-V183 VanDerWaalsContact C-N 3.27Å; K181-V183 PolarHBondContact O-N 3.21Å; V183-T185 PolarHBondContact O-N 2.73Å; V183-V186 PolarHBondContact O-N 3.23Å
184	K	70.4	Confident	79.4	Confident	204 Å²	204	67 Å²	67	89%	0.887	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-66.5	-24.4	179.2	-65.2	-176.1	179.8	-178.3	0	113.3	S182	S182-K184 PolarHBondContact O-N 3.47Å
185	T	68.7	Low	78	Confident	123 Å²	123	70.8 Å²	70.8	76%	0.755	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-83.6	-21.3	-177.1	-50.4	0	0	0	0	112.2	S182 V183	S182-T185 WeakPolarHBondContact O-CB 3.35Å; S182-T185 PolarHBondContact O-N 3.02Å; V183-T185 PolarHBondContact O-N 2.73Å
186	V	74.3	Confident	76.2	Confident	19 Å²	19	76.9 Å²	76.9	12%	0.115	38%	0.381	C	S	.	.	S	Bend	trans	-109	121.5	-169	-175.8	0	0	0	0	110.9	V148 K151 L152 V183 L188	V148-V186 HydrophobicContact CG1-CG1 3.98Å; V148-V186 HydrophobicContact CG2-CG1 4.49Å; K151-V186 HydrophobicContact CB-CG2 3.56Å; K151-V186 HydrophobicContact CD-CG2 3.96Å; K151-V186 HydrophobicContact CG-CG2 4.36Å; L152-V186 HydrophobicContact CD2-CB 4.32Å; L152-V186 HydrophobicContact CD2-CG2 4.12Å; L152-V186 HydrophobicContact CG-CG2 4.47Å; V183-V186 PolarHBondContact O-N 3.23Å; V186-L188 HydrophobicContact CG1-CD2 4.34Å; V186-L188 PolarHBondContact O-N 3.25Å
187	S	74.5	Confident	74.2	Confident	49 Å²	49	77.6 Å²	77.6	34%	0.343	39%	0.386	S	S	.	.			trans	-75.5	117.9	169.8	-165.1	0	0	0	0	110.3	Q189 V193	S187-Q189 PolarHBondContact O-N 2.83Å; S187-V193 VanDerWaalsContact O-CG2 3.29Å; S187-V193 WeakPolarHBondContact O-CG2 3.42Å
188	L	72.4	Confident	72.4	Confident	26 Å²	26	80.2 Å²	80.2	14%	0.136	40%	0.403	C	S	.	.			trans	-87.6	19.4	175.8	-62.3	175	0	0	0	112.7	L116 L119 K120 V123 V148 L152 V186	L116-L188 HydrophobicContact CD1-CD2 4.12Å; L116-L188 VanDerWaalsContact CD2-O 3.29Å; L116-L188 WeakPolarHBondContact CD2-O 3.44Å; L119-L188 HydrophobicContact CD2-CD2 3.81Å; L119-L188 HydrophobicContact CG-CD2 4.49Å; K120-L188 HydrophobicContact CD-CB 4.4Å; K120-L188 WeakPolarHBondContact CE-O 3.48Å; K120-L188 HydrophobicContact CG-CB 3.94Å; K120-L188 HydrophobicContact CG-CD1 3.78Å; K120-L188 HydrophobicContact CG-CG 4.44Å; K120-L188 PolarHBondContact NZ-O 3.16Å; K120-L188 VanDerWaalsContact NZ-O 3.07Å; V123-L188 HydrophobicContact CG2-CD1 4.47Å; V148-L188 HydrophobicContact CG1-CD2 4.1Å; L152-L188 HydrophobicContact CD1-CD2 4.18Å; V186-L188 HydrophobicContact CG1-CD2 4.34Å; V186-L188 PolarHBondContact O-N 3.25Å
189	Q	75.7	Confident	70.2	Confident	107 Å²	107	86.3 Å²	86.3	50%	0.5	44%	0.435	S	S	.	.			trans	-89.5	122.5	177.7	-69.4	-179.8	-10.1	0	0	110.1	S187 K191 K192 V193	S187-Q189 PolarHBondContact O-N 2.83Å; Q189-K191 PolarHBondContact O-N 3.02Å; Q189-K192 PolarHBondContact O-N 3.21Å; Q189-V193 WeakPolarHBondContact O-CG2 3.31Å; Q189-V193 PolarHBondContact O-N 2.92Å; Q189-V193 VanDerWaalsContact O-N 3.13Å
190	Y	72.8	Confident	68.1	Low	79 Å²	79	89.9 Å²	89.9	31%	0.31	45%	0.452	S	S	.	.	H	α-helix	trans	-54.9	-39	-176.3	63.1	-91.2	0	0	0	112.8	F109 K192 V193 F194	F109-Y190 HydrophobicContact CZ-CD2 4.16Å; Y190-K192 PolarHBondContact O-N 3.35Å; Y190-V193 PolarHBondContact O-N 2.78Å; Y190-F194 WeakPolarHBondContact O-CD2 3.49Å; Y190-F194 WeakPolarHBondContact O-CG 3.39Å; Y190-F194 PolarHBondContact O-N 3.09Å
191	K	75.3	Confident	66.2	Low	137 Å²	137	91.6 Å²	91.6	60%	0.596	46%	0.463	S	S	*	.	H	α-helix	trans	-55	-53.2	179.3	-65.1	-170.5	177.5	-176.1	0	111.3	Q189 E195	Q189-K191 PolarHBondContact O-N 3.02Å; K191-E195 WeakPolarHBondContact O-CB 3.15Å; K191-E195 PolarHBondContact O-N 3.25Å
192	K	72.1	Confident	64.6	Low	110 Å²	110	90.2 Å²	90.2	48%	0.478	46%	0.46	S	S	.	.	H	α-helix	trans	-65.8	-44.4	179.8	-67.7	-179.7	177.4	178.6	0	112.5	Q189 Y190 F194 E195 D196	Q189-K192 PolarHBondContact O-N 3.21Å; Y190-K192 PolarHBondContact O-N 3.35Å; K192-F194 VanDerWaalsContact C-N 3.3Å; K192-F194 PolarHBondContact O-N 3.36Å; K192-E195 PolarHBondContact O-N 3.2Å; K192-D196 PolarHBondContact O-N 3.22Å
193	V	69.8	Low	62.9	Low	13 Å²	13	96.9 Å²	96.9	8%	0.079	49%	0.485	C	S	.	.	H	α-helix	trans	-61	-37.8	-177.6	174.7	0	0	0	0	112.2	A144 V148 S187 Q189 Y190	A144-V193 HydrophobicContact CB-CG1 4.15Å; V148-V193 HydrophobicContact CG2-CG1 3.78Å; V148-V193 HydrophobicContact CG2-CG2 4.05Å; S187-V193 VanDerWaalsContact O-CG2 3.29Å; S187-V193 WeakPolarHBondContact O-CG2 3.42Å; Q189-V193 WeakPolarHBondContact O-CG2 3.31Å; Q189-V193 PolarHBondContact O-N 2.92Å; Q189-V193 VanDerWaalsContact O-N 3.13Å; Y190-V193 PolarHBondContact O-N 2.78Å
194	F	71.5	Confident	61.4	Low	15 Å²	15	100.7 Å²	100.7	7%	0.066	51%	0.509	C	S	.	.	H	α-helix	trans	-94.1	-21.6	-177.9	-57.3	-50	0	0	0	113.8	F109 A112 D141 A144 L145 Y190 K192 S198	F109-F194 HydrophobicContact CD2-CD2 4.28Å; F109-F194 HydrophobicContact CD2-CE2 4.44Å; F109-F194 AromaticContact CE2-CD2 3.55Å; F109-F194 HydrophobicContact CE2-CD2 3.55Å; F109-F194 AromaticContact CE2-CE2 3.96Å; F109-F194 HydrophobicContact CE2-CE2 3.96Å; F109-F194 HydrophobicContact CE2-CG 4.31Å; F109-F194 HydrophobicContact CZ-CD2 4.32Å; A112-F194 HydrophobicContact CB-CE1 4.31Å; A112-F194 HydrophobicContact CB-CE2 4.4Å; A112-F194 HydrophobicContact CB-CZ 3.68Å; D141-F194 HydrophobicContact CB-CD1 3.74Å; D141-F194 HydrophobicContact CB-CE1 3.56Å; D141-F194 HydrophobicContact CB-CZ 4.38Å; A144-F194 HydrophobicContact CB-CD1 4.17Å; A144-F194 HydrophobicContact CB-CE1 4.31Å; L145-F194 HydrophobicContact CD2-CE1 4.18Å; L145-F194 HydrophobicContact CD2-CZ 4.06Å; L145-F194 HydrophobicContact CG-CE1 4.1Å; L145-F194 HydrophobicContact CG-CZ 4.3Å; Y190-F194 WeakPolarHBondContact O-CD2 3.49Å; Y190-F194 WeakPolarHBondContact O-CG 3.39Å; Y190-F194 PolarHBondContact O-N 3.09Å; K192-F194 VanDerWaalsContact C-N 3.3Å; K192-F194 PolarHBondContact O-N 3.36Å; F194-S198 PolarHBondContact O-OG 3.36Å
195	E	63	Low	60.2	Low	120 Å²	120	99.1 Å²	99.1	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-71.1	-43.8	174.4	-175.9	172.6	-168.3	0	0	112	K191 K192 L197 S198	K191-E195 WeakPolarHBondContact O-CB 3.15Å; K191-E195 PolarHBondContact O-N 3.25Å; K192-E195 PolarHBondContact O-N 3.2Å; E195-L197 PolarHBondContact O-N 3.23Å; E195-S198 PolarHBondContact O-N 3.38Å
196	D	56	Low	59.1	Low	128 Å²	128	97.3 Å²	97.3	68%	0.684	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-22.2	-178.3	-82.3	-10.2	0	0	0	113.6	K192	K192-D196 PolarHBondContact O-N 3.22Å
197	L	50.5	Low	57.8	Low	83 Å²	83	100.5 Å²	100.5	44%	0.435	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-9.3	-179.9	-72.9	161.8	0	0	0	114.5	A144 E195 L199	A144-L197 VanDerWaalsContact CA-CD1 3.49Å; A144-L197 HydrophobicContact CB-CD1 3.2Å; E195-L197 PolarHBondContact O-N 3.23Å; L197-L199 VanDerWaalsContact C-N 3.28Å
198	S	51.8	Low	56.7	Low	66 Å²	66	99.9 Å²	99.9	46%	0.462	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-14.4	174.9	-67.6	0	0	0	0	112.5	F194 E195 E200	F194-S198 PolarHBondContact O-OG 3.36Å; E195-S198 PolarHBondContact O-N 3.38Å; S198-E200 VanDerWaalsContact C-N 3.3Å; S198-E200 PolarHBondContact O-N 3.04Å
199	L	47.3	Very low	55.3	Low	135 Å²	135	102.5 Å²	102.5	71%	0.707	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	3.2	-179.3	-68.9	174.9	0	0	0	115.2	L197 P201	L197-L199 VanDerWaalsContact C-N 3.28Å; L199-P201 WeakPolarHBondContact O-CD 3.22Å
200	E	45.3	Very low	54.3	Low	155 Å²	155	104.8 Å²	104.8	72%	0.724	52%	0.516	S	S	*	.			trans	-99.5	75.8	159.4	-67.6	174.6	175.4	0	0	107.9	S198 E202	S198-E200 VanDerWaalsContact C-N 3.3Å; S198-E200 PolarHBondContact O-N 3.04Å; E200-E202 PolarHBondContact O-N 3.34Å
201	P	42.4	Very low	53	Low	98 Å²	98	106.3 Å²	106.3	64%	0.636	54%	0.536	S	S	*	.			trans	-62.6	98.9	153.6	29.8	-26.9	0	0	0	103.3	L199 K203	L199-P201 WeakPolarHBondContact O-CD 3.22Å; P201-K203 PolarHBondContact O-N 3.27Å
202	E	47.2	Very low	51.9	Low	163 Å²	163	106.1 Å²	106.1	76%	0.762	54%	0.537	S	S	*	.			trans	-39.3	99.3	155.8	-84.6	-89.5	166.5	0	0	104.5	E200 T204	E200-E202 PolarHBondContact O-N 3.34Å; E202-T204 WeakPolarHBondContact O-CA 3.26Å; E202-T204 PolarHBondContact O-N 3.21Å; E202-T204 PolarHBondContact O-OG1 2.93Å
203	K	43.4	Very low	51	Low	165 Å²	165	111 Å²	111	72%	0.717	56%	0.558	S	S	*	*			trans	-56.4	100.6	179.7	-72.1	-172.7	179.2	-168.6	0	101.9	P201 K205	P201-K203 PolarHBondContact O-N 3.27Å; K203-K205 PolarHBondContact O-N 3Å
204	T	45.1	Very low	49.8	Very low	119 Å²	119	117.4 Å²	117.4	73%	0.73	59%	0.587	S	S	*	*			trans	-72.9	87.5	-173.7	-4.8	0	0	0	0	100.4	E202 I206	E202-T204 WeakPolarHBondContact O-CA 3.26Å; E202-T204 PolarHBondContact O-N 3.21Å; E202-T204 PolarHBondContact O-OG1 2.93Å; T204-I206 PolarHBondContact O-N 3.12Å
205	K	44.1	Very low	48.7	Very low	172 Å²	172	125.9 Å²	125.9	75%	0.748	62%	0.624	S	S	*	*			trans	-62	93.3	173.4	-70.6	-177.4	-176.9	177.2	0	101.6	K203 N207	K203-K205 PolarHBondContact O-N 3Å; K205-N207 PolarHBondContact O-N 3.33Å
206	I	45.9	Very low	48.1	Very low	85 Å²	85	130.3 Å²	130.3	44%	0.436	64%	0.636	S	S	.	*			trans	-60.5	97.3	171.3	-61.9	172.2	0	0	0	101.4	T204 T208	T204-I206 PolarHBondContact O-N 3.12Å; I206-T208 HydrophobicContact CG2-CG2 4.21Å; I206-T208 PolarHBondContact O-N 2.95Å; I206-T208 PolarHBondContact O-OG1 3.05Å
207	N	48.2	Very low	47.9	Very low	86 Å²	86	133 Å²	133	46%	0.46	64%	0.641	S	S	.	*			trans	-69.2	77.9	175.8	-82.8	-26.2	0	0	0	104.9	K205 L209 Y210	K205-N207 PolarHBondContact O-N 3.33Å; N207-L209 PolarHBondContact O-N 3.35Å; N207-L209 VanDerWaalsContact O-N 3.11Å; N207-Y210 VanDerWaalsContact CB-O 3.22Å; N207-Y210 WeakPolarHBondContact CB-O 3.47Å; N207-Y210 CarbonylContact O-C 2.89Å; N207-Y210 WeakPolarHBondContact O-CA 3.46Å; N207-Y210 PolarHBondContact O-N 3.44Å
208	T	50.5	Low	48	Very low	36 Å²	36	134.2 Å²	134.2	22%	0.221	66%	0.663	C	S	.	*	T	Hydrogen-bonded Turn	trans	-57.1	-25.8	175.3	15.3	0	0	0	0	110.4	I206	I206-T208 HydrophobicContact CG2-CG2 4.21Å; I206-T208 PolarHBondContact O-N 2.95Å; I206-T208 PolarHBondContact O-OG1 3.05Å
209	L	43.7	Very low	48	Very low	80 Å²	80	139.4 Å²	139.4	42%	0.419	68%	0.68	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	-26	173.6	-71.6	161.7	0	0	0	114.2	N207	N207-L209 PolarHBondContact O-N 3.35Å; N207-L209 VanDerWaalsContact O-N 3.11Å
210	Y	53.5	Low	48.1	Very low	156 Å²	156	136.1 Å²	136.1	61%	0.612	68%	0.679	S	S	*	*	S	Bend	trans	-137.4	82.3	177.6	-53.1	-79.8	0	0	0	108.6	N207 E212	N207-Y210 VanDerWaalsContact CB-O 3.22Å; N207-Y210 WeakPolarHBondContact CB-O 3.47Å; N207-Y210 CarbonylContact O-C 2.89Å; N207-Y210 WeakPolarHBondContact O-CA 3.46Å; N207-Y210 PolarHBondContact O-N 3.44Å; Y210-E212 PolarHBondContact O-N 3.17Å
211	P	47.1	Very low	48.4	Very low	110 Å²	110	137.5 Å²	137.5	71%	0.714	68%	0.679	S	S	*	*			trans	-65.6	89.5	169.4	27	-31.7	0	0	0	106.7	K213	P211-K213 PolarHBondContact O-N 3.44Å
212	E	50.6	Low	49	Very low	134 Å²	134	136.3 Å²	136.3	63%	0.626	68%	0.678	S	S	*	*			trans	-54	131.2	165.7	-82.4	-164.6	156.6	0	0	106.1	Y210 Q214	Y210-E212 PolarHBondContact O-N 3.17Å; E212-Q214 PolarHBondContact O-N 3.45Å
213	K	53	Low	49.3	Very low	213 Å²	213	136.9 Å²	136.9	93%	0.926	69%	0.686	S	S	*	*			trans	-70.7	43.9	174.5	-64.3	-178.2	179.7	178.9	0	110.5	P211 K215	P211-K213 PolarHBondContact O-N 3.44Å; K213-K215 PolarHBondContact O-N 2.97Å
214	Q	46.5	Very low	50.1	Low	147 Å²	147	132.8 Å²	132.8	69%	0.687	69%	0.69	S	S	*	*			trans	-72.2	122.6	163.8	-90.3	178	-3.5	0	0	107.4	E212 R216	E212-Q214 PolarHBondContact O-N 3.45Å; Q214-R216 PolarHBondContact O-N 3.38Å
215	K	48	Very low	50.4	Low	192 Å²	192	129.9 Å²	129.9	84%	0.835	68%	0.678	S	S	*	*			trans	-55.3	106.7	167.7	-67.7	178.5	178.8	179.7	0	106.4	K213 K217	K213-K215 PolarHBondContact O-N 2.97Å; K215-K217 PolarHBondContact O-N 3.07Å; K215-K217 VanDerWaalsContact O-N 3.15Å
216	R	50.4	Low	51.1	Low	214 Å²	214	128.7 Å²	128.7	81%	0.808	69%	0.685	S	S	*	*			trans	-54.2	125.3	171.4	-65.2	-176.1	-176.3	-169	0.2	106.3	Q214 A218	Q214-R216 PolarHBondContact O-N 3.38Å; R216-A218 PolarHBondContact O-N 2.94Å
217	K	50.7	Low	51.8	Low	185 Å²	185	129.5 Å²	129.5	80%	0.804	69%	0.694	S	S	*	*			trans	-59.5	136.9	166.2	-66	178.5	-177.9	174.2	0	105.3	K215 E219	K215-K217 PolarHBondContact O-N 3.07Å; K215-K217 VanDerWaalsContact O-N 3.15Å; K217-E219 PolarHBondContact O-N 3.06Å
218	A	52.6	Low	52.7	Low	108 Å²	108	132 Å²	132	89%	0.893	71%	0.707	S	S	*	*			trans	-65.3	91.4	172.8	0	0	0	0	0	106.5	R216	R216-A218 PolarHBondContact O-N 2.94Å
219	E	53.3	Low	53.9	Low	174 Å²	174	135.1 Å²	135.1	81%	0.813	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-64	138.5	166.3	-72.4	176.6	175.5	0	0	106.7	K217	K217-E219 PolarHBondContact O-N 3.06Å
220	G	48	Very low	55.7	Low	67 Å²	67	134.5 Å²	134.5	69%	0.691	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-58.7	158.9	172.1	0	0	0	0	0	109.9	A222	G220-A222 PolarHBondContact O-N 3.33Å
221	Y	52.9	Low	57.2	Low	183 Å²	183	132.3 Å²	132.3	72%	0.718	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-55.6	136.9	169.1	-59.5	-83.9	0	0	0	108.8	D223 L228	Y221-D223 PolarHBondContact O-N 3.42Å; Y221-L228 HydrophobicContact CD1-CD1 4.14Å; Y221-L228 HydrophobicContact CE1-CD1 4.04Å
222	A	54.2	Low	59.1	Low	74 Å²	74	127.7 Å²	127.7	61%	0.612	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-59	131.5	170.3	0	0	0	0	0	108.6	G220 G224 A225	G220-A222 PolarHBondContact O-N 3.33Å; A222-G224 PolarHBondContact O-N 2.67Å; A222-G224 VanDerWaalsContact O-N 3.08Å; A222-A225 HydrophobicContact CB-CB 4.43Å; A222-A225 PolarHBondContact O-N 3.11Å; A222-A225 VanDerWaalsContact O-N 3.08Å
223	D	54.2	Low	60.9	Low	175 Å²	175	125.1 Å²	125.1	94%	0.936	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	116.3	179.8	-71.2	-39.7	0	0	0	109.7	Y221	Y221-D223 PolarHBondContact O-N 3.42Å
224	G	58.6	Low	62.5	Low	78 Å²	78	115 Å²	115	80%	0.804	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.2	-6.3	178.7	0	0	0	0	0	116.5	A222 V226	A222-G224 PolarHBondContact O-N 2.67Å; A222-G224 VanDerWaalsContact O-N 3.08Å; G224-V226 PolarHBondContact O-N 3.1Å
225	A	51.4	Low	64.4	Low	58 Å²	58	110.9 Å²	110.9	48%	0.479	61%	0.607	S	S	.	*			trans	-85.9	101.2	176.5	0	0	0	0	0	111.7	A222 T227	A222-A225 HydrophobicContact CB-CB 4.43Å; A222-A225 PolarHBondContact O-N 3.11Å; A222-A225 VanDerWaalsContact O-N 3.08Å; A225-T227 VanDerWaalsContact C-N 3.35Å
226	V	59	Low	66.3	Low	147 Å²	147	107 Å²	107	89%	0.891	59%	0.592	S	S	*	*			trans	-69.5	-33	177.6	-177.6	0	0	0	0	111.8	G224	G224-V226 PolarHBondContact O-N 3.1Å
227	T	61.9	Low	68.1	Low	102 Å²	102	96.8 Å²	96.8	63%	0.626	55%	0.553	S	S	*	*			trans	-117.1	124	-176.7	54.5	0	0	0	0	111.3	A225 F229	A225-T227 VanDerWaalsContact C-N 3.35Å; T227-F229 PolarHBondContact O-N 3.42Å
228	L	66.3	Low	69.8	Low	140 Å²	140	88 Å²	88	73%	0.733	52%	0.515	S	S	*	.	S	Bend	trans	-67.4	-17.4	172.9	-160.7	68.9	0	0	0	112.5	Y221 N230	Y221-L228 HydrophobicContact CD1-CD1 4.14Å; Y221-L228 HydrophobicContact CE1-CD1 4.04Å; L228-N230 PolarHBondContact O-N 2.85Å
229	F	75.9	Confident	71.4	Confident	100 Å²	100	86.6 Å²	86.6	44%	0.439	50%	0.496	S	S	.	.			trans	-88.4	98.5	179.9	-159.4	-91.5	0	0	0	110.7	T227 K231 N251 E252	T227-F229 PolarHBondContact O-N 3.42Å; F229-K231 HydrophobicContact CD1-CD 4.5Å; F229-K231 HydrophobicContact CD1-CG 3.79Å; F229-K231 HydrophobicContact CE1-CD 4.31Å; F229-K231 HydrophobicContact CE1-CG 3.76Å; F229-N251 HydrophobicContact CD1-CB 4.38Å; F229-N251 HydrophobicContact CD2-CB 3.71Å; F229-N251 HydrophobicContact CE1-CB 4.15Å; F229-N251 HydrophobicContact CE2-CB 3.44Å; F229-N251 VanDerWaalsContact CE2-CB 3.44Å; F229-N251 HydrophobicContact CG-CB 4.19Å; F229-N251 HydrophobicContact CZ-CB 3.69Å; F229-E252 HydrophobicContact CE1-CB 3.79Å; F229-E252 WeakPolarHBondContact CE1-OE2 3.43Å; F229-E252 HydrophobicContact CZ-CB 3.85Å
230	N	82.2	Confident	72.9	Confident	68 Å²	68	79.7 Å²	79.7	36%	0.364	47%	0.466	S	S	.	.			trans	-83.8	125.4	171.6	-170.7	20.1	0	0	0	111.4	L228 N251	L228-N230 PolarHBondContact O-N 2.85Å; N230-N251 PolarHBondContact N-ND2 3.14Å; N230-N251 WeakPolarHBondContact O-CB 3.5Å; N230-N251 PolarHBondContact O-N 3.08Å; N230-N251 PolarHBondContact O-ND2 2.84Å
231	K	85.1	Confident	74.6	Confident	110 Å²	110	82.4 Å²	82.4	48%	0.478	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.7	172	-55.7	-167.8	-179.2	-135.4	0	108.4	F229 E252 I254	F229-K231 HydrophobicContact CD1-CD 4.5Å; F229-K231 HydrophobicContact CD1-CG 3.79Å; F229-K231 HydrophobicContact CE1-CD 4.31Å; F229-K231 HydrophobicContact CE1-CG 3.76Å; K231-E252 WeakPolarHBondContact CA-O 3.06Å; K231-E252 VanDerWaalsContact CE-OE2 3.31Å; K231-E252 WeakPolarHBondContact CE-OE2 3.5Å; K231-E252 HydrophobicContact CG-CB 4.44Å; K231-E252 IonicContact NZ-OE2 3.42Å; K231-E252 PolarHBondContact NZ-OE2 3.06Å; K231-I254 HydrophobicContact CB-CD1 3.82Å; K231-I254 HydrophobicContact CB-CG1 4.24Å; K231-I254 HydrophobicContact CD-CD1 4.03Å
232	V	86.7	Confident	76	Confident	12 Å²	12	78.8 Å²	78.8	7%	0.073	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	144.9	-179.1	-178.1	0	0	0	0	109.9	E236 I246 A250 E252 L253 I254	V232-E236 HydrophobicContact CG1-CB 4.4Å; V232-I246 HydrophobicContact CB-CG2 4.22Å; V232-I246 HydrophobicContact CG1-CG2 3.63Å; V232-I246 HydrophobicContact CG2-CG2 4.36Å; V232-A250 HydrophobicContact CB-CB 4.18Å; V232-A250 HydrophobicContact CG2-CB 3.81Å; V232-E252 PolarHBondContact N-O 2.85Å; V232-L253 HydrophobicContact CB-CD2 4.18Å; V232-L253 CarbonylContact O-C 3.54Å; V232-L253 VanDerWaalsContact O-CA 3.27Å; V232-L253 WeakPolarHBondContact O-CA 3.41Å; V232-I254 PolarHBondContact O-N 2.95Å
233	D	88.8	Confident	77.3	Confident	81 Å²	81	77.8 Å²	77.8	43%	0.433	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	133.8	178.7	-64.9	-20	0	0	0	110.8	L235 E236 F237	D233-L235 PolarHBondContact O-N 2.81Å; D233-E236 HydrophobicContact CB-CB 4.45Å; D233-E236 WeakPolarHBondContact O-CB 3.44Å; D233-E236 PolarHBondContact O-N 3.27Å; D233-E236 VanDerWaalsContact O-N 3.14Å; D233-F237 PolarHBondContact O-N 3.29Å
234	A	86.4	Confident	78.7	Confident	0 Å²	0	73 Å²	73	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-63	-28.4	-179.2	0	0	0	0	0	112.4	F237 V238 I254 L255 L260 W291	A234-F237 WeakPolarHBondContact O-CB 3.24Å; A234-F237 PolarHBondContact O-N 3.27Å; A234-V238 VanDerWaalsContact O-CG2 3.28Å; A234-V238 WeakPolarHBondContact O-CG2 3.36Å; A234-V238 PolarHBondContact O-N 3.18Å; A234-I254 WeakPolarHBondContact CB-O 3.41Å; A234-I254 PolarHBondContact N-O 3.08Å; A234-L255 HydrophobicContact CB-CD2 3.5Å; A234-L255 VanDerWaalsContact CB-CD2 3.5Å; A234-L255 HydrophobicContact CB-CG 4.25Å; A234-L260 HydrophobicContact CB-CD1 3.97Å; A234-W291 HydrophobicContact CB-CH2 4.34Å
235	L	86.1	Confident	79.7	Confident	61 Å²	61	75.2 Å²	75.2	32%	0.319	40%	0.402	S	S	.	.	H	α-helix	trans	-67.4	-39.1	175.4	178.8	67.4	0	0	0	112.6	D233 F237 V238 T239 D257 L260 L299	D233-L235 PolarHBondContact O-N 2.81Å; L235-F237 VanDerWaalsContact C-N 3.32Å; L235-V238 PolarHBondContact O-N 2.96Å; L235-T239 WeakPolarHBondContact O-CB 3.05Å; L235-T239 PolarHBondContact O-N 3.02Å; L235-T239 PolarHBondContact O-OG1 2.87Å; L235-D257 WeakPolarHBondContact CB-OD2 3.29Å; L235-L260 HydrophobicContact CB-CD1 4.42Å; L235-L299 HydrophobicContact CD1-CD1 4.02Å
236	E	87.2	Confident	81.3	Confident	109 Å²	109	73.4 Å²	73.4	51%	0.509	38%	0.384	S	S	.	.	H	α-helix	trans	-61.9	-44.2	173.9	-168.1	-174.4	167.1	0	0	110.1	V232 D233 V238 T239 S240 I246	V232-E236 HydrophobicContact CG1-CB 4.4Å; D233-E236 HydrophobicContact CB-CB 4.45Å; D233-E236 WeakPolarHBondContact O-CB 3.44Å; D233-E236 PolarHBondContact O-N 3.27Å; D233-E236 VanDerWaalsContact O-N 3.14Å; E236-V238 PolarHBondContact O-N 2.92Å; E236-T239 PolarHBondContact O-N 3.44Å; E236-S240 WeakPolarHBondContact O-CB 3.31Å; E236-S240 PolarHBondContact O-N 2.83Å; E236-S240 PolarHBondContact O-OG 3.26Å; E236-I246 HydrophobicContact CG-CD1 4.16Å
237	F	88.1	Confident	82.4	Confident	1 Å²	1	66.9 Å²	66.9	0%	0.004	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-41.6	174.7	172.2	-107.7	0	0	0	113.2	D233 A234 L235 S240 Y243 I246 L247 L253 L288 W291 R292	D233-F237 PolarHBondContact O-N 3.29Å; A234-F237 WeakPolarHBondContact O-CB 3.24Å; A234-F237 PolarHBondContact O-N 3.27Å; L235-F237 VanDerWaalsContact C-N 3.32Å; F237-S240 PolarHBondContact O-OG 2.83Å; F237-Y243 HydrophobicContact CE2-CD2 4.19Å; F237-Y243 HydrophobicContact CE2-CG 4.46Å; F237-Y243 WeakPolarHBondContact CE2-O 2.92Å; F237-I246 HydrophobicContact CB-CG2 4.31Å; F237-I246 HydrophobicContact CD2-CG2 4.27Å; F237-L247 HydrophobicContact CE2-CB 4.18Å; F237-L247 HydrophobicContact CE2-CD1 3.98Å; F237-L247 HydrophobicContact CZ-CD1 4.2Å; F237-L253 HydrophobicContact CB-CD2 3.97Å; F237-L253 HydrophobicContact CD1-CD1 4.08Å; F237-L253 HydrophobicContact CE1-CD1 4.37Å; F237-L253 HydrophobicContact CG-CD1 4.25Å; F237-L253 HydrophobicContact CG-CD2 4.29Å; F237-L288 HydrophobicContact CE1-CD2 4.47Å; F237-W291 HydrophobicContact CD1-CZ3 4.33Å; F237-W291 HydrophobicContact CE1-CZ3 4.34Å; F237-R292 HydrophobicContact CE1-CB 4.03Å; F237-R292 HydrophobicContact CE1-CG 4.39Å; F237-R292 WeakPolarHBondContact O-CD 3.18Å; F237-R292 PolarHBondContact O-NE 3.43Å
238	V	87.7	Confident	83.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-69.9	-40.7	-179.5	171.4	0	0	0	0	111.5	A234 L235 E236 W291 R292 M295 K296 L299	A234-V238 VanDerWaalsContact O-CG2 3.28Å; A234-V238 WeakPolarHBondContact O-CG2 3.36Å; A234-V238 PolarHBondContact O-N 3.18Å; L235-V238 PolarHBondContact O-N 2.96Å; E236-V238 PolarHBondContact O-N 2.92Å; V238-W291 HydrophobicContact CG2-CH2 4.15Å; V238-W291 HydrophobicContact CG2-CZ3 4.12Å; V238-R292 HydrophobicContact CG2-CG 4.38Å; V238-R292 PolarHBondContact O-NE 2.98Å; V238-M295 HydrophobicContact CG1-CB 3.82Å; V238-M295 HydrophobicContact CG2-CB 4.18Å; V238-K296 HydrophobicContact CG1-CB 4.14Å; V238-L299 HydrophobicContact CG1-CD1 3.96Å
239	T	85.2	Confident	84.1	Confident	79 Å²	79	58.9 Å²	58.9	49%	0.485	31%	0.307	S	S	.	.	H	α-helix	trans	-80.6	-46.9	-171.8	-52.1	0	0	0	0	112.2	L235 E236 K296	L235-T239 WeakPolarHBondContact O-CB 3.05Å; L235-T239 PolarHBondContact O-N 3.02Å; L235-T239 PolarHBondContact O-OG1 2.87Å; E236-T239 PolarHBondContact O-N 3.44Å; T239-K296 PolarHBondContact O-NZ 3.16Å; T239-K296 VanDerWaalsContact O-NZ 3.08Å
240	S	84.7	Confident	84.4	Confident	29 Å²	29	54.1 Å²	54.1	20%	0.203	29%	0.286	C	S	.	.			trans	-56	148.4	-175.4	59.9	0	0	0	0	113.6	E236 F237 I246 R292	E236-S240 WeakPolarHBondContact O-CB 3.31Å; E236-S240 PolarHBondContact O-N 2.83Å; E236-S240 PolarHBondContact O-OG 3.26Å; F237-S240 PolarHBondContact O-OG 2.83Å; S240-I246 WeakPolarHBondContact OG-CD1 3.47Å; S240-R292 PolarHBondContact O-NH2 3.24Å
241	D	83.1	Confident	84.6	Confident	123 Å²	123	51.7 Å²	51.7	66%	0.658	27%	0.273	S	S	*	.	S	Bend	trans	-85.1	-22.4	174.2	-67.1	-36.5	0	0	0	112.3	Y243 K296	D241-Y243 VanDerWaalsContact C-N 3.34Å; D241-Y243 WeakPolarHBondContact O-CD1 3.21Å; D241-Y243 PolarHBondContact O-N 2.88Å; D241-K296 IonicContact OD1-NZ 3.57Å; D241-K296 PolarHBondContact OD1-NZ 3.33Å; D241-K296 VanDerWaalsContact OD1-NZ 3.1Å
242	D	82.3	Confident	84.8	Confident	107 Å²	107	48.7 Å²	48.7	57%	0.572	26%	0.261	S	S	*	.			trans	-95.1	32.4	177.7	-62.2	-44.1	0	0	0	113.7	L244 E245 I246	D242-L244 PolarHBondContact O-N 3.19Å; D242-E245 PolarHBondContact O-N 3.14Å; D242-I246 PolarHBondContact O-N 2.86Å
243	Y	82.6	Confident	84.9	Confident	53 Å²	53	48.3 Å²	48.3	21%	0.208	26%	0.258	C	S	.	.	H	α-helix	trans	-52.3	-24.8	179.5	66.2	-81.3	0	0	0	115	F237 D241 L247 M289	F237-Y243 HydrophobicContact CE2-CD2 4.19Å; F237-Y243 HydrophobicContact CE2-CG 4.46Å; F237-Y243 WeakPolarHBondContact CE2-O 2.92Å; D241-Y243 VanDerWaalsContact C-N 3.34Å; D241-Y243 WeakPolarHBondContact O-CD1 3.21Å; D241-Y243 PolarHBondContact O-N 2.88Å; Y243-L247 WeakPolarHBondContact O-CB 3.18Å; Y243-L247 PolarHBondContact O-N 2.7Å; Y243-M289 HydrophobicContact CE2-CG 4.48Å; Y243-M289 HydrophobicContact CE2-SD 4.15Å
244	L	83	Confident	84.8	Confident	74 Å²	74	46.4 Å²	46.4	39%	0.387	25%	0.248	S	C	.	.	H	α-helix	trans	-70.1	-36.5	177	-70.4	173.9	0	0	0	112.2	D242 G248	D242-L244 PolarHBondContact O-N 3.19Å; L244-G248 PolarHBondContact O-N 3.03Å
245	E	79.9	Confident	84.7	Confident	125 Å²	125	47.8 Å²	47.8	58%	0.584	26%	0.255	S	S	*	.	H	α-helix	trans	-73	-41.5	177.5	-62.3	-170.6	172.3	0	0	110.2	D242 L247 G248 S249	D242-E245 PolarHBondContact O-N 3.14Å; E245-L247 VanDerWaalsContact C-N 3.33Å; E245-L247 PolarHBondContact O-N 3.17Å; E245-G248 PolarHBondContact O-N 3.46Å; E245-G248 VanDerWaalsContact O-N 3.13Å; E245-S249 PolarHBondContact O-N 3.41Å; E245-S249 PolarHBondContact O-OG 3.43Å
246	I	84.7	Confident	84.4	Confident	20 Å²	20	50.8 Å²	50.8	10%	0.103	27%	0.271	C	S	.	.	H	α-helix	trans	-57.4	-47.1	171.9	-62.7	179.7	0	0	0	110.8	V232 E236 F237 S240 D242 G248 S249 A250	V232-I246 HydrophobicContact CB-CG2 4.22Å; V232-I246 HydrophobicContact CG1-CG2 3.63Å; V232-I246 HydrophobicContact CG2-CG2 4.36Å; E236-I246 HydrophobicContact CG-CD1 4.16Å; F237-I246 HydrophobicContact CB-CG2 4.31Å; F237-I246 HydrophobicContact CD2-CG2 4.27Å; S240-I246 WeakPolarHBondContact OG-CD1 3.47Å; D242-I246 PolarHBondContact O-N 2.86Å; I246-G248 VanDerWaalsContact C-N 3.27Å; I246-G248 PolarHBondContact O-N 2.77Å; I246-S249 PolarHBondContact O-N 3.35Å; I246-S249 PolarHBondContact O-OG 3.08Å; I246-A250 WeakPolarHBondContact O-CB 3.49Å; I246-A250 PolarHBondContact O-N 3.33Å
247	L	82.5	Confident	84.1	Confident	10 Å²	10	47.7 Å²	47.7	5%	0.052	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-32	178.7	-163.6	75.4	0	0	0	112.4	F237 Y243 E245 L253 V277 I285	F237-L247 HydrophobicContact CE2-CB 4.18Å; F237-L247 HydrophobicContact CE2-CD1 3.98Å; F237-L247 HydrophobicContact CZ-CD1 4.2Å; Y243-L247 WeakPolarHBondContact O-CB 3.18Å; Y243-L247 PolarHBondContact O-N 2.7Å; E245-L247 VanDerWaalsContact C-N 3.33Å; E245-L247 PolarHBondContact O-N 3.17Å; L247-L253 HydrophobicContact CD1-CD1 4.35Å; L247-V277 HydrophobicContact CD1-CG1 3.38Å; L247-V277 HydrophobicContact CG-CG1 3.76Å; L247-I285 HydrophobicContact CD2-CG2 4.08Å
248	G	80.8	Confident	83.7	Confident	18 Å²	18	51.9 Å²	51.9	19%	0.186	29%	0.286	C	S	.	.	H	α-helix	trans	-71.8	-34.1	177.3	0	0	0	0	0	113.3	L244 E245 I246	L244-G248 PolarHBondContact O-N 3.03Å; E245-G248 PolarHBondContact O-N 3.46Å; E245-G248 VanDerWaalsContact O-N 3.13Å; I246-G248 VanDerWaalsContact C-N 3.27Å; I246-G248 PolarHBondContact O-N 2.77Å
249	S	82.3	Confident	83.2	Confident	56 Å²	56	55.9 Å²	55.9	39%	0.392	31%	0.307	S	S	.	.	H	α-helix	trans	-88.7	-33.5	-179.2	70.5	0	0	0	0	113	E245 I246	E245-S249 PolarHBondContact O-N 3.41Å; E245-S249 PolarHBondContact O-OG 3.43Å; I246-S249 PolarHBondContact O-N 3.35Å; I246-S249 PolarHBondContact O-OG 3.08Å
250	A	84	Confident	82.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.284	C	S	.	.			trans	-68.7	142.4	-178.2	0	0	0	0	0	112.4	V232 I246 L253	V232-A250 HydrophobicContact CB-CB 4.18Å; V232-A250 HydrophobicContact CG2-CB 3.81Å; I246-A250 WeakPolarHBondContact O-CB 3.49Å; I246-A250 PolarHBondContact O-N 3.33Å; A250-L253 HydrophobicContact CB-CD2 4.37Å
251	N	85.7	Confident	82.7	Confident	17 Å²	17	54.5 Å²	54.5	9%	0.091	29%	0.294	C	S	.	.	S	Bend	trans	-101.2	-37.7	167.2	-57.5	-89.3	0	0	0	110.5	F229 N230 V277 K278	F229-N251 HydrophobicContact CD1-CB 4.38Å; F229-N251 HydrophobicContact CD2-CB 3.71Å; F229-N251 HydrophobicContact CE1-CB 4.15Å; F229-N251 HydrophobicContact CE2-CB 3.44Å; F229-N251 VanDerWaalsContact CE2-CB 3.44Å; F229-N251 HydrophobicContact CG-CB 4.19Å; F229-N251 HydrophobicContact CZ-CB 3.69Å; N230-N251 PolarHBondContact N-ND2 3.14Å; N230-N251 WeakPolarHBondContact O-CB 3.5Å; N230-N251 PolarHBondContact O-N 3.08Å; N230-N251 PolarHBondContact O-ND2 2.84Å; N251-V277 PolarHBondContact O-N 3.22Å; N251-K278 WeakPolarHBondContact OD1-CD 3.43Å; N251-K278 WeakPolarHBondContact OD1-CE 3.49Å; N251-K278 PolarHBondContact OD1-NZ 2.85Å
252	E	89.3	Confident	82.5	Confident	47 Å²	47	52.7 Å²	52.7	22%	0.22	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	137.4	-179.6	179.8	174.2	-161.8	0	0	109.4	F229 K231 V232 C274	F229-E252 HydrophobicContact CE1-CB 3.79Å; F229-E252 WeakPolarHBondContact CE1-OE2 3.43Å; F229-E252 HydrophobicContact CZ-CB 3.85Å; K231-E252 WeakPolarHBondContact CA-O 3.06Å; K231-E252 VanDerWaalsContact CE-OE2 3.31Å; K231-E252 WeakPolarHBondContact CE-OE2 3.5Å; K231-E252 HydrophobicContact CG-CB 4.44Å; K231-E252 IonicContact NZ-OE2 3.42Å; K231-E252 PolarHBondContact NZ-OE2 3.06Å; V232-E252 PolarHBondContact N-O 2.85Å; E252-C274 WeakPolarHBondContact CA-O 3.47Å
253	L	87.9	Confident	82.4	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	114.7	171.1	-71	172	0	0	0	109.4	V232 F237 L247 A250 L255 C274 V277 L288	V232-L253 HydrophobicContact CB-CD2 4.18Å; V232-L253 CarbonylContact O-C 3.54Å; V232-L253 VanDerWaalsContact O-CA 3.27Å; V232-L253 WeakPolarHBondContact O-CA 3.41Å; F237-L253 HydrophobicContact CB-CD2 3.97Å; F237-L253 HydrophobicContact CD1-CD1 4.08Å; F237-L253 HydrophobicContact CE1-CD1 4.37Å; F237-L253 HydrophobicContact CG-CD1 4.25Å; F237-L253 HydrophobicContact CG-CD2 4.29Å; L247-L253 HydrophobicContact CD1-CD1 4.35Å; A250-L253 HydrophobicContact CB-CD2 4.37Å; L253-L255 PolarHBondContact O-N 3.46Å; L253-C274 HydrophobicContact CB-CB 3.94Å; L253-C274 PolarHBondContact N-O 2.81Å; L253-C274 WeakPolarHBondContact O-CB 3.37Å; L253-V277 HydrophobicContact CD1-CG2 4.03Å; L253-V277 HydrophobicContact CG-CG2 3.89Å; L253-L288 HydrophobicContact CD1-CD2 4.39Å
254	I	88	Confident	82.4	Confident	42 Å²	42	52 Å²	52	22%	0.215	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	121.2	-178.6	-60.7	176.6	0	0	0	109.2	K231 V232 A234 D256	K231-I254 HydrophobicContact CB-CD1 3.82Å; K231-I254 HydrophobicContact CB-CG1 4.24Å; K231-I254 HydrophobicContact CD-CD1 4.03Å; V232-I254 PolarHBondContact O-N 2.95Å; A234-I254 WeakPolarHBondContact CB-O 3.41Å; A234-I254 PolarHBondContact N-O 3.08Å; I254-D256 HydrophobicContact CG2-CB 4.1Å; I254-D256 VanDerWaalsContact CG2-OD1 3.23Å; I254-D256 WeakPolarHBondContact CG2-OD1 3.42Å; I254-D256 WeakPolarHBondContact CG2-OD2 3.49Å
255	L	83.2	Confident	82.4	Confident	29 Å²	29	49.2 Å²	49.2	15%	0.152	29%	0.289	C	S	.	.			trans	-100.4	65.6	-180	-70.4	169.2	0	0	0	110.6	A234 L253 L261 K271 C274 W291	A234-L255 HydrophobicContact CB-CD2 3.5Å; A234-L255 VanDerWaalsContact CB-CD2 3.5Å; A234-L255 HydrophobicContact CB-CG 4.25Å; L253-L255 PolarHBondContact O-N 3.46Å; L255-L261 WeakPolarHBondContact O-CD1 3.38Å; L255-K271 HydrophobicContact CD1-CB 4.36Å; L255-K271 HydrophobicContact CD1-CG 4.02Å; L255-C274 HydrophobicContact CD1-CB 3.88Å; L255-C274 HydrophobicContact CG-CB 4.23Å; L255-W291 HydrophobicContact CD2-CH2 3.67Å; L255-W291 HydrophobicContact CD2-CZ2 3.87Å
256	D	80.5	Confident	82.6	Confident	123 Å²	123	43.8 Å²	43.8	66%	0.658	26%	0.264	S	S	*	.			trans	-90.4	-24.8	-178.3	-73.8	-7.6	0	0	0	113	I254	I254-D256 HydrophobicContact CG2-CB 4.1Å; I254-D256 VanDerWaalsContact CG2-OD1 3.23Å; I254-D256 WeakPolarHBondContact CG2-OD1 3.42Å; I254-D256 WeakPolarHBondContact CG2-OD2 3.49Å
257	D	80.9	Confident	82.7	Confident	45 Å²	45	47 Å²	47	24%	0.241	28%	0.282	C	S	.	.			trans	-68.1	123.3	-173.7	-82	-75.9	0	0	0	113.7	L235 N259 L260 L261	L235-D257 WeakPolarHBondContact CB-OD2 3.29Å; D257-N259 PolarHBondContact O-N 3.3Å; D257-L260 HydrophobicContact CB-CB 4.27Å; D257-L260 HydrophobicContact CB-CD1 3.98Å; D257-L260 HydrophobicContact CB-CG 3.83Å; D257-L260 PolarHBondContact O-N 2.81Å; D257-L261 PolarHBondContact O-N 3.5Å; D257-L261 VanDerWaalsContact O-N 3.1Å
258	P	79.1	Confident	82.8	Confident	89 Å²	89	52.4 Å²	52.4	58%	0.578	31%	0.311	S	S	*	.	H	α-helix	trans	-62.8	-31.3	-179.1	23.2	-32	0	0	0	112.2	L260 L261 A262	P258-L260 PolarHBondContact O-N 3.37Å; P258-L261 PolarHBondContact O-N 3.27Å; P258-A262 VanDerWaalsContact O-CB 3.32Å; P258-A262 WeakPolarHBondContact O-CB 3.33Å; P258-A262 PolarHBondContact O-N 3.26Å
259	N	78.5	Confident	83.1	Confident	84 Å²	84	57 Å²	57	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-63.8	-30.3	175.3	-66.1	-38.9	0	0	0	112.6	D257 L299	D257-N259 PolarHBondContact O-N 3.3Å; N259-L299 HydrophobicContact CB-CD2 4.34Å
260	L	78.9	Confident	83.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-81.7	-40.1	177.6	-58.1	-178.3	0	0	0	111.4	A234 L235 D257 P258 T266 M295 L299	A234-L260 HydrophobicContact CB-CD1 3.97Å; L235-L260 HydrophobicContact CB-CD1 4.42Å; D257-L260 HydrophobicContact CB-CB 4.27Å; D257-L260 HydrophobicContact CB-CD1 3.98Å; D257-L260 HydrophobicContact CB-CG 3.83Å; D257-L260 PolarHBondContact O-N 2.81Å; P258-L260 PolarHBondContact O-N 3.37Å; L260-T266 WeakPolarHBondContact O-CB 3.35Å; L260-T266 PolarHBondContact O-OG1 3.35Å; L260-M295 HydrophobicContact CB-CE 3.91Å; L260-M295 HydrophobicContact CD2-CB 4.14Å; L260-M295 HydrophobicContact CD2-CE 3.32Å; L260-M295 HydrophobicContact CD2-CG 4.33Å; L260-M295 HydrophobicContact CG-CE 4.2Å; L260-L299 HydrophobicContact CD2-CD1 4.45Å
261	L	80.4	Confident	83.5	Confident	78 Å²	78	58.2 Å²	58.2	41%	0.408	33%	0.326	S	S	.	.	H	α-helix	trans	-67.5	-34.8	179.1	-78.9	149.3	0	0	0	113.4	L255 D257 P258 H263	L255-L261 WeakPolarHBondContact O-CD1 3.38Å; D257-L261 PolarHBondContact O-N 3.5Å; D257-L261 VanDerWaalsContact O-N 3.1Å; P258-L261 PolarHBondContact O-N 3.27Å; L261-H263 VanDerWaalsContact C-N 3.29Å; L261-H263 PolarHBondContact O-N 2.91Å
262	A	78.4	Confident	83.5	Confident	85 Å²	85	61.1 Å²	61.1	70%	0.702	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-17	-178.6	0	0	0	0	0	113.9	P258	P258-A262 VanDerWaalsContact O-CB 3.32Å; P258-A262 WeakPolarHBondContact O-CB 3.33Å; P258-A262 PolarHBondContact O-N 3.26Å
263	H	80.1	Confident	83.5	Confident	34 Å²	34	59.9 Å²	59.9	16%	0.157	34%	0.339	C	S	.	.	S	Bend	trans	-79.1	133.5	-175.2	-171	-93	0	0	0	111.3	L261 A265 T266 M295 H298	L261-H263 VanDerWaalsContact C-N 3.29Å; L261-H263 PolarHBondContact O-N 2.91Å; H263-A265 VanDerWaalsContact CE1-CB 3.41Å; H263-A265 WeakPolarHBondContact CE1-CB 3.27Å; H263-A265 VanDerWaalsContact ND1-CB 3.29Å; H263-A265 WeakPolarHBondContact ND1-CB 3.32Å; H263-A265 PolarHBondContact ND1-N 3.29Å; H263-A265 VanDerWaalsContact ND1-N 3.15Å; H263-A265 PolarHBondContact O-N 3.46Å; H263-A265 VanDerWaalsContact O-N 3.09Å; H263-T266 WeakPolarHBondContact O-CB 3.14Å; H263-T266 PolarHBondContact O-N 3.15Å; H263-M295 HydrophobicContact CB-CE 3.58Å; H263-M295 HydrophobicContact CB-SD 3.82Å; H263-M295 PolarHBondContact ND1-SD 3.23Å; H263-M295 VanDerWaalsContact ND1-SD 3.45Å; H263-H298 AromaticContact CD2-CE1 3.88Å; H263-H298 AromaticContact CD2-CG 3.54Å; H263-H298 AromaticContact CD2-ND1 3.43Å; H263-H298 PolarHBondContact CD2-ND1 3.13Å
264	P	81.7	Confident	83.4	Confident	111 Å²	111	59.8 Å²	59.8	72%	0.721	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.5	-174.7	25.3	-35.6	0	0	0	114.2	T266	P264-T266 VanDerWaalsContact C-N 3.28Å
265	A	82.8	Confident	83.4	Confident	16 Å²	16	64.4 Å²	64.4	13%	0.132	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-7.6	175.1	0	0	0	0	0	113.9	H263 D267	H263-A265 VanDerWaalsContact CE1-CB 3.41Å; H263-A265 WeakPolarHBondContact CE1-CB 3.27Å; H263-A265 VanDerWaalsContact ND1-CB 3.29Å; H263-A265 WeakPolarHBondContact ND1-CB 3.32Å; H263-A265 PolarHBondContact ND1-N 3.29Å; H263-A265 VanDerWaalsContact ND1-N 3.15Å; H263-A265 PolarHBondContact O-N 3.46Å; H263-A265 VanDerWaalsContact O-N 3.09Å; A265-D267 PolarHBondContact O-N 3.31Å
266	T	84.7	Confident	83.5	Confident	11 Å²	11	66.8 Å²	66.8	7%	0.067	37%	0.37	C	S	.	.			trans	-83.8	65.3	174.8	-53.3	0	0	0	0	109.1	L260 H263 P264 K271 W291	L260-T266 WeakPolarHBondContact O-CB 3.35Å; L260-T266 PolarHBondContact O-OG1 3.35Å; H263-T266 WeakPolarHBondContact O-CB 3.14Å; H263-T266 PolarHBondContact O-N 3.15Å; P264-T266 VanDerWaalsContact C-N 3.28Å; T266-K271 HydrophobicContact CG2-CG 4.41Å; T266-W291 PolarHBondContact OG1-NE1 3.44Å; T266-W291 VanDerWaalsContact OG1-NE1 3.08Å
267	D	86.2	Confident	83.7	Confident	88 Å²	88	61.3 Å²	61.3	47%	0.471	34%	0.341	S	S	.	.			trans	-62.6	161.2	179.1	-64.1	-42.7	0	0	0	111.4	A265 E269 V270 K271	A265-D267 PolarHBondContact O-N 3.31Å; D267-E269 HydrophobicContact CB-CB 4.49Å; D267-E269 PolarHBondContact O-N 3.14Å; D267-V270 PolarHBondContact O-N 3.31Å; D267-K271 PolarHBondContact O-N 3.35Å; D267-K271 VanDerWaalsContact O-N 3.15Å
268	D	86.4	Confident	83.7	Confident	124 Å²	124	64.6 Å²	64.6	66%	0.663	35%	0.353	S	S	*	.	H	α-helix	trans	-58.5	-30.9	174.2	-162	36.4	0	0	0	111.6	K271 T272	D268-K271 WeakPolarHBondContact O-CB 3.3Å; D268-K271 PolarHBondContact O-N 3.2Å; D268-T272 WeakPolarHBondContact O-CG2 3.16Å; D268-T272 PolarHBondContact O-N 3.05Å
269	E	85.7	Confident	83.8	Confident	115 Å²	115	65.7 Å²	65.7	54%	0.537	36%	0.358	S	S	.	.	H	α-helix	trans	-57.6	-51.8	170.7	-65.4	-169.3	173.6	0	0	111.5	D267 K271 T272 L273 Q287	D267-E269 HydrophobicContact CB-CB 4.49Å; D267-E269 PolarHBondContact O-N 3.14Å; E269-K271 VanDerWaalsContact C-N 3.25Å; E269-K271 PolarHBondContact O-N 3.41Å; E269-T272 WeakPolarHBondContact O-CA 3.15Å; E269-T272 PolarHBondContact O-N 3.15Å; E269-T272 PolarHBondContact O-OG1 3.43Å; E269-L273 WeakPolarHBondContact O-CG 3.41Å; E269-L273 PolarHBondContact O-N 2.91Å; E269-Q287 PolarHBondContact OE2-NE2 2.91Å
270	V	87.1	Confident	84.1	Confident	3 Å²	3	63 Å²	63	2%	0.018	34%	0.343	C	S	.	.	H	α-helix	trans	-60.1	-40	-179.4	-179.7	0	0	0	0	110.6	D267 T272 L273 C274 W291	D267-V270 PolarHBondContact O-N 3.31Å; V270-T272 VanDerWaalsContact C-N 3.3Å; V270-T272 PolarHBondContact O-N 3.04Å; V270-L273 PolarHBondContact O-N 3.3Å; V270-L273 VanDerWaalsContact O-N 3.14Å; V270-C274 PolarHBondContact O-N 2.65Å; V270-C274 PolarHBondContact O-SG 2.67Å; V270-C274 VanDerWaalsContact O-SG 3.37Å; V270-W291 HydrophobicContact CG1-CD2 3.66Å; V270-W291 HydrophobicContact CG1-CE3 4.12Å; V270-W291 HydrophobicContact CG1-CG 3.86Å; V270-W291 HydrophobicContact CG1-CZ2 4.27Å; V270-W291 HydrophobicContact CG2-CB 4.46Å; V270-W291 HydrophobicContact CG2-CG 4.26Å
271	K	87.6	Confident	84.3	Confident	78 Å²	78	64.5 Å²	64.5	34%	0.339	36%	0.359	S	S	.	.	H	α-helix	trans	-59.9	-40.1	174.6	-64	179.7	-175.8	177.8	0	111.9	L255 T266 D267 D268 E269	L255-K271 HydrophobicContact CD1-CB 4.36Å; L255-K271 HydrophobicContact CD1-CG 4.02Å; T266-K271 HydrophobicContact CG2-CG 4.41Å; D267-K271 PolarHBondContact O-N 3.35Å; D267-K271 VanDerWaalsContact O-N 3.15Å; D268-K271 WeakPolarHBondContact O-CB 3.3Å; D268-K271 PolarHBondContact O-N 3.2Å; E269-K271 VanDerWaalsContact C-N 3.25Å; E269-K271 PolarHBondContact O-N 3.41Å
272	T	87	Confident	84.2	Confident	77 Å²	77	67.8 Å²	67.8	47%	0.472	37%	0.366	S	S	.	.	H	α-helix	trans	-68.6	-36.4	174.5	63.7	0	0	0	0	112.9	D268 E269 V270 C274 K275	D268-T272 WeakPolarHBondContact O-CG2 3.16Å; D268-T272 PolarHBondContact O-N 3.05Å; E269-T272 WeakPolarHBondContact O-CA 3.15Å; E269-T272 PolarHBondContact O-N 3.15Å; E269-T272 PolarHBondContact O-OG1 3.43Å; V270-T272 VanDerWaalsContact C-N 3.3Å; V270-T272 PolarHBondContact O-N 3.04Å; T272-C274 VanDerWaalsContact C-N 3.32Å; T272-C274 PolarHBondContact O-N 3.17Å; T272-K275 PolarHBondContact O-N 3.15Å
273	L	88.3	Confident	84.5	Confident	21 Å²	21	71 Å²	71	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-67.5	-32.5	178.4	-59.2	-177.3	0	0	0	112.5	E269 V270 K275 L280 E284 Q287 L288	E269-L273 WeakPolarHBondContact O-CG 3.41Å; E269-L273 PolarHBondContact O-N 2.91Å; V270-L273 PolarHBondContact O-N 3.3Å; V270-L273 VanDerWaalsContact O-N 3.14Å; L273-K275 VanDerWaalsContact C-N 3.3Å; L273-K275 PolarHBondContact O-N 3.26Å; L273-L280 HydrophobicContact CB-CD2 3.94Å; L273-L280 HydrophobicContact CD2-CD2 3.66Å; L273-L280 HydrophobicContact CG-CD2 4.32Å; L273-E284 HydrophobicContact CD1-CB 4.37Å; L273-E284 HydrophobicContact CD2-CB 4.05Å; L273-E284 HydrophobicContact CD2-CG 4.08Å; L273-Q287 HydrophobicContact CD1-CB 4.35Å; L273-Q287 HydrophobicContact CD1-CG 4.21Å; L273-L288 HydrophobicContact CB-CD1 3.97Å; L273-L288 HydrophobicContact CB-CG 4.38Å; L273-L288 HydrophobicContact CD1-CD1 4.42Å; L273-L288 HydrophobicContact CD1-CG 4.4Å
274	C	86.8	Confident	84.8	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.014	37%	0.371	C	S	.	.	H	α-helix	trans	-71.4	-20.9	179.2	-71.7	0	0	0	0	113.7	E252 L253 L255 V270 T272	E252-C274 WeakPolarHBondContact CA-O 3.47Å; L253-C274 HydrophobicContact CB-CB 3.94Å; L253-C274 PolarHBondContact N-O 2.81Å; L253-C274 WeakPolarHBondContact O-CB 3.37Å; L255-C274 HydrophobicContact CD1-CB 3.88Å; L255-C274 HydrophobicContact CG-CB 4.23Å; V270-C274 PolarHBondContact O-N 2.65Å; V270-C274 PolarHBondContact O-SG 2.67Å; V270-C274 VanDerWaalsContact O-SG 3.37Å; T272-C274 VanDerWaalsContact C-N 3.32Å; T272-C274 PolarHBondContact O-N 3.17Å
275	K	87.8	Confident	85	Confident	140 Å²	140	68.2 Å²	68.2	61%	0.609	34%	0.342	S	S	*	.	H	α-helix	trans	-70.8	-36.6	-178	-69.3	-179.4	-179.6	-179.6	0	113.7	T272 L273	T272-K275 PolarHBondContact O-N 3.15Å; L273-K275 VanDerWaalsContact C-N 3.3Å; L273-K275 PolarHBondContact O-N 3.26Å
276	D	84	Confident	85.1	Confident	78 Å²	78	73.1 Å²	73.1	42%	0.417	36%	0.357	S	S	.	.			trans	-139.3	83	-178.9	-165.1	-16.3	0	0	0	111.3	K278 V279 L280	D276-K278 VanDerWaalsContact C-N 3.27Å; D276-K278 PolarHBondContact O-N 2.74Å; D276-K278 PolarHBondContact OD1-N 3.19Å; D276-V279 VanDerWaalsContact CG-CG2 3.47Å; D276-V279 PolarHBondContact O-N 3.09Å; D276-V279 WeakPolarHBondContact OD1-CG2 3.35Å; D276-V279 PolarHBondContact OD1-N 3.49Å; D276-V279 WeakPolarHBondContact OD2-CG2 3.4Å; D276-L280 WeakPolarHBondContact O-CG 3.48Å
277	V	85.4	Confident	85.3	Confident	8 Å²	8	75.6 Å²	75.6	5%	0.048	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-65	-31.5	-175.9	173.5	0	0	0	0	112	L247 N251 L253 V279 L280	L247-V277 HydrophobicContact CD1-CG1 3.38Å; L247-V277 HydrophobicContact CG-CG1 3.76Å; N251-V277 PolarHBondContact O-N 3.22Å; L253-V277 HydrophobicContact CD1-CG2 4.03Å; L253-V277 HydrophobicContact CG-CG2 3.89Å; V277-V279 VanDerWaalsContact C-N 3.32Å; V277-V279 PolarHBondContact O-N 2.93Å; V277-L280 HydrophobicContact CB-CD1 4.31Å; V277-L280 HydrophobicContact CG1-CD1 4.2Å; V277-L280 WeakPolarHBondContact O-CB 2.92Å; V277-L280 WeakPolarHBondContact O-CD1 3.18Å; V277-L280 VanDerWaalsContact O-CG 3.23Å; V277-L280 WeakPolarHBondContact O-CG 3.42Å; V277-L280 PolarHBondContact O-N 3.24Å
278	K	81.1	Confident	85.3	Confident	114 Å²	114	71.4 Å²	71.4	50%	0.496	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-77.7	-18.1	-174.3	-71.1	-169.9	178.7	167.7	0	113.5	N251 D276	N251-K278 WeakPolarHBondContact OD1-CD 3.43Å; N251-K278 WeakPolarHBondContact OD1-CE 3.49Å; N251-K278 PolarHBondContact OD1-NZ 2.85Å; D276-K278 VanDerWaalsContact C-N 3.27Å; D276-K278 PolarHBondContact O-N 2.74Å; D276-K278 PolarHBondContact OD1-N 3.19Å
279	V	82.1	Confident	85.4	Confident	112 Å²	112	67.1 Å²	67.1	68%	0.679	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-88.8	-8.4	176.8	176.1	0	0	0	0	112.2	D276 V277	D276-V279 VanDerWaalsContact CG-CG2 3.47Å; D276-V279 PolarHBondContact O-N 3.09Å; D276-V279 WeakPolarHBondContact OD1-CG2 3.35Å; D276-V279 PolarHBondContact OD1-N 3.49Å; D276-V279 WeakPolarHBondContact OD2-CG2 3.4Å; V277-V279 VanDerWaalsContact C-N 3.32Å; V277-V279 PolarHBondContact O-N 2.93Å
280	L	84.2	Confident	85.5	Confident	27 Å²	27	68.2 Å²	68.2	14%	0.141	33%	0.325	C	S	.	.			trans	-65	135.8	-177.1	-59.2	177.2	0	0	0	113.3	L273 D276 V277 E284 I285 L288	L273-L280 HydrophobicContact CB-CD2 3.94Å; L273-L280 HydrophobicContact CD2-CD2 3.66Å; L273-L280 HydrophobicContact CG-CD2 4.32Å; D276-L280 WeakPolarHBondContact O-CG 3.48Å; V277-L280 HydrophobicContact CB-CD1 4.31Å; V277-L280 HydrophobicContact CG1-CD1 4.2Å; V277-L280 WeakPolarHBondContact O-CB 2.92Å; V277-L280 WeakPolarHBondContact O-CD1 3.18Å; V277-L280 VanDerWaalsContact O-CG 3.23Å; V277-L280 WeakPolarHBondContact O-CG 3.42Å; V277-L280 PolarHBondContact O-N 3.24Å; L280-E284 HydrophobicContact CB-CB 4.18Å; L280-E284 HydrophobicContact CD2-CB 3.99Å; L280-I285 HydrophobicContact CB-CG1 3.95Å; L280-L288 HydrophobicContact CD1-CD1 3.21Å
281	G	82.5	Confident	85.7	Confident	32 Å²	32	68.2 Å²	68.2	33%	0.33	32%	0.324	S	S	.	.			trans	-86.8	-179.7	171.2	0	0	0	0	0	113.4	K283 E284 I285	G281-K283 VanDerWaalsContact C-N 3.26Å; G281-K283 PolarHBondContact O-N 3.39Å; G281-E284 WeakPolarHBondContact CA-OE2 3.37Å; G281-E284 PolarHBondContact N-OE2 2.96Å; G281-E284 PolarHBondContact O-N 2.91Å; G281-E284 VanDerWaalsContact O-OE2 3.05Å; G281-I285 VanDerWaalsContact O-CG1 3.3Å; G281-I285 WeakPolarHBondContact O-CG1 3.42Å; G281-I285 PolarHBondContact O-N 3.45Å
282	R	78.7	Confident	85.7	Confident	148 Å²	148	65.4 Å²	65.4	56%	0.558	31%	0.312	S	S	*	.	H	α-helix	trans	-63.7	-27.9	-178.1	-176.8	178	177.6	-168.3	2.8	113.6	R286	R282-R286 WeakPolarHBondContact O-CG 3.31Å; R282-R286 PolarHBondContact O-N 3.23Å; R282-R286 PolarHBondContact O-NE 3.34Å
283	K	84.7	Confident	85.7	Confident	153 Å²	153	69.7 Å²	69.7	67%	0.665	32%	0.319	S	S	*	.	H	α-helix	trans	-77.1	-42	-179.6	-71.3	-177.7	179.5	180	0	109.7	G281 R286 Q287	G281-K283 VanDerWaalsContact C-N 3.26Å; G281-K283 PolarHBondContact O-N 3.39Å; K283-R286 WeakPolarHBondContact O-CB 3.26Å; K283-R286 PolarHBondContact O-N 3.44Å; K283-Q287 PolarHBondContact O-N 3.39Å
284	E	85.3	Confident	85.8	Confident	66 Å²	66	72.1 Å²	72.1	31%	0.308	33%	0.33	S	S	.	.	H	α-helix	trans	-68.7	-44.9	-178.1	-57.4	73.4	-163	0	0	110.5	L273 L280 G281 R286 Q287 L288	L273-E284 HydrophobicContact CD1-CB 4.37Å; L273-E284 HydrophobicContact CD2-CB 4.05Å; L273-E284 HydrophobicContact CD2-CG 4.08Å; L280-E284 HydrophobicContact CB-CB 4.18Å; L280-E284 HydrophobicContact CD2-CB 3.99Å; G281-E284 WeakPolarHBondContact CA-OE2 3.37Å; G281-E284 PolarHBondContact N-OE2 2.96Å; G281-E284 PolarHBondContact O-N 2.91Å; G281-E284 VanDerWaalsContact O-OE2 3.05Å; E284-R286 VanDerWaalsContact C-N 3.28Å; E284-R286 PolarHBondContact O-N 2.93Å; E284-Q287 WeakPolarHBondContact O-CA 3.32Å; E284-Q287 WeakPolarHBondContact O-CB 3.49Å; E284-Q287 PolarHBondContact O-N 2.73Å; E284-L288 PolarHBondContact O-N 2.71Å
285	I	85.8	Confident	85.7	Confident	19 Å²	19	72 Å²	72	10%	0.097	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-39.4	172.9	-67.1	168.9	0	0	0	111	L247 L280 G281 Q287 L288 M289	L247-I285 HydrophobicContact CD2-CG2 4.08Å; L280-I285 HydrophobicContact CB-CG1 3.95Å; G281-I285 VanDerWaalsContact O-CG1 3.3Å; G281-I285 WeakPolarHBondContact O-CG1 3.42Å; G281-I285 PolarHBondContact O-N 3.45Å; I285-Q287 VanDerWaalsContact C-N 3.34Å; I285-L288 PolarHBondContact O-N 3.33Å; I285-M289 HydrophobicContact CG2-CE 4.37Å; I285-M289 WeakPolarHBondContact O-CG 3.48Å; I285-M289 PolarHBondContact O-N 2.81Å
286	R	86.4	Confident	85.6	Confident	119 Å²	119	69.2 Å²	69.2	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-67.7	-34.5	175.9	-78.3	-175.6	-71.1	-178.8	1.6	112.4	R282 K283 E284 M289 K290	R282-R286 WeakPolarHBondContact O-CG 3.31Å; R282-R286 PolarHBondContact O-N 3.23Å; R282-R286 PolarHBondContact O-NE 3.34Å; K283-R286 WeakPolarHBondContact O-CB 3.26Å; K283-R286 PolarHBondContact O-N 3.44Å; E284-R286 VanDerWaalsContact C-N 3.28Å; E284-R286 PolarHBondContact O-N 2.93Å; R286-M289 HydrophobicContact CG-CE 4.08Å; R286-M289 PolarHBondContact O-N 3.19Å; R286-K290 PolarHBondContact O-N 3.41Å
287	Q	87.8	Confident	85.7	Confident	63 Å²	63	72.1 Å²	72.1	29%	0.294	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-47.3	174	-175.9	173.2	0.2	0	0	110.9	E269 L273 K283 E284 I285 M289 K290 W291	E269-Q287 PolarHBondContact OE2-NE2 2.91Å; L273-Q287 HydrophobicContact CD1-CB 4.35Å; L273-Q287 HydrophobicContact CD1-CG 4.21Å; K283-Q287 PolarHBondContact O-N 3.39Å; E284-Q287 WeakPolarHBondContact O-CA 3.32Å; E284-Q287 WeakPolarHBondContact O-CB 3.49Å; E284-Q287 PolarHBondContact O-N 2.73Å; I285-Q287 VanDerWaalsContact C-N 3.34Å; Q287-M289 VanDerWaalsContact C-N 3.32Å; Q287-M289 PolarHBondContact O-N 2.64Å; Q287-K290 WeakPolarHBondContact O-CB 3.33Å; Q287-K290 PolarHBondContact O-N 3.42Å; Q287-K290 VanDerWaalsContact O-N 3.08Å; Q287-W291 PolarHBondContact O-N 3.32Å
288	L	86.6	Confident	85.5	Confident	1 Å²	1	74.4 Å²	74.4	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-57.6	-41.6	173.1	-93.8	151.6	0	0	0	112.6	F237 L253 L273 L280 E284 I285 K290 W291 R292	F237-L288 HydrophobicContact CE1-CD2 4.47Å; L253-L288 HydrophobicContact CD1-CD2 4.39Å; L273-L288 HydrophobicContact CB-CD1 3.97Å; L273-L288 HydrophobicContact CB-CG 4.38Å; L273-L288 HydrophobicContact CD1-CD1 4.42Å; L273-L288 HydrophobicContact CD1-CG 4.4Å; L280-L288 HydrophobicContact CD1-CD1 3.21Å; E284-L288 PolarHBondContact O-N 2.71Å; I285-L288 PolarHBondContact O-N 3.33Å; L288-K290 VanDerWaalsContact C-N 3.35Å; L288-K290 PolarHBondContact O-N 2.82Å; L288-W291 HydrophobicContact CD2-CE3 4.04Å; L288-W291 HydrophobicContact CD2-CZ3 4.25Å; L288-W291 PolarHBondContact O-N 2.98Å; L288-R292 WeakPolarHBondContact O-CB 3.02Å; L288-R292 PolarHBondContact O-N 2.99Å
289	M	88.4	Confident	85.7	Confident	34 Å²	34	70.3 Å²	70.3	17%	0.167	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-36.9	175	-74.2	-160.9	-72.8	0	0	112.9	Y243 I285 R286 Q287 R293	Y243-M289 HydrophobicContact CE2-CG 4.48Å; Y243-M289 HydrophobicContact CE2-SD 4.15Å; I285-M289 HydrophobicContact CG2-CE 4.37Å; I285-M289 WeakPolarHBondContact O-CG 3.48Å; I285-M289 PolarHBondContact O-N 2.81Å; R286-M289 HydrophobicContact CG-CE 4.08Å; R286-M289 PolarHBondContact O-N 3.19Å; Q287-M289 VanDerWaalsContact C-N 3.32Å; Q287-M289 PolarHBondContact O-N 2.64Å; M289-R293 WeakPolarHBondContact O-CG 3.47Å; M289-R293 PolarHBondContact O-N 2.68Å
290	K	88.9	Confident	85.7	Confident	137 Å²	137	70.8 Å²	70.8	60%	0.596	31%	0.314	S	S	*	.	H	α-helix	trans	-66.9	-45.9	175.7	-174.5	-174.9	176.1	-169.9	0	110.7	R286 Q287 L288 R293 Q294	R286-K290 PolarHBondContact O-N 3.41Å; Q287-K290 WeakPolarHBondContact O-CB 3.33Å; Q287-K290 PolarHBondContact O-N 3.42Å; Q287-K290 VanDerWaalsContact O-N 3.08Å; L288-K290 VanDerWaalsContact C-N 3.35Å; L288-K290 PolarHBondContact O-N 2.82Å; K290-R293 PolarHBondContact O-N 3.24Å; K290-Q294 PolarHBondContact O-N 2.96Å
291	W	89.9	Confident	85.6	Confident	4 Å²	4	73 Å²	73	2%	0.015	33%	0.332	C	S	.	.	H	α-helix	trans	-58.1	-51.9	175.2	170.5	76.7	0	0	0	111.1	A234 F237 V238 L255 T266 V270 Q287 L288 R293 Q294 M295	A234-W291 HydrophobicContact CB-CH2 4.34Å; F237-W291 HydrophobicContact CD1-CZ3 4.33Å; F237-W291 HydrophobicContact CE1-CZ3 4.34Å; V238-W291 HydrophobicContact CG2-CH2 4.15Å; V238-W291 HydrophobicContact CG2-CZ3 4.12Å; L255-W291 HydrophobicContact CD2-CH2 3.67Å; L255-W291 HydrophobicContact CD2-CZ2 3.87Å; T266-W291 PolarHBondContact OG1-NE1 3.44Å; T266-W291 VanDerWaalsContact OG1-NE1 3.08Å; V270-W291 HydrophobicContact CG1-CD2 3.66Å; V270-W291 HydrophobicContact CG1-CE3 4.12Å; V270-W291 HydrophobicContact CG1-CG 3.86Å; V270-W291 HydrophobicContact CG1-CZ2 4.27Å; V270-W291 HydrophobicContact CG2-CB 4.46Å; V270-W291 HydrophobicContact CG2-CG 4.26Å; Q287-W291 PolarHBondContact O-N 3.32Å; L288-W291 HydrophobicContact CD2-CE3 4.04Å; L288-W291 HydrophobicContact CD2-CZ3 4.25Å; L288-W291 PolarHBondContact O-N 2.98Å; W291-R293 VanDerWaalsContact C-N 3.27Å; W291-R293 PolarHBondContact O-N 3.45Å; W291-Q294 WeakPolarHBondContact O-CA 3.46Å; W291-Q294 WeakPolarHBondContact O-CB 3.22Å; W291-Q294 PolarHBondContact O-N 3.25Å; W291-M295 HydrophobicContact CD2-CG 3.98Å; W291-M295 HydrophobicContact CG-CG 4.23Å; W291-M295 HydrophobicContact CZ2-CG 3.91Å; W291-M295 WeakPolarHBondContact O-CG 3.47Å; W291-M295 PolarHBondContact O-N 2.93Å
292	R	88.4	Confident	85.3	Confident	19 Å²	19	76.4 Å²	76.4	7%	0.072	34%	0.342	C	S	.	.	H	α-helix	trans	-51.8	-43.5	176	170.3	168.5	174.1	-93.4	-3.6	112.8	F237 V238 S240 L288 Q294 M295 K296	F237-R292 HydrophobicContact CE1-CB 4.03Å; F237-R292 HydrophobicContact CE1-CG 4.39Å; F237-R292 WeakPolarHBondContact O-CD 3.18Å; F237-R292 PolarHBondContact O-NE 3.43Å; V238-R292 HydrophobicContact CG2-CG 4.38Å; V238-R292 PolarHBondContact O-NE 2.98Å; S240-R292 PolarHBondContact O-NH2 3.24Å; L288-R292 WeakPolarHBondContact O-CB 3.02Å; L288-R292 PolarHBondContact O-N 2.99Å; R292-Q294 VanDerWaalsContact C-N 3.33Å; R292-Q294 PolarHBondContact O-N 3.27Å; R292-M295 PolarHBondContact O-N 3.33Å; R292-K296 WeakPolarHBondContact O-CB 3.11Å; R292-K296 PolarHBondContact O-N 2.87Å
293	R	87.9	Confident	85	Confident	166 Å²	166	77 Å²	77	63%	0.626	35%	0.351	S	S	*	.	H	α-helix	trans	-62.5	-39.4	177.4	-74.1	175.4	-173.6	-178.4	2.1	112.3	M289 K290 W291 Q297	M289-R293 WeakPolarHBondContact O-CG 3.47Å; M289-R293 PolarHBondContact O-N 2.68Å; K290-R293 PolarHBondContact O-N 3.24Å; W291-R293 VanDerWaalsContact C-N 3.27Å; W291-R293 PolarHBondContact O-N 3.45Å; R293-Q297 VanDerWaalsContact O-CG 3.25Å; R293-Q297 WeakPolarHBondContact O-CG 3.37Å; R293-Q297 PolarHBondContact O-N 2.72Å
294	Q	88.7	Confident	84.1	Confident	72 Å²	72	72.1 Å²	72.1	34%	0.336	33%	0.331	S	S	.	.	H	α-helix	trans	-67.6	-43.7	176.3	-67.9	171.5	-36.9	0	0	110.9	K290 W291 R292 Q297 H298	K290-Q294 PolarHBondContact O-N 2.96Å; W291-Q294 WeakPolarHBondContact O-CA 3.46Å; W291-Q294 WeakPolarHBondContact O-CB 3.22Å; W291-Q294 PolarHBondContact O-N 3.25Å; R292-Q294 VanDerWaalsContact C-N 3.33Å; R292-Q294 PolarHBondContact O-N 3.27Å; Q294-Q297 WeakPolarHBondContact O-CB 3.49Å; Q294-Q297 PolarHBondContact O-N 2.71Å; Q294-H298 PolarHBondContact O-N 3.35Å
295	M	85.1	Confident	82.9	Confident	0 Å²	0	77 Å²	77	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65	-43.1	178.9	-59.1	-46.2	-73.4	0	0	112.5	V238 L260 H263 W291 R292 Q297 H298 L299	V238-M295 HydrophobicContact CG1-CB 3.82Å; V238-M295 HydrophobicContact CG2-CB 4.18Å; L260-M295 HydrophobicContact CB-CE 3.91Å; L260-M295 HydrophobicContact CD2-CB 4.14Å; L260-M295 HydrophobicContact CD2-CE 3.32Å; L260-M295 HydrophobicContact CD2-CG 4.33Å; L260-M295 HydrophobicContact CG-CE 4.2Å; H263-M295 HydrophobicContact CB-CE 3.58Å; H263-M295 HydrophobicContact CB-SD 3.82Å; H263-M295 PolarHBondContact ND1-SD 3.23Å; H263-M295 VanDerWaalsContact ND1-SD 3.45Å; W291-M295 HydrophobicContact CD2-CG 3.98Å; W291-M295 HydrophobicContact CG-CG 4.23Å; W291-M295 HydrophobicContact CZ2-CG 3.91Å; W291-M295 WeakPolarHBondContact O-CG 3.47Å; W291-M295 PolarHBondContact O-N 2.93Å; R292-M295 PolarHBondContact O-N 3.33Å; M295-Q297 VanDerWaalsContact C-N 3.28Å; M295-Q297 PolarHBondContact O-N 3.29Å; M295-H298 PolarHBondContact O-N 3.06Å; M295-L299 WeakPolarHBondContact O-CB 3.32Å; M295-L299 WeakPolarHBondContact O-CG 3.47Å; M295-L299 PolarHBondContact O-N 3.33Å
296	K	85.9	Confident	81.4	Confident	81 Å²	81	81 Å²	81	35%	0.352	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-35.9	175.2	-168.4	164.7	-177.4	158	0	111.5	V238 T239 D241 R292 K300	V238-K296 HydrophobicContact CG1-CB 4.14Å; T239-K296 PolarHBondContact O-NZ 3.16Å; T239-K296 VanDerWaalsContact O-NZ 3.08Å; D241-K296 IonicContact OD1-NZ 3.57Å; D241-K296 PolarHBondContact OD1-NZ 3.33Å; D241-K296 VanDerWaalsContact OD1-NZ 3.1Å; R292-K296 WeakPolarHBondContact O-CB 3.11Å; R292-K296 PolarHBondContact O-N 2.87Å; K296-K300 WeakPolarHBondContact O-CB 3.31Å; K296-K300 PolarHBondContact O-N 2.84Å; K296-K300 VanDerWaalsContact O-N 3.1Å
297	Q	85.7	Confident	80	Confident	139 Å²	139	83.4 Å²	83.4	65%	0.65	40%	0.395	S	S	*	.	H	α-helix	trans	-68.5	-41.5	173.8	-73.9	173.1	11.3	0	0	112.5	R293 Q294 M295 K300 S301	R293-Q297 VanDerWaalsContact O-CG 3.25Å; R293-Q297 WeakPolarHBondContact O-CG 3.37Å; R293-Q297 PolarHBondContact O-N 2.72Å; Q294-Q297 WeakPolarHBondContact O-CB 3.49Å; Q294-Q297 PolarHBondContact O-N 2.71Å; M295-Q297 VanDerWaalsContact C-N 3.28Å; M295-Q297 PolarHBondContact O-N 3.29Å; Q297-K300 PolarHBondContact O-N 2.98Å; Q297-S301 WeakPolarHBondContact O-CB 3.45Å; Q297-S301 PolarHBondContact O-N 3.36Å
298	H	82.1	Confident	78.5	Confident	56 Å²	56	85 Å²	85	26%	0.259	40%	0.402	S	S	.	.	H	α-helix	trans	-64.9	-47.5	177.6	-177.6	-134.4	0	0	0	111.8	H263 Q294 M295 K300 S301 L302	H263-H298 AromaticContact CD2-CE1 3.88Å; H263-H298 AromaticContact CD2-CG 3.54Å; H263-H298 AromaticContact CD2-ND1 3.43Å; H263-H298 PolarHBondContact CD2-ND1 3.13Å; Q294-H298 PolarHBondContact O-N 3.35Å; M295-H298 PolarHBondContact O-N 3.06Å; H298-K300 VanDerWaalsContact C-N 3.27Å; H298-K300 PolarHBondContact O-N 3.44Å; H298-S301 WeakPolarHBondContact O-CB 3.5Å; H298-S301 PolarHBondContact O-N 3Å; H298-L302 PolarHBondContact O-N 2.95Å
299	L	84.1	Confident	77	Confident	28 Å²	28	85.9 Å²	85.9	15%	0.147	41%	0.409	C	S	.	.	H	α-helix	trans	-58.3	-41.1	175.4	-74	169.6	0	0	0	111.6	L235 V238 N259 L260 M295 L302 Q303	L235-L299 HydrophobicContact CD1-CD1 4.02Å; V238-L299 HydrophobicContact CG1-CD1 3.96Å; N259-L299 HydrophobicContact CB-CD2 4.34Å; L260-L299 HydrophobicContact CD2-CD1 4.45Å; M295-L299 WeakPolarHBondContact O-CB 3.32Å; M295-L299 WeakPolarHBondContact O-CG 3.47Å; M295-L299 PolarHBondContact O-N 3.33Å; L299-L302 PolarHBondContact O-N 2.89Å; L299-Q303 WeakPolarHBondContact O-CG 3.44Å; L299-Q303 PolarHBondContact O-N 2.88Å
300	K	83.8	Confident	75.9	Confident	122 Å²	122	89.2 Å²	89.2	53%	0.53	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-40.9	174.9	-161.8	-175.9	-171	-131.9	0	112.3	K296 Q297 H298 L302 Q303 E304	K296-K300 WeakPolarHBondContact O-CB 3.31Å; K296-K300 PolarHBondContact O-N 2.84Å; K296-K300 VanDerWaalsContact O-N 3.1Å; Q297-K300 PolarHBondContact O-N 2.98Å; H298-K300 VanDerWaalsContact C-N 3.27Å; H298-K300 PolarHBondContact O-N 3.44Å; K300-L302 VanDerWaalsContact C-N 3.27Å; K300-L302 PolarHBondContact O-N 2.72Å; K300-Q303 PolarHBondContact O-N 2.67Å; K300-E304 WeakPolarHBondContact CE-OE1 3.18Å; K300-E304 HydrophobicContact CG-CG 4.43Å; K300-E304 IonicContact NZ-OE1 3.18Å; K300-E304 PolarHBondContact NZ-OE1 2.74Å; K300-E304 WeakPolarHBondContact O-CG 3.5Å; K300-E304 PolarHBondContact O-N 2.96Å
301	S	81.6	Confident	74.8	Confident	73 Å²	73	87.1 Å²	87.1	51%	0.51	42%	0.42	S	S	.	.	H	α-helix	trans	-65.7	-28.6	177.2	-172.9	0	0	0	0	113.2	Q297 H298	Q297-S301 WeakPolarHBondContact O-CB 3.45Å; Q297-S301 PolarHBondContact O-N 3.36Å; H298-S301 WeakPolarHBondContact O-CB 3.5Å; H298-S301 PolarHBondContact O-N 3Å
302	L	76.1	Confident	73.6	Confident	104 Å²	104	89 Å²	89	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-75.4	-30.8	174.1	-72.8	166.9	0	0	0	111.9	H298 L299 K300	H298-L302 PolarHBondContact O-N 2.95Å; L299-L302 PolarHBondContact O-N 2.89Å; K300-L302 VanDerWaalsContact C-N 3.27Å; K300-L302 PolarHBondContact O-N 2.72Å
303	Q	72	Confident	72.6	Confident	161 Å²	161	94.8 Å²	94.8	75%	0.752	46%	0.458	S	S	*	.	H	α-helix	trans	-81.5	-31.4	177.9	-71.5	176.1	-12.2	0	0	113.1	L299 K300 K305	L299-Q303 WeakPolarHBondContact O-CG 3.44Å; L299-Q303 PolarHBondContact O-N 2.88Å; K300-Q303 PolarHBondContact O-N 2.67Å; Q303-K305 PolarHBondContact O-N 2.91Å
304	E	66	Low	71.9	Confident	50 Å²	50	95.6 Å²	95.6	23%	0.234	46%	0.461	C	S	.	.	S	Bend	trans	-74.2	120.9	178.3	-74.5	178.3	-174.1	0	0	110.6	K300	K300-E304 WeakPolarHBondContact CE-OE1 3.18Å; K300-E304 HydrophobicContact CG-CG 4.43Å; K300-E304 IonicContact NZ-OE1 3.18Å; K300-E304 PolarHBondContact NZ-OE1 2.74Å; K300-E304 WeakPolarHBondContact O-CG 3.5Å; K300-E304 PolarHBondContact O-N 2.96Å
305	K	58.9	Low	71.2	Confident	169 Å²	169	100.1 Å²	100.1	74%	0.735	48%	0.475	S	S	*	.			trans	-54.5	144.4	173.3	-73.7	-178.5	178.9	-179.8	0	110.6	Q303 E307 H308	Q303-K305 PolarHBondContact O-N 2.91Å; K305-E307 PolarHBondContact O-N 3.22Å; K305-H308 PolarHBondContact O-N 3.42Å
306	P	54.6	Low	70.6	Confident	103 Å²	103	107.1 Å²	107.1	67%	0.669	51%	0.505	S	S	*	.	H	α-helix	trans	-54.6	-33.9	-171.5	17.3	-30.2	0	0	0	114.1	H308 A309 D310	P306-H308 PolarHBondContact O-N 2.94Å; P306-A309 PolarHBondContact O-N 3.27Å; P306-D310 PolarHBondContact O-N 3.33Å
307	E	57.8	Low	70	Confident	170 Å²	170	105.6 Å²	105.6	79%	0.794	51%	0.505	S	S	*	.	H	α-helix	trans	-62	-38.5	179	-64.7	-177.1	164.9	0	0	113.6	K305	K305-E307 PolarHBondContact O-N 3.22Å
308	H	55.1	Low	69.4	Low	96 Å²	96	104 Å²	104	44%	0.444	50%	0.498	S	S	.	.	H	α-helix	trans	-75.4	-33.7	-179.1	-163.9	60.8	0	0	0	111.9	K305 P306 D310 E311 V312	K305-H308 PolarHBondContact O-N 3.42Å; P306-H308 PolarHBondContact O-N 2.94Å; H308-D310 VanDerWaalsContact C-N 3.35Å; H308-D310 PolarHBondContact O-N 3.41Å; H308-E311 PolarHBondContact O-N 3.49Å; H308-V312 VanDerWaalsContact O-CG2 3.31Å; H308-V312 WeakPolarHBondContact O-CG2 3.23Å; H308-V312 PolarHBondContact O-N 2.89Å
309	A	56.2	Low	69	Low	19 Å²	19	109.1 Å²	109.1	16%	0.157	52%	0.52	C	S	.	.	H	α-helix	trans	-63.2	-40.2	180	0	0	0	0	0	112	P306 V312 K313	P306-A309 PolarHBondContact O-N 3.27Å; A309-V312 PolarHBondContact O-N 3.25Å; A309-K313 WeakPolarHBondContact O-CB 3.35Å; A309-K313 WeakPolarHBondContact O-CG 3.49Å; A309-K313 PolarHBondContact O-N 2.95Å
310	D	64.2	Low	68.4	Low	105 Å²	105	114.6 Å²	114.6	56%	0.561	55%	0.545	S	S	*	.	H	α-helix	trans	-69.2	-38.2	177.7	-77.1	-20.2	0	0	0	112.2	P306 H308 K313 R314	P306-D310 PolarHBondContact O-N 3.33Å; H308-D310 VanDerWaalsContact C-N 3.35Å; H308-D310 PolarHBondContact O-N 3.41Å; D310-K313 PolarHBondContact O-N 2.89Å; D310-R314 WeakPolarHBondContact O-CB 3.44Å; D310-R314 PolarHBondContact O-N 3.44Å
311	E	67.6	Low	68	Low	93 Å²	93	116.1 Å²	116.1	44%	0.435	55%	0.551	S	S	.	*	H	α-helix	trans	-63.5	-44.1	174.3	-162	-165.2	160.4	0	0	111.6	H308 R314 R315	H308-E311 PolarHBondContact O-N 3.49Å; E311-R314 PolarHBondContact O-N 3.47Å; E311-R315 WeakPolarHBondContact O-CB 3.32Å; E311-R315 PolarHBondContact O-N 3.45Å; E311-R315 IonicContact OE1-CZ 2.84Å; E311-R315 IonicContact OE1-NE 3.54Å
312	V	64.5	Low	67.6	Low	43 Å²	43	121.9 Å²	121.9	26%	0.261	56%	0.562	S	S	.	*	H	α-helix	trans	-65.4	-42.5	178	173.8	0	0	0	0	111.3	H308 A309 R315 K316	H308-V312 VanDerWaalsContact O-CG2 3.31Å; H308-V312 WeakPolarHBondContact O-CG2 3.23Å; H308-V312 PolarHBondContact O-N 2.89Å; A309-V312 PolarHBondContact O-N 3.25Å; V312-R315 PolarHBondContact O-N 3.06Å; V312-K316 HydrophobicContact CG1-CD 4.42Å; V312-K316 WeakPolarHBondContact O-CG 3.45Å; V312-K316 PolarHBondContact O-N 3.11Å
313	K	67.1	Low	67.3	Low	141 Å²	141	126.6 Å²	126.6	61%	0.613	57%	0.573	S	S	*	*	H	α-helix	trans	-60.7	-44.4	173.5	-79.1	176.5	-176.8	170.7	0	111.2	A309 D310 R315 K316 S317	A309-K313 WeakPolarHBondContact O-CB 3.35Å; A309-K313 WeakPolarHBondContact O-CG 3.49Å; A309-K313 PolarHBondContact O-N 2.95Å; D310-K313 PolarHBondContact O-N 2.89Å; K313-R315 PolarHBondContact O-N 3.37Å; K313-K316 PolarHBondContact O-N 2.7Å; K313-S317 PolarHBondContact O-N 2.83Å
314	R	72.2	Confident	67	Low	183 Å²	183	126.5 Å²	126.5	69%	0.691	57%	0.566	S	S	*	*	H	α-helix	trans	-62.3	-44.1	178	-155.6	172.1	98.7	179.1	5.4	111.4	D310 E311 S317 M318	D310-R314 WeakPolarHBondContact O-CB 3.44Å; D310-R314 PolarHBondContact O-N 3.44Å; E311-R314 PolarHBondContact O-N 3.47Å; R314-S317 PolarHBondContact O-N 2.95Å; R314-S317 PolarHBondContact O-OG 3.38Å; R314-M318 PolarHBondContact O-N 3.2Å
315	R	74.9	Confident	67.3	Low	166 Å²	166	130.9 Å²	130.9	63%	0.626	59%	0.585	S	S	*	*	H	α-helix	trans	-62	-42.2	174.6	-84.4	179.9	162.5	-171.4	-3.2	112.9	E311 V312 K313 M318 K319	E311-R315 WeakPolarHBondContact O-CB 3.32Å; E311-R315 PolarHBondContact O-N 3.45Å; E311-R315 IonicContact OE1-CZ 2.84Å; E311-R315 IonicContact OE1-NE 3.54Å; V312-R315 PolarHBondContact O-N 3.06Å; K313-R315 PolarHBondContact O-N 3.37Å; R315-M318 PolarHBondContact O-N 3.41Å; R315-K319 PolarHBondContact O-N 3.47Å
316	K	72.3	Confident	67.5	Low	147 Å²	147	130.9 Å²	130.9	64%	0.639	58%	0.58	S	S	*	*	H	α-helix	trans	-64.2	-48.2	176.1	-77.9	-179.3	179.6	174.7	0	111.6	V312 K313 M318 K319 E320	V312-K316 HydrophobicContact CG1-CD 4.42Å; V312-K316 WeakPolarHBondContact O-CG 3.45Å; V312-K316 PolarHBondContact O-N 3.11Å; K313-K316 PolarHBondContact O-N 2.7Å; K316-M318 VanDerWaalsContact C-N 3.29Å; K316-M318 PolarHBondContact O-N 3.46Å; K316-K319 PolarHBondContact O-N 3.36Å; K316-K319 VanDerWaalsContact O-N 3.12Å; K316-E320 PolarHBondContact O-N 2.89Å
317	S	73.6	Confident	67.9	Low	49 Å²	49	133.4 Å²	133.4	34%	0.343	58%	0.581	S	S	.	*	H	α-helix	trans	-61.2	-38	178.1	83	0	0	0	0	112.1	K313 R314 E320 K321	K313-S317 PolarHBondContact O-N 2.83Å; R314-S317 PolarHBondContact O-N 2.95Å; R314-S317 PolarHBondContact O-OG 3.38Å; S317-E320 PolarHBondContact O-N 2.97Å; S317-K321 WeakPolarHBondContact O-CB 3.27Å; S317-K321 WeakPolarHBondContact O-CG 3.49Å; S317-K321 PolarHBondContact O-N 2.86Å
318	M	73	Confident	67.8	Low	106 Å²	106	130 Å²	130	52%	0.522	57%	0.567	S	S	.	*	H	α-helix	trans	-65.5	-42.3	173.9	-90.5	-147.5	-69	0	0	112.4	R314 R315 K316 E320 R322	R314-M318 PolarHBondContact O-N 3.2Å; R315-M318 PolarHBondContact O-N 3.41Å; K316-M318 VanDerWaalsContact C-N 3.29Å; K316-M318 PolarHBondContact O-N 3.46Å; M318-E320 VanDerWaalsContact C-N 3.31Å; M318-E320 PolarHBondContact O-N 2.74Å; M318-R322 WeakPolarHBondContact O-CB 3.16Å; M318-R322 WeakPolarHBondContact O-CG 3.12Å; M318-R322 PolarHBondContact O-N 2.86Å
319	K	73.4	Confident	68	Low	164 Å²	164	131.6 Å²	131.6	71%	0.713	58%	0.575	S	S	*	*	H	α-helix	trans	-62.7	-40.1	176.3	-109.8	-178.5	177.7	176.4	0	111.6	R315 K316 R322 R323	R315-K319 PolarHBondContact O-N 3.47Å; K316-K319 PolarHBondContact O-N 3.36Å; K316-K319 VanDerWaalsContact O-N 3.12Å; K319-R322 PolarHBondContact O-N 3.14Å; K319-R323 PolarHBondContact O-N 2.96Å
320	E	72.2	Confident	67.9	Low	143 Å²	143	140 Å²	140	67%	0.668	60%	0.604	S	S	*	*	H	α-helix	trans	-68.7	-45.7	178.8	-165.5	162.6	-148.4	0	0	111.6	K316 S317 M318 R322 R323 Y324	K316-E320 PolarHBondContact O-N 2.89Å; S317-E320 PolarHBondContact O-N 2.97Å; M318-E320 VanDerWaalsContact C-N 3.31Å; M318-E320 PolarHBondContact O-N 2.74Å; E320-R322 VanDerWaalsContact C-N 3.32Å; E320-R322 PolarHBondContact O-N 3.22Å; E320-R323 PolarHBondContact O-N 3.44Å; E320-R323 VanDerWaalsContact O-N 3.13Å; E320-Y324 WeakPolarHBondContact O-CB 3.17Å; E320-Y324 PolarHBondContact O-N 3.14Å
321	K	75.4	Confident	67.1	Low	153 Å²	153	141.8 Å²	141.8	67%	0.665	61%	0.609	S	S	*	*	H	α-helix	trans	-57.8	-41.4	170.9	-75.3	-179.4	178.4	-177.5	0	112.3	S317 Y324 K325	S317-K321 WeakPolarHBondContact O-CB 3.27Å; S317-K321 WeakPolarHBondContact O-CG 3.49Å; S317-K321 PolarHBondContact O-N 2.86Å; K321-Y324 PolarHBondContact O-N 3.48Å; K321-K325 WeakPolarHBondContact O-CB 3.23Å; K321-K325 PolarHBondContact O-N 3.45Å
322	R	73.2	Confident	66.2	Low	195 Å²	195	144.2 Å²	144.2	74%	0.736	62%	0.622	S	S	*	*	H	α-helix	trans	-65.2	-39.2	174.8	-76.5	176.9	92.8	-179.6	7.5	112.3	M318 K319 E320 R326	M318-R322 WeakPolarHBondContact O-CB 3.16Å; M318-R322 WeakPolarHBondContact O-CG 3.12Å; M318-R322 PolarHBondContact O-N 2.86Å; K319-R322 PolarHBondContact O-N 3.14Å; E320-R322 VanDerWaalsContact C-N 3.32Å; E320-R322 PolarHBondContact O-N 3.22Å; R322-R326 WeakPolarHBondContact O-CB 3.45Å; R322-R326 PolarHBondContact O-N 2.7Å
323	R	68.3	Low	65.5	Low	203 Å²	203	148 Å²	148	77%	0.766	65%	0.645	S	S	*	*	H	α-helix	trans	-66.5	-42	175.2	-108.7	-176.7	174.3	-175.4	-2.1	112	K319 E320 R326 K327	K319-R323 PolarHBondContact O-N 2.96Å; E320-R323 PolarHBondContact O-N 3.44Å; E320-R323 VanDerWaalsContact O-N 3.13Å; R323-R326 PolarHBondContact O-N 3.08Å; R323-K327 PolarHBondContact O-N 3.32Å
324	Y	67.3	Low	64.8	Low	159 Å²	159	144.5 Å²	144.5	62%	0.624	64%	0.635	S	S	*	*	H	α-helix	trans	-64.6	-46.2	176.2	-173.7	-97	0	0	0	111	E320 K321 R326 K327 L328	E320-Y324 WeakPolarHBondContact O-CB 3.17Å; E320-Y324 PolarHBondContact O-N 3.14Å; K321-Y324 PolarHBondContact O-N 3.48Å; Y324-R326 PolarHBondContact O-N 3.26Å; Y324-K327 WeakPolarHBondContact O-CB 3.35Å; Y324-K327 PolarHBondContact O-N 3.27Å; Y324-K327 VanDerWaalsContact O-N 3.14Å; Y324-L328 HydrophobicContact CD1-CD1 4.38Å; Y324-L328 HydrophobicContact CE1-CD1 3.67Å; Y324-L328 PolarHBondContact O-N 3.37Å
325	K	71.2	Confident	63.6	Low	141 Å²	141	141.9 Å²	141.9	61%	0.613	64%	0.642	S	S	*	*	H	α-helix	trans	-57.8	-47.2	173.9	-172.4	176.3	-179.6	-178.7	0	111.5	K321 K327 L328 E329	K321-K325 WeakPolarHBondContact O-CB 3.23Å; K321-K325 PolarHBondContact O-N 3.45Å; K325-K327 VanDerWaalsContact C-N 3.32Å; K325-K327 PolarHBondContact O-N 2.92Å; K325-L328 WeakPolarHBondContact O-CB 2.95Å; K325-L328 PolarHBondContact O-N 3.46Å; K325-E329 WeakPolarHBondContact O-CB 3.3Å; K325-E329 PolarHBondContact O-N 3.44Å
326	R	63.2	Low	63.1	Low	169 Å²	169	137.5 Å²	137.5	64%	0.638	65%	0.649	S	S	*	*	H	α-helix	trans	-63.3	-35.5	176.7	-173.7	-178.8	-79.5	-178.3	-7.6	112.3	R322 R323 Y324 E329 Y330	R322-R326 WeakPolarHBondContact O-CB 3.45Å; R322-R326 PolarHBondContact O-N 2.7Å; R323-R326 PolarHBondContact O-N 3.08Å; Y324-R326 PolarHBondContact O-N 3.26Å; R326-E329 PolarHBondContact O-N 3.19Å; R326-Y330 HydrophobicContact CG-CD2 3.85Å; R326-Y330 HydrophobicContact CG-CE2 4.1Å; R326-Y330 WeakPolarHBondContact O-CB 3.4Å; R326-Y330 WeakPolarHBondContact O-CD2 3.49Å; R326-Y330 PolarHBondContact O-N 2.98Å
327	K	63.5	Low	62.1	Low	157 Å²	157	136.5 Å²	136.5	68%	0.683	65%	0.65	S	S	*	*	H	α-helix	trans	-63.1	-46.4	172.2	-93.4	-170.7	171.9	-167.4	0	111.2	R323 Y324 K325 E329 Y330 E331	R323-K327 PolarHBondContact O-N 3.32Å; Y324-K327 WeakPolarHBondContact O-CB 3.35Å; Y324-K327 PolarHBondContact O-N 3.27Å; Y324-K327 VanDerWaalsContact O-N 3.14Å; K325-K327 VanDerWaalsContact C-N 3.32Å; K325-K327 PolarHBondContact O-N 2.92Å; K327-E329 VanDerWaalsContact C-N 3.26Å; K327-E329 PolarHBondContact O-N 3.32Å; K327-Y330 PolarHBondContact O-N 3.45Å; K327-E331 WeakPolarHBondContact O-CB 3.19Å; K327-E331 PolarHBondContact O-N 3.03Å
328	L	55.8	Low	61.4	Low	99 Å²	99	142.7 Å²	142.7	52%	0.518	67%	0.674	S	S	.	*	H	α-helix	trans	-61.1	-36.8	175.1	-129.3	95.7	0	0	0	111.9	Y324 K325 E331	Y324-L328 HydrophobicContact CD1-CD1 4.38Å; Y324-L328 HydrophobicContact CE1-CD1 3.67Å; Y324-L328 PolarHBondContact O-N 3.37Å; K325-L328 WeakPolarHBondContact O-CB 2.95Å; K325-L328 PolarHBondContact O-N 3.46Å; L328-E331 CarbonylContact O-C 3.56Å; L328-E331 PolarHBondContact O-N 3.14Å
329	E	59.7	Low	60.5	Low	129 Å²	129	143.3 Å²	143.3	60%	0.603	69%	0.686	S	S	*	*	H	α-helix	trans	-71.9	-34.3	178.4	-138.5	166.4	-142.8	0	0	112	K325 R326 K327 M332	K325-E329 WeakPolarHBondContact O-CB 3.3Å; K325-E329 PolarHBondContact O-N 3.44Å; R326-E329 PolarHBondContact O-N 3.19Å; K327-E329 VanDerWaalsContact C-N 3.26Å; K327-E329 PolarHBondContact O-N 3.32Å; E329-M332 VanDerWaalsContact O-CG 3.26Å; E329-M332 WeakPolarHBondContact O-CG 3.12Å
330	Y	54.4	Low	59.7	Low	195 Å²	195	140.4 Å²	140.4	77%	0.765	68%	0.677	S	S	*	*	H	α-helix	trans	-78.1	-22.7	173	-99.7	-90.9	0	0	0	112.9	R326 K327 M332	R326-Y330 HydrophobicContact CG-CD2 3.85Å; R326-Y330 HydrophobicContact CG-CE2 4.1Å; R326-Y330 WeakPolarHBondContact O-CB 3.4Å; R326-Y330 WeakPolarHBondContact O-CD2 3.49Å; R326-Y330 PolarHBondContact O-N 2.98Å; K327-Y330 PolarHBondContact O-N 3.45Å; Y330-M332 PolarHBondContact O-N 2.93Å
331	E	45.9	Very low	59.3	Low	142 Å²	142	137.3 Å²	137.3	66%	0.664	67%	0.668	S	S	*	*	S	Bend	trans	-74.2	59.5	164.6	-158.3	161.8	-162.5	0	0	107.8	K327 L328 V333	K327-E331 WeakPolarHBondContact O-CB 3.19Å; K327-E331 PolarHBondContact O-N 3.03Å; L328-E331 CarbonylContact O-C 3.56Å; L328-E331 PolarHBondContact O-N 3.14Å; E331-V333 PolarHBondContact O-N 3.48Å
332	M	48.9	Very low	58.5	Low	145 Å²	145	133.8 Å²	133.8	71%	0.714	67%	0.667	S	S	*	*			trans	-66.3	98.2	174.1	-75.2	179.3	51.3	0	0	107.8	E329 Y330 V334	E329-M332 VanDerWaalsContact O-CG 3.26Å; E329-M332 WeakPolarHBondContact O-CG 3.12Å; Y330-M332 PolarHBondContact O-N 2.93Å; M332-V334 HydrophobicContact CE-CG2 4.21Å; M332-V334 PolarHBondContact O-N 3.37Å
333	V	50.8	Low	57.7	Low	123 Å²	123	132.2 Å²	132.2	75%	0.745	67%	0.668	S	S	*	*			trans	-77.6	98.1	158.7	-176.4	0	0	0	0	105.8	E331 P335	E331-V333 PolarHBondContact O-N 3.48Å; V333-P335 WeakPolarHBondContact O-CD 3.28Å
334	V	51.2	Low	57.1	Low	67 Å²	67	127.4 Å²	127.4	41%	0.406	66%	0.655	S	S	.	*			trans	-66.4	122	169.5	-178.6	0	0	0	0	106.7	M332 G336 D337	M332-V334 HydrophobicContact CE-CG2 4.21Å; M332-V334 PolarHBondContact O-N 3.37Å; V334-G336 PolarHBondContact O-N 2.92Å; V334-D337 PolarHBondContact O-N 3.29Å
335	P	48.5	Very low	56.4	Low	127 Å²	127	126 Å²	126	83%	0.825	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	108.3	177.8	-22.4	33.6	0	0	0	110	V333	V333-P335 WeakPolarHBondContact O-CD 3.28Å
336	G	63.5	Low	55.5	Low	75 Å²	75	124.7 Å²	124.7	77%	0.773	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	128.6	-15.4	-179.9	0	0	0	0	0	115	V334	V334-G336 PolarHBondContact O-N 2.92Å
337	D	51.1	Low	55	Low	125 Å²	125	123.8 Å²	123.8	67%	0.668	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-82.8	124.4	173.9	-75.1	-24.9	0	0	0	110.4	V334	V334-D337 PolarHBondContact O-N 3.29Å
338	E	59.2	Low	54.1	Low	179 Å²	179	124.3 Å²	124.3	84%	0.836	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-64.7	146.7	174.6	-71.2	-173.2	172.5	0	0	110.9	I340	E338-I340 PolarHBondContact O-N 3.45Å
339	P	53.8	Low	53.6	Low	119 Å²	119	121.8 Å²	121.8	77%	0.773	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-58.5	130.7	178.9	24	-33.2	0	0	0	110.9	T341	P339-T341 PolarHBondContact O-N 2.65Å; P339-T341 VanDerWaalsContact O-N 3.12Å
340	I	55.8	Low	52.6	Low	104 Å²	104	123.7 Å²	123.7	53%	0.533	67%	0.666	S	S	.	*			trans	-43.5	119.7	171.2	-67.3	175.2	0	0	0	109	E338 E344 Q345	E338-I340 PolarHBondContact O-N 3.45Å; I340-E344 HydrophobicContact CG2-CB 3.39Å; I340-E344 HydrophobicContact CG2-CG 4.45Å; I340-E344 WeakPolarHBondContact CG2-OE2 3.33Å; I340-Q345 HydrophobicContact CG2-CG 3.85Å
341	T	63.8	Low	52	Low	77 Å²	77	122 Å²	122	47%	0.472	67%	0.665	S	S	.	*			trans	-65.1	155.9	-178	56.6	0	0	0	0	110.6	P339 E343 E344 Q345	P339-T341 PolarHBondContact O-N 2.65Å; P339-T341 VanDerWaalsContact O-N 3.12Å; T341-E343 PolarHBondContact O-N 3.31Å; T341-E344 PolarHBondContact O-N 3.08Å; T341-Q345 PolarHBondContact O-N 2.82Å; T341-Q345 VanDerWaalsContact O-N 3.16Å
342	A	59.2	Low	51.8	Low	80 Å²	80	125.5 Å²	125.5	66%	0.661	67%	0.672	S	S	*	*	H	α-helix	trans	-55.9	-24.3	178.1	0	0	0	0	0	112.9	N346	A342-N346 PolarHBondContact O-N 2.94Å
343	E	57.7	Low	51.2	Low	162 Å²	162	124.7 Å²	124.7	76%	0.757	68%	0.675	S	S	*	*	H	α-helix	trans	-68.6	-44.8	174.9	-65.8	-174.6	164.7	0	0	112.2	T341 N346 L347	T341-E343 PolarHBondContact O-N 3.31Å; E343-N346 WeakPolarHBondContact O-CB 3.48Å; E343-N346 PolarHBondContact O-N 2.88Å; E343-L347 PolarHBondContact O-N 3.1Å
344	E	54.5	Low	50.8	Low	102 Å²	102	124.4 Å²	124.4	48%	0.477	67%	0.673	S	S	.	*	H	α-helix	trans	-68.4	-36.6	177.3	-73	-177	151.6	0	0	111.9	I340 T341 N346 L347 F348	I340-E344 HydrophobicContact CG2-CB 3.39Å; I340-E344 HydrophobicContact CG2-CG 4.45Å; I340-E344 WeakPolarHBondContact CG2-OE2 3.33Å; T341-E344 PolarHBondContact O-N 3.08Å; E344-N346 PolarHBondContact O-N 3.06Å; E344-L347 WeakPolarHBondContact O-CB 3.32Å; E344-L347 PolarHBondContact O-N 3.06Å; E344-F348 VanDerWaalsContact O-CD2 3.29Å; E344-F348 WeakPolarHBondContact O-CD2 3.06Å
345	Q	52.4	Low	50.1	Low	130 Å²	130	126.5 Å²	126.5	61%	0.607	69%	0.686	S	S	*	*	H	α-helix	trans	-61.2	-34.1	172.5	-70.1	-171.5	-10.3	0	0	112.1	I340 T341 L347 F348	I340-Q345 HydrophobicContact CG2-CG 3.85Å; T341-Q345 PolarHBondContact O-N 2.82Å; T341-Q345 VanDerWaalsContact O-N 3.16Å; Q345-L347 VanDerWaalsContact C-N 3.32Å; Q345-F348 PolarHBondContact O-N 2.81Å
346	N	52.1	Low	49.8	Very low	113 Å²	113	129 Å²	129	60%	0.604	69%	0.687	S	S	*	*	H	α-helix	trans	-71.9	-28.6	179.3	-152.2	6.7	0	0	0	112.2	A342 E343 E344 F348 S349	A342-N346 PolarHBondContact O-N 2.94Å; E343-N346 WeakPolarHBondContact O-CB 3.48Å; E343-N346 PolarHBondContact O-N 2.88Å; E344-N346 PolarHBondContact O-N 3.06Å; N346-F348 VanDerWaalsContact C-N 3.27Å; N346-F348 PolarHBondContact O-N 3.48Å; N346-S349 PolarHBondContact O-N 3.37Å; N346-S349 PolarHBondContact O-OG 2.97Å
347	L	53.5	Low	48.5	Very low	150 Å²	150	130.4 Å²	130.4	79%	0.785	68%	0.68	S	S	*	*	H	α-helix	trans	-63.4	-30.9	177.2	-141.3	79.9	0	0	0	112.7	E343 E344 Q345	E343-L347 PolarHBondContact O-N 3.1Å; E344-L347 WeakPolarHBondContact O-CB 3.32Å; E344-L347 PolarHBondContact O-N 3.06Å; Q345-L347 VanDerWaalsContact C-N 3.32Å
348	F	45.1	Very low	47.8	Very low	167 Å²	167	130.5 Å²	130.5	73%	0.732	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-2	178.4	-64.5	-74.4	0	0	0	114.1	E344 Q345 N346 I350	E344-F348 VanDerWaalsContact O-CD2 3.29Å; E344-F348 WeakPolarHBondContact O-CD2 3.06Å; Q345-F348 PolarHBondContact O-N 2.81Å; N346-F348 VanDerWaalsContact C-N 3.27Å; N346-F348 PolarHBondContact O-N 3.48Å; F348-I350 PolarHBondContact O-N 3.25Å
349	S	44.5	Very low	47.2	Very low	47 Å²	47	132.1 Å²	132.1	33%	0.329	69%	0.685	S	S	.	*	S	Bend	trans	-71.1	117.9	172.3	91.8	0	0	0	0	108.4	N346 H351	N346-S349 PolarHBondContact O-N 3.37Å; N346-S349 PolarHBondContact O-OG 2.97Å; S349-H351 PolarHBondContact O-N 3.47Å; S349-H351 PolarHBondContact OG-ND1 3.03Å; S349-H351 VanDerWaalsContact OG-ND1 3.1Å
350	I	39.8	Very low	46.7	Very low	168 Å²	168	131.2 Å²	131.2	86%	0.862	68%	0.682	S	S	*	*			trans	-71.8	61.4	176.2	-53.9	168.6	0	0	0	108.1	F348 R352	F348-I350 PolarHBondContact O-N 3.25Å; I350-R352 PolarHBondContact O-N 2.64Å
351	H	40.3	Very low	46.3	Very low	160 Å²	160	134.1 Å²	134.1	74%	0.741	70%	0.698	S	S	*	*			trans	-75.9	80.8	163.5	-89.9	84.4	0	0	0	107.3	S349 V353	S349-H351 PolarHBondContact O-N 3.47Å; S349-H351 PolarHBondContact OG-ND1 3.03Å; S349-H351 VanDerWaalsContact OG-ND1 3.1Å; H351-V353 PolarHBondContact O-N 2.92Å
352	R	42.4	Very low	45.6	Very low	215 Å²	215	134.3 Å²	134.3	81%	0.811	71%	0.708	S	S	*	*			trans	19.7	83.8	138.7	-170.6	179.8	167.5	115.8	-0.3	111.8	I350 V354	I350-R352 PolarHBondContact O-N 2.64Å; R352-V354 VanDerWaalsContact C-N 3.31Å; R352-V354 PolarHBondContact O-N 3.07Å
353	V	37	Very low	45.1	Very low	129 Å²	129	141.5 Å²	141.5	78%	0.782	72%	0.718	S	S	*	*			trans	-51.9	102.2	167.8	-178.9	0	0	0	0	106.3	H351 T355	H351-V353 PolarHBondContact O-N 2.92Å; V353-T355 PolarHBondContact O-N 3.01Å
354	V	41.2	Very low	44.8	Very low	116 Å²	116	140.2 Å²	140.2	70%	0.703	72%	0.721	S	S	*	*			trans	-70.1	90.5	172.2	178.5	0	0	0	0	104.1	R352 Q356	R352-V354 VanDerWaalsContact C-N 3.31Å; R352-V354 PolarHBondContact O-N 3.07Å; V354-Q356 PolarHBondContact O-N 3.45Å
355	T	36	Very low	44.8	Very low	111 Å²	111	144.5 Å²	144.5	68%	0.681	74%	0.738	S	S	*	*			trans	-56.1	106.5	169.5	25.9	0	0	0	0	106.7	V353 V357	V353-T355 PolarHBondContact O-N 3.01Å; T355-V357 PolarHBondContact O-N 3.32Å
356	Q	42.1	Very low	45.1	Very low	181 Å²	181	147.2 Å²	147.2	85%	0.846	75%	0.751	S	S	*	*			trans	-64.4	84.6	169	-76.6	178.7	-34.9	0	0	107.1	V354 V358	V354-Q356 PolarHBondContact O-N 3.45Å; Q356-V358 PolarHBondContact O-N 3.4Å
357	V	36.7	Very low	45.5	Very low	103 Å²	103	148.4 Å²	148.4	62%	0.624	76%	0.762	S	S	*	*			trans	-71.1	102.8	165.5	-178.1	0	0	0	0	105.5	T355 Y359	T355-V357 PolarHBondContact O-N 3.32Å; V357-Y359 PolarHBondContact O-N 2.99Å
358	V	36.7	Very low	46.4	Very low	127 Å²	127	150.1 Å²	150.1	77%	0.77	76%	0.763	S	S	*	*			trans	-59.3	107.7	171.9	-179.8	0	0	0	0	107	Q356 S360	Q356-V358 PolarHBondContact O-N 3.4Å; V358-S360 PolarHBondContact O-N 2.98Å; V358-S360 VanDerWaalsContact O-N 3.08Å
359	Y	45.7	Very low	48	Very low	213 Å²	213	149 Å²	149	84%	0.835	76%	0.76	S	S	*	*			trans	-67.6	104.9	166.8	-67.7	-86.2	0	0	0	106.5	V357	V357-Y359 PolarHBondContact O-N 2.99Å
360	S	44.6	Very low	49.8	Very low	100 Å²	100	150.7 Å²	150.7	70%	0.699	76%	0.764	S	S	*	*			trans	-64.5	141.4	162.6	51.3	0	0	0	0	108.3	V358 A362	V358-S360 PolarHBondContact O-N 2.98Å; V358-S360 VanDerWaalsContact O-N 3.08Å; S360-A362 PolarHBondContact O-N 3.29Å
361	D	46.7	Very low	52.1	Low	165 Å²	165	144.7 Å²	144.7	88%	0.882	74%	0.737	S	S	*	*			trans	-61.9	70.2	178.3	-77.7	-40.3	0	0	0	111.4	R363	D361-R363 PolarHBondContact O-N 3.3Å
362	A	48.3	Very low	54.3	Low	81 Å²	81	137.9 Å²	137.9	67%	0.669	71%	0.709	S	S	*	*			trans	-70.1	91	165.5	0	0	0	0	0	105.8	S360 T364	S360-A362 PolarHBondContact O-N 3.29Å; A362-T364 PolarHBondContact O-N 2.99Å
363	R	49.2	Very low	56.4	Low	232 Å²	232	130.3 Å²	130.3	88%	0.875	68%	0.683	S	S	*	*			trans	-23.5	106.4	168.4	-59.8	178	-164.6	177.4	3	108.2	D361 K365	D361-R363 PolarHBondContact O-N 3.3Å; R363-K365 VanDerWaalsContact C-N 3.26Å; R363-K365 PolarHBondContact O-N 3.15Å
364	T	51.3	Low	58.8	Low	134 Å²	134	128.8 Å²	128.8	82%	0.822	67%	0.667	S	S	*	*			trans	-54.9	97.7	179.1	41.4	0	0	0	0	106.5	A362 E366	A362-T364 PolarHBondContact O-N 2.99Å; T364-E366 PolarHBondContact O-N 2.87Å
365	K	55.1	Low	61	Low	192 Å²	192	126.1 Å²	126.1	84%	0.835	65%	0.649	S	S	*	*			trans	-59.8	112.6	173.1	-76.2	-177.6	177.2	-179.8	0	104.3	R363 V367	R363-K365 VanDerWaalsContact C-N 3.26Å; R363-K365 PolarHBondContact O-N 3.15Å; K365-V367 PolarHBondContact O-N 3.41Å
366	E	58.5	Low	63.5	Low	188 Å²	188	121 Å²	121	88%	0.879	62%	0.617	S	S	*	*			trans	-51.3	112.5	175	-70.1	-174.2	158.4	0	0	107.4	T364 K368	T364-E366 PolarHBondContact O-N 2.87Å; E366-K368 PolarHBondContact O-N 2.89Å
367	V	60.3	Low	65.5	Low	138 Å²	138	113.8 Å²	113.8	84%	0.836	59%	0.585	S	S	*	*			trans	-71.4	101.7	178.3	-180	0	0	0	0	105.3	K365 H369	K365-V367 PolarHBondContact O-N 3.41Å; V367-H369 PolarHBondContact O-N 3.48Å
368	K	72.6	Confident	67.9	Low	185 Å²	185	109.8 Å²	109.8	80%	0.804	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-55.4	127	172.8	-76.7	-173.5	174.6	-176.7	0	108.5	E366 L370	E366-K368 PolarHBondContact O-N 2.89Å; K368-L370 WeakPolarHBondContact O-CD1 3.46Å; K368-L370 PolarHBondContact O-N 3.08Å
369	H	78.1	Confident	70.3	Confident	144 Å²	144	107.3 Å²	107.3	67%	0.667	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-69.5	120.2	173.8	-168.8	-69.2	0	0	0	108.3	V367	V367-H369 PolarHBondContact O-N 3.48Å
370	L	83.1	Confident	72.1	Confident	82 Å²	82	100 Å²	100	43%	0.429	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-68.9	144.3	179.1	-85.1	68.7	0	0	0	110.5	K368 E374 L375	K368-L370 WeakPolarHBondContact O-CD1 3.46Å; K368-L370 PolarHBondContact O-N 3.08Å; L370-E374 WeakPolarHBondContact CA-OE2 3.5Å; L370-E374 HydrophobicContact CB-CB 4.09Å; L370-E374 HydrophobicContact CD2-CB 4.23Å; L370-E374 HydrophobicContact CG-CB 4.17Å; L370-L375 HydrophobicContact CB-CD2 3.93Å; L370-L375 HydrophobicContact CB-CG 4.02Å; L370-L375 HydrophobicContact CD2-CD2 4.09Å
371	S	88.1	Confident	73.8	Confident	42 Å²	42	100.9 Å²	100.9	29%	0.294	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-70.9	165.3	171.5	97.7	0	0	0	0	111.3	E373 E374 L375	S371-E373 VanDerWaalsContact C-N 3.26Å; S371-E373 WeakPolarHBondContact CB-OE2 3.34Å; S371-E373 PolarHBondContact O-N 2.92Å; S371-E373 PolarHBondContact OG-N 3.18Å; S371-E373 PolarHBondContact OG-OE2 2.9Å; S371-E374 PolarHBondContact N-OE2 3.38Å; S371-E374 PolarHBondContact O-N 3.46Å; S371-E374 PolarHBondContact OG-N 3.08Å; S371-L375 WeakPolarHBondContact O-CG 3.36Å; S371-L375 PolarHBondContact O-N 3.33Å
372	A	86.2	Confident	75.6	Confident	18 Å²	18	100 Å²	100	15%	0.149	50%	0.501	C	S	.	.	H	α-helix	trans	-62.3	-36.4	176.3	0	0	0	0	0	112.1	L375 A376 K433	A372-L375 PolarHBondContact O-N 3.1Å; A372-A376 PolarHBondContact O-N 3.34Å; A372-A376 VanDerWaalsContact O-N 3.09Å; A372-K433 HydrophobicContact CB-CG 3.7Å
373	E	86.6	Confident	77.2	Confident	55 Å²	55	102.6 Å²	102.6	26%	0.257	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-42.9	175.1	-59.5	75.2	-164.1	0	0	111.3	S371 A376 L377 L422 V429 K433	S371-E373 VanDerWaalsContact C-N 3.26Å; S371-E373 WeakPolarHBondContact CB-OE2 3.34Å; S371-E373 PolarHBondContact O-N 2.92Å; S371-E373 PolarHBondContact OG-N 3.18Å; S371-E373 PolarHBondContact OG-OE2 2.9Å; E373-A376 PolarHBondContact O-N 2.94Å; E373-L377 PolarHBondContact O-N 3.21Å; E373-L422 HydrophobicContact CB-CD1 4.08Å; E373-L422 HydrophobicContact CG-CD1 4.41Å; E373-V429 HydrophobicContact CG-CG1 3.89Å; E373-V429 HydrophobicContact CG-CG2 4.41Å; E373-K433 WeakPolarHBondContact OE1-CE 3.34Å; E373-K433 IonicContact OE1-NZ 2.79Å; E373-K433 PolarHBondContact OE1-NZ 3.18Å
374	E	87.3	Confident	78.7	Confident	98 Å²	98	93.6 Å²	93.6	46%	0.458	47%	0.471	S	S	.	.	H	α-helix	trans	-66.8	-37.7	177	-67.5	175.8	157.5	0	0	112.3	L370 S371 A376 L377 G378	L370-E374 WeakPolarHBondContact CA-OE2 3.5Å; L370-E374 HydrophobicContact CB-CB 4.09Å; L370-E374 HydrophobicContact CD2-CB 4.23Å; L370-E374 HydrophobicContact CG-CB 4.17Å; S371-E374 PolarHBondContact N-OE2 3.38Å; S371-E374 PolarHBondContact O-N 3.46Å; S371-E374 PolarHBondContact OG-N 3.08Å; E374-A376 VanDerWaalsContact C-N 3.33Å; E374-L377 PolarHBondContact O-N 3.1Å; E374-G378 PolarHBondContact O-N 3.46Å
375	L	88	Confident	80.1	Confident	60 Å²	60	90.4 Å²	90.4	31%	0.314	46%	0.455	S	S	.	.	H	α-helix	trans	-64.5	-39.1	174.1	-71.1	175.2	0	0	0	111.7	L370 S371 A372 G378 Q379 Y432	L370-L375 HydrophobicContact CB-CD2 3.93Å; L370-L375 HydrophobicContact CB-CG 4.02Å; L370-L375 HydrophobicContact CD2-CD2 4.09Å; S371-L375 WeakPolarHBondContact O-CG 3.36Å; S371-L375 PolarHBondContact O-N 3.33Å; A372-L375 PolarHBondContact O-N 3.1Å; L375-G378 PolarHBondContact O-N 3.08Å; L375-Q379 PolarHBondContact O-N 3.03Å; L375-Y432 HydrophobicContact CB-CD1 3.71Å; L375-Y432 HydrophobicContact CB-CE1 3.79Å; L375-Y432 HydrophobicContact CB-CG 4.14Å; L375-Y432 HydrophobicContact CD1-CD1 4.06Å; L375-Y432 HydrophobicContact CD1-CE1 4.48Å
376	A	87.7	Confident	81.4	Confident	2 Å²	2	88.7 Å²	88.7	2%	0.017	45%	0.447	C	S	.	.	H	α-helix	trans	-67.9	-43.1	176.3	0	0	0	0	0	112.2	A372 E373 E374 G378 Q379 L380 V424 V429 Y432	A372-A376 PolarHBondContact O-N 3.34Å; A372-A376 VanDerWaalsContact O-N 3.09Å; E373-A376 PolarHBondContact O-N 2.94Å; E374-A376 VanDerWaalsContact C-N 3.33Å; A376-G378 VanDerWaalsContact C-N 3.33Å; A376-G378 PolarHBondContact O-N 2.91Å; A376-Q379 PolarHBondContact O-N 2.94Å; A376-L380 PolarHBondContact O-N 3.35Å; A376-L380 VanDerWaalsContact O-N 3.14Å; A376-V424 HydrophobicContact CB-CG1 3.73Å; A376-V429 HydrophobicContact CB-CG2 4.36Å; A376-Y432 HydrophobicContact CB-CD2 3.71Å; A376-Y432 HydrophobicContact CB-CE2 3.9Å
377	L	85.7	Confident	82.5	Confident	31 Å²	31	81.7 Å²	81.7	16%	0.162	42%	0.418	C	S	.	.	H	α-helix	trans	-59.6	-44.2	170.7	-79.8	164.6	0	0	0	111.6	E373 E374 Q379 L380 W381 I391 L422 P423 V424	E373-L377 PolarHBondContact O-N 3.21Å; E374-L377 PolarHBondContact O-N 3.1Å; L377-Q379 VanDerWaalsContact C-N 3.31Å; L377-Q379 PolarHBondContact O-N 2.81Å; L377-L380 PolarHBondContact O-N 2.85Å; L377-W381 PolarHBondContact O-N 3.19Å; L377-I391 HydrophobicContact CD2-CD1 4.42Å; L377-L422 HydrophobicContact CD1-CD1 4.47Å; L377-L422 HydrophobicContact CD1-CD2 4.15Å; L377-P423 HydrophobicContact CD2-CG 4.19Å; L377-V424 HydrophobicContact CD2-CG2 3.44Å; L377-V424 VanDerWaalsContact CD2-CG2 3.44Å; L377-V424 HydrophobicContact CG-CG2 3.63Å
378	G	86.1	Confident	83.6	Confident	19 Å²	19	82 Å²	82	20%	0.196	40%	0.404	C	S	.	.	H	α-helix	trans	-59.8	-40.5	177.3	0	0	0	0	0	112.3	E374 L375 A376 W381 I382	E374-G378 PolarHBondContact O-N 3.46Å; L375-G378 PolarHBondContact O-N 3.08Å; A376-G378 VanDerWaalsContact C-N 3.33Å; A376-G378 PolarHBondContact O-N 2.91Å; G378-W381 WeakPolarHBondContact O-CB 3.48Å; G378-W381 PolarHBondContact O-N 3Å; G378-I382 WeakPolarHBondContact O-CD1 3.47Å; G378-I382 VanDerWaalsContact O-CG1 3.26Å; G378-I382 WeakPolarHBondContact O-CG1 3.42Å; G378-I382 PolarHBondContact O-N 3.29Å
379	Q	87.1	Confident	84.1	Confident	74 Å²	74	81 Å²	81	35%	0.346	40%	0.395	S	S	.	.	H	α-helix	trans	-61	-48.9	174	-175.4	-178.5	-0.7	0	0	111.4	L375 A376 L377 W381 I382 H383 Y432	L375-Q379 PolarHBondContact O-N 3.03Å; A376-Q379 PolarHBondContact O-N 2.94Å; L377-Q379 VanDerWaalsContact C-N 3.31Å; L377-Q379 PolarHBondContact O-N 2.81Å; Q379-W381 VanDerWaalsContact C-N 3.27Å; Q379-W381 PolarHBondContact O-N 3.19Å; Q379-I382 PolarHBondContact O-N 2.68Å; Q379-I382 VanDerWaalsContact O-N 3.15Å; Q379-H383 VanDerWaalsContact CG-CD2 3.49Å; Q379-H383 WeakPolarHBondContact CG-CD2 3.39Å; Q379-H383 VanDerWaalsContact CG-NE2 3.32Å; Q379-H383 WeakPolarHBondContact CG-NE2 3.37Å; Q379-H383 PolarHBondContact NE2-NE2 2.88Å; Q379-H383 VanDerWaalsContact NE2-NE2 3.19Å; Q379-H383 PolarHBondContact O-CD2 2.84Å; Q379-H383 PolarHBondContact O-N 3.32Å; Q379-Y432 HydrophobicContact CB-CE2 4.49Å; Q379-Y432 WeakPolarHBondContact CB-OH 3.49Å; Q379-Y432 VanDerWaalsContact OE1-CE2 3.27Å; Q379-Y432 PolarHBondContact OE1-OH 3.38Å
380	L	82.9	Confident	84.3	Confident	59 Å²	59	78.8 Å²	78.8	31%	0.309	39%	0.388	S	S	.	.	H	α-helix	trans	-60.2	-37.5	176.7	-70.8	171.7	0	0	0	112.3	A376 L377 T387 I391 V424	A376-L380 PolarHBondContact O-N 3.35Å; A376-L380 VanDerWaalsContact O-N 3.14Å; L377-L380 PolarHBondContact O-N 2.85Å; L380-T387 PolarHBondContact O-OG1 3.45Å; L380-I391 HydrophobicContact CB-CD1 4.03Å; L380-V424 HydrophobicContact CD1-CB 4.4Å; L380-V424 HydrophobicContact CD1-CG1 4.3Å; L380-V424 HydrophobicContact CD1-CG2 3.84Å
381	W	81.8	Confident	84.3	Confident	120 Å²	120	76 Å²	76	46%	0.455	37%	0.373	S	S	.	.	H	α-helix	trans	-65.2	-33.5	175.5	-93.9	1.3	0	0	0	114.3	L377 G378 Q379 I391	L377-W381 PolarHBondContact O-N 3.19Å; G378-W381 WeakPolarHBondContact O-CB 3.48Å; G378-W381 PolarHBondContact O-N 3Å; Q379-W381 VanDerWaalsContact C-N 3.27Å; Q379-W381 PolarHBondContact O-N 3.19Å; W381-I391 HydrophobicContact CG-CD1 4.39Å; W381-I391 HydrophobicContact CZ2-CG2 3.95Å; W381-I391 VanDerWaalsContact NE1-CB 3.32Å
382	I	83.9	Confident	84.1	Confident	145 Å²	145	77.3 Å²	77.3	74%	0.744	38%	0.379	S	S	*	.	H	α-helix	trans	-77.3	-38.8	-178.9	-69.1	164.1	0	0	0	110.8	G378 Q379	G378-I382 WeakPolarHBondContact O-CD1 3.47Å; G378-I382 VanDerWaalsContact O-CG1 3.26Å; G378-I382 WeakPolarHBondContact O-CG1 3.42Å; G378-I382 PolarHBondContact O-N 3.29Å; Q379-I382 PolarHBondContact O-N 2.68Å; Q379-I382 VanDerWaalsContact O-N 3.15Å
383	H	82.4	Confident	83.9	Confident	137 Å²	137	81.3 Å²	81.3	63%	0.634	40%	0.398	S	S	*	.	H	α-helix	trans	-69.8	-35.3	-171.7	-76.8	-62.4	0	0	0	114.5	Q379	Q379-H383 VanDerWaalsContact CG-CD2 3.49Å; Q379-H383 WeakPolarHBondContact CG-CD2 3.39Å; Q379-H383 VanDerWaalsContact CG-NE2 3.32Å; Q379-H383 WeakPolarHBondContact CG-NE2 3.37Å; Q379-H383 PolarHBondContact NE2-NE2 2.88Å; Q379-H383 VanDerWaalsContact NE2-NE2 3.19Å; Q379-H383 PolarHBondContact O-CD2 2.84Å; Q379-H383 PolarHBondContact O-N 3.32Å
384	S	79	Confident	83.6	Confident	42 Å²	42	81 Å²	81	29%	0.294	41%	0.405	S	S	.	.			trans	-144	140	-175.3	174.1	0	0	0	0	113.1	K386 T387 R388	S384-K386 PolarHBondContact O-N 2.99Å; S384-K386 WeakPolarHBondContact OG-CB 3.37Å; S384-K386 PolarHBondContact OG-N 3.09Å; S384-T387 VanDerWaalsContact CB-OG1 3.3Å; S384-T387 WeakPolarHBondContact CB-OG1 3.4Å; S384-T387 PolarHBondContact O-OG1 3.15Å; S384-R388 PolarHBondContact O-N 2.92Å; S384-R388 VanDerWaalsContact O-N 3.14Å
385	S	82	Confident	83.2	Confident	68 Å²	68	78.4 Å²	78.4	48%	0.476	40%	0.404	S	S	.	.	H	α-helix	trans	-70.1	-23.5	170.5	-174.8	0	0	0	0	112	R389	S385-R389 WeakPolarHBondContact O-CG 3.42Å; S385-R389 PolarHBondContact O-N 3.18Å
386	K	82.3	Confident	82.7	Confident	156 Å²	156	83.4 Å²	83.4	68%	0.678	42%	0.424	S	S	*	.	H	α-helix	trans	-71.4	-53.9	176.9	-65.2	-176	178.6	-179.6	0	109.7	S384 R388 R389 D390	S384-K386 PolarHBondContact O-N 2.99Å; S384-K386 WeakPolarHBondContact OG-CB 3.37Å; S384-K386 PolarHBondContact OG-N 3.09Å; K386-R388 PolarHBondContact O-N 3.22Å; K386-R388 VanDerWaalsContact O-N 3.17Å; K386-R389 CarbonylContact O-C 3.58Å; K386-R389 WeakPolarHBondContact O-CA 3.46Å; K386-R389 WeakPolarHBondContact O-CB 3.43Å; K386-R389 PolarHBondContact O-N 2.94Å; K386-D390 PolarHBondContact O-N 3.43Å
387	T	80.9	Confident	82.1	Confident	41 Å²	41	86.3 Å²	86.3	25%	0.252	44%	0.439	S	S	.	.	H	α-helix	trans	-56.2	-37.5	175.7	53.8	0	0	0	0	111.7	L380 S384 D390 I391	L380-T387 PolarHBondContact O-OG1 3.45Å; S384-T387 VanDerWaalsContact CB-OG1 3.3Å; S384-T387 WeakPolarHBondContact CB-OG1 3.4Å; S384-T387 PolarHBondContact O-OG1 3.15Å; T387-D390 PolarHBondContact O-N 3.43Å; T387-I391 VanDerWaalsContact O-CB 3.32Å; T387-I391 WeakPolarHBondContact O-CB 3.49Å; T387-I391 WeakPolarHBondContact O-CD1 3.4Å; T387-I391 WeakPolarHBondContact O-CG1 3.34Å; T387-I391 PolarHBondContact O-N 2.89Å
388	R	83.6	Confident	81.4	Confident	144 Å²	144	94.7 Å²	94.7	54%	0.543	47%	0.468	S	S	.	.	H	α-helix	trans	-59.7	-46.3	172.1	-176.5	179.4	175.1	130	1	113	S384 K386 V392	S384-R388 PolarHBondContact O-N 2.92Å; S384-R388 VanDerWaalsContact O-N 3.14Å; K386-R388 PolarHBondContact O-N 3.22Å; K386-R388 VanDerWaalsContact O-N 3.17Å; R388-V392 VanDerWaalsContact O-CG2 3.27Å; R388-V392 WeakPolarHBondContact O-CG2 3.37Å; R388-V392 PolarHBondContact O-N 2.91Å; R388-V392 VanDerWaalsContact O-N 3.08Å
389	R	82.6	Confident	80.7	Confident	164 Å²	164	96.8 Å²	96.8	62%	0.619	47%	0.471	S	S	*	.	H	α-helix	trans	-64	-48.4	176.1	-71.4	173	-174.6	169.5	0.1	110.5	S385 K386 I391 V392 D393	S385-R389 WeakPolarHBondContact O-CG 3.42Å; S385-R389 PolarHBondContact O-N 3.18Å; K386-R389 CarbonylContact O-C 3.58Å; K386-R389 WeakPolarHBondContact O-CA 3.46Å; K386-R389 WeakPolarHBondContact O-CB 3.43Å; K386-R389 PolarHBondContact O-N 2.94Å; R389-I391 VanDerWaalsContact C-N 3.27Å; R389-I391 PolarHBondContact O-N 3.19Å; R389-V392 CarbonylContact O-C 3.6Å; R389-V392 WeakPolarHBondContact O-CA 3.36Å; R389-V392 WeakPolarHBondContact O-CB 3.4Å; R389-V392 PolarHBondContact O-N 3.41Å; R389-D393 PolarHBondContact O-N 3.37Å
390	D	82.7	Confident	79.8	Confident	97 Å²	97	96 Å²	96	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-59.5	-38.4	-179.3	-54.6	-24.8	0	0	0	111.6	K386 T387 A394	K386-D390 PolarHBondContact O-N 3.43Å; T387-D390 PolarHBondContact O-N 3.43Å; D390-A394 WeakPolarHBondContact O-CB 3.44Å; D390-A394 PolarHBondContact O-N 3.18Å
391	I	83	Confident	79.3	Confident	24 Å²	24	101 Å²	101	12%	0.123	50%	0.499	C	S	.	.	H	α-helix	trans	-70.6	-38.2	175.5	-69.6	162.7	0	0	0	111.7	L377 L380 W381 T387 R389 G395 P423	L377-I391 HydrophobicContact CD2-CD1 4.42Å; L380-I391 HydrophobicContact CB-CD1 4.03Å; W381-I391 HydrophobicContact CG-CD1 4.39Å; W381-I391 HydrophobicContact CZ2-CG2 3.95Å; W381-I391 VanDerWaalsContact NE1-CB 3.32Å; T387-I391 VanDerWaalsContact O-CB 3.32Å; T387-I391 WeakPolarHBondContact O-CB 3.49Å; T387-I391 WeakPolarHBondContact O-CD1 3.4Å; T387-I391 WeakPolarHBondContact O-CG1 3.34Å; T387-I391 PolarHBondContact O-N 2.89Å; R389-I391 VanDerWaalsContact C-N 3.27Å; R389-I391 PolarHBondContact O-N 3.19Å; I391-G395 PolarHBondContact O-N 3.19Å; I391-G395 VanDerWaalsContact O-N 3.14Å; I391-P423 HydrophobicContact CG1-CG 4.05Å
392	V	83.7	Confident	78.8	Confident	70 Å²	70	100.9 Å²	100.9	42%	0.424	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-44.5	175	169.1	0	0	0	0	110.2	R388 R389 G395 F396	R388-V392 VanDerWaalsContact O-CG2 3.27Å; R388-V392 WeakPolarHBondContact O-CG2 3.37Å; R388-V392 PolarHBondContact O-N 2.91Å; R388-V392 VanDerWaalsContact O-N 3.08Å; R389-V392 CarbonylContact O-C 3.6Å; R389-V392 WeakPolarHBondContact O-CA 3.36Å; R389-V392 WeakPolarHBondContact O-CB 3.4Å; R389-V392 PolarHBondContact O-N 3.41Å; V392-G395 WeakPolarHBondContact O-CA 3.48Å; V392-G395 PolarHBondContact O-N 3.35Å; V392-F396 HydrophobicContact CG1-CE2 4.42Å; V392-F396 WeakPolarHBondContact O-CD2 3.41Å
393	D	82.6	Confident	78.6	Confident	102 Å²	102	100.1 Å²	100.1	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-64.8	-40.3	177.4	-72.5	-11.1	0	0	0	111.2	R389 G395 F396	R389-D393 PolarHBondContact O-N 3.37Å; D393-G395 PolarHBondContact O-N 2.67Å; D393-F396 WeakPolarHBondContact O-CB 3.35Å; D393-F396 PolarHBondContact O-N 2.97Å
394	A	80.3	Confident	78.5	Confident	49 Å²	49	102 Å²	102	41%	0.405	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-18.2	173.2	0	0	0	0	0	113.5	D390 F396 N397	D390-A394 WeakPolarHBondContact O-CB 3.44Å; D390-A394 PolarHBondContact O-N 3.18Å; A394-F396 VanDerWaalsContact C-N 3.28Å; A394-N397 PolarHBondContact O-ND2 3.07Å
395	G	78.4	Confident	78.7	Confident	42 Å²	42	108 Å²	108	43%	0.433	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-25.2	171.3	0	0	0	0	0	113.1	I391 V392 D393 N397	I391-G395 PolarHBondContact O-N 3.19Å; I391-G395 VanDerWaalsContact O-N 3.14Å; V392-G395 WeakPolarHBondContact O-CA 3.48Å; V392-G395 PolarHBondContact O-N 3.35Å; D393-G395 PolarHBondContact O-N 2.67Å; G395-N397 PolarHBondContact O-N 3.4Å; G395-N397 VanDerWaalsContact O-N 3.12Å
396	F	78	Confident	78.8	Confident	165 Å²	165	107.5 Å²	107.5	72%	0.724	53%	0.534	S	S	*	.	S	Bend	trans	-82.4	85.3	171.2	-63.1	-82.6	0	0	0	109.5	V392 D393 A394	V392-F396 HydrophobicContact CG1-CE2 4.42Å; V392-F396 WeakPolarHBondContact O-CD2 3.41Å; D393-F396 WeakPolarHBondContact O-CB 3.35Å; D393-F396 PolarHBondContact O-N 2.97Å; A394-F396 VanDerWaalsContact C-N 3.28Å
397	N	75.3	Confident	79.1	Confident	64 Å²	64	103.4 Å²	103.4	34%	0.342	52%	0.523	S	S	.	.	S	Bend	trans	-137.3	176	-178	61.5	38.8	0	0	0	111	A394 G395 Y399 A400	A394-N397 PolarHBondContact O-ND2 3.07Å; G395-N397 PolarHBondContact O-N 3.4Å; G395-N397 VanDerWaalsContact O-N 3.12Å; N397-Y399 HydrophobicContact CB-CD2 4.29Å; N397-Y399 PolarHBondContact O-N 2.93Å; N397-Y399 VanDerWaalsContact O-N 3.12Å; N397-Y399 WeakPolarHBondContact OD1-CA 3.29Å; N397-Y399 WeakPolarHBondContact OD1-CB 3.25Å; N397-Y399 WeakPolarHBondContact OD1-CD2 3.47Å; N397-Y399 PolarHBondContact OD1-N 3.44Å; N397-A400 VanDerWaalsContact O-CB 3.29Å; N397-A400 WeakPolarHBondContact O-CB 3.48Å; N397-A400 PolarHBondContact O-N 3.47Å; N397-A400 PolarHBondContact OD1-N 3.27Å
398	R	71.2	Confident	79.5	Confident	206 Å²	206	108.3 Å²	108.3	78%	0.777	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-59.3	-22.3	178.9	-67.3	-178.1	-70.5	176.5	-0.6	113.2	A400 Y418	R398-A400 VanDerWaalsContact C-N 3.29Å; R398-A400 PolarHBondContact O-N 3.34Å; R398-Y418 VanDerWaalsContact C-OH 3.25Å; R398-Y418 PolarHBondContact O-OH 2.79Å; R398-Y418 VanDerWaalsContact O-OH 3.05Å
399	Y	70.6	Confident	79.7	Confident	64 Å²	64	110 Å²	110	25%	0.251	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-80.3	-5.9	178	-48.3	-89	0	0	0	113.3	N397 Y418 R419 A420	N397-Y399 HydrophobicContact CB-CD2 4.29Å; N397-Y399 PolarHBondContact O-N 2.93Å; N397-Y399 VanDerWaalsContact O-N 3.12Å; N397-Y399 WeakPolarHBondContact OD1-CA 3.29Å; N397-Y399 WeakPolarHBondContact OD1-CB 3.25Å; N397-Y399 WeakPolarHBondContact OD1-CD2 3.47Å; N397-Y399 PolarHBondContact OD1-N 3.44Å; Y399-Y418 AromaticContact CD1-CD1 3.64Å; Y399-Y418 HydrophobicContact CD1-CD1 3.64Å; Y399-Y418 HydrophobicContact CD1-CD2 4.13Å; Y399-Y418 AromaticContact CD1-CE1 3.14Å; Y399-Y418 HydrophobicContact CD1-CE1 3.14Å; Y399-Y418 AromaticContact CD1-CE2 3.64Å; Y399-Y418 HydrophobicContact CD1-CE2 3.64Å; Y399-Y418 HydrophobicContact CD1-CG 4.1Å; Y399-Y418 AromaticContact CD1-CZ 3.11Å; Y399-Y418 WeakPolarHBondContact CD1-OH 3.31Å; Y399-Y418 AromaticContact CE1-CD1 3.77Å; Y399-Y418 HydrophobicContact CE1-CD1 3.77Å; Y399-Y418 AromaticContact CE1-CD2 3.49Å; Y399-Y418 HydrophobicContact CE1-CD2 3.49Å; Y399-Y418 VanDerWaalsContact CE1-CD2 3.49Å; Y399-Y418 AromaticContact CE1-CE1 3.59Å; Y399-Y418 HydrophobicContact CE1-CE1 3.59Å; Y399-Y418 AromaticContact CE1-CE2 3.23Å; Y399-Y418 HydrophobicContact CE1-CE2 3.23Å; Y399-Y418 AromaticContact CE1-CG 3.73Å; Y399-Y418 HydrophobicContact CE1-CG 3.73Å; Y399-Y418 AromaticContact CE1-CZ 3.29Å; Y399-Y418 HydrophobicContact CG-CE1 4.13Å; Y399-Y418 AromaticContact CG-CZ 3.94Å; Y399-Y418 PolarHBondContact N-OH 2.92Å; Y399-R419 PolarHBondContact OH-O 2.87Å; Y399-A420 HydrophobicContact CD1-CB 4.24Å; Y399-A420 HydrophobicContact CD2-CB 4.19Å; Y399-A420 HydrophobicContact CE1-CB 4.32Å; Y399-A420 HydrophobicContact CE2-CB 4.24Å; Y399-A420 HydrophobicContact CG-CB 4.23Å
400	A	69.4	Low	79.9	Confident	57 Å²	57	106 Å²	106	47%	0.471	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-79.9	-17.4	-177.4	0	0	0	0	0	113.8	N397 R398	N397-A400 VanDerWaalsContact O-CB 3.29Å; N397-A400 WeakPolarHBondContact O-CB 3.48Å; N397-A400 PolarHBondContact O-N 3.47Å; N397-A400 PolarHBondContact OD1-N 3.27Å; R398-A400 VanDerWaalsContact C-N 3.29Å; R398-A400 PolarHBondContact O-N 3.34Å
401	H	71.6	Confident	80	Confident	165 Å²	165	104.6 Å²	104.6	76%	0.764	54%	0.536	S	S	*	.			trans	-118.2	95.4	-178.7	-64.9	-76.6	0	0	0	109
402	N	71.6	Confident	80.1	Confident	117 Å²	117	106.6 Å²	106.6	63%	0.626	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-96.5	129.6	171	-70.7	-9.2	0	0	0	108.8
403	D	79.1	Confident	80.1	Confident	129 Å²	129	107.1 Å²	107.1	69%	0.69	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-73.3	143.5	173.4	-68.7	-36.2	0	0	0	110.5	L406	D403-L406 HydrophobicContact CB-CD1 4.22Å; D403-L406 HydrophobicContact CB-CD2 4.5Å; D403-L406 HydrophobicContact CB-CG 4.36Å; D403-L406 WeakPolarHBondContact O-CD1 3.01Å
404	E	80	Confident	80.1	Confident	177 Å²	177	104.9 Å²	104.9	83%	0.827	54%	0.543	S	S	*	.	S	Bend	trans	-87.7	154	174	-62.9	-176.2	175	0	0	110.4
405	N	84.7	Confident	80.1	Confident	166 Å²	166	110.7 Å²	110.7	89%	0.888	56%	0.559	S	S	*	*	S	Bend	trans	65.8	39.6	177.9	-56	-37.8	0	0	0	116.4
406	L	82.9	Confident	80.2	Confident	59 Å²	59	115.4 Å²	115.4	31%	0.309	57%	0.568	S	S	.	*			trans	-80.7	147.9	172	-67.3	161.3	0	0	0	111.7	D403 F410 V411	D403-L406 HydrophobicContact CB-CD1 4.22Å; D403-L406 HydrophobicContact CB-CD2 4.5Å; D403-L406 HydrophobicContact CB-CG 4.36Å; D403-L406 WeakPolarHBondContact O-CD1 3.01Å; L406-F410 HydrophobicContact CB-CD1 4.21Å; L406-F410 HydrophobicContact CD1-CD1 4.12Å; L406-F410 HydrophobicContact CD1-CE1 4.09Å; L406-F410 HydrophobicContact CD2-CD1 4.01Å; L406-F410 HydrophobicContact CD2-CE1 4.07Å; L406-F410 HydrophobicContact CG-CD1 4.35Å; L406-V411 HydrophobicContact CB-CG2 4.01Å
407	P	89.9	Confident	80.2	Confident	69 Å²	69	113.8 Å²	113.8	45%	0.448	56%	0.562	S	S	.	*			trans	-59.9	142.7	174.8	-23.9	33.9	0	0	0	113.2	W409 F410 V411	P407-W409 VanDerWaalsContact C-N 3.25Å; P407-W409 HydrophobicContact CB-CG 4.45Å; P407-W409 PolarHBondContact O-N 2.9Å; P407-W409 VanDerWaalsContact O-N 3.16Å; P407-F410 HydrophobicContact CB-CB 4.43Å; P407-F410 WeakPolarHBondContact O-CA 3.32Å; P407-F410 WeakPolarHBondContact O-CB 3.44Å; P407-F410 PolarHBondContact O-N 3.24Å; P407-V411 PolarHBondContact O-N 2.86Å; P407-V411 VanDerWaalsContact O-N 3.1Å
408	D	87.5	Confident	80.1	Confident	145 Å²	145	114.5 Å²	114.5	78%	0.775	56%	0.561	S	S	*	*	H	α-helix	trans	-55.7	-37.5	-177.9	-67.9	-22.3	0	0	0	113.6	F410 V411 A412	D408-F410 VanDerWaalsContact C-N 3.3Å; D408-F410 PolarHBondContact O-N 3.48Å; D408-V411 PolarHBondContact O-N 3.44Å; D408-A412 WeakPolarHBondContact O-CB 3.45Å; D408-A412 PolarHBondContact O-N 2.83Å
409	W	89.3	Confident	80.2	Confident	180 Å²	180	113.8 Å²	113.8	68%	0.682	56%	0.558	S	S	*	*	H	α-helix	trans	-65.5	-35.3	178.2	75.1	-97.3	0	0	0	111.9	P407 A412 D413	P407-W409 VanDerWaalsContact C-N 3.25Å; P407-W409 HydrophobicContact CB-CG 4.45Å; P407-W409 PolarHBondContact O-N 2.9Å; P407-W409 VanDerWaalsContact O-N 3.16Å; W409-A412 PolarHBondContact O-N 3.37Å; W409-D413 WeakPolarHBondContact O-CB 3.43Å; W409-D413 PolarHBondContact O-N 2.79Å
410	F	86.6	Confident	80.3	Confident	79 Å²	79	113.7 Å²	113.7	35%	0.346	57%	0.57	S	S	.	*	H	α-helix	trans	-70.5	-43.5	177.5	-177	-91.5	0	0	0	110.1	L406 P407 D408 A412 D413 E414	L406-F410 HydrophobicContact CB-CD1 4.21Å; L406-F410 HydrophobicContact CD1-CD1 4.12Å; L406-F410 HydrophobicContact CD1-CE1 4.09Å; L406-F410 HydrophobicContact CD2-CD1 4.01Å; L406-F410 HydrophobicContact CD2-CE1 4.07Å; L406-F410 HydrophobicContact CG-CD1 4.35Å; P407-F410 HydrophobicContact CB-CB 4.43Å; P407-F410 WeakPolarHBondContact O-CA 3.32Å; P407-F410 WeakPolarHBondContact O-CB 3.44Å; P407-F410 PolarHBondContact O-N 3.24Å; D408-F410 VanDerWaalsContact C-N 3.3Å; D408-F410 PolarHBondContact O-N 3.48Å; F410-A412 VanDerWaalsContact C-N 3.29Å; F410-A412 PolarHBondContact O-N 3Å; F410-D413 PolarHBondContact O-N 2.93Å; F410-E414 HydrophobicContact CE1-CB 4.44Å; F410-E414 WeakPolarHBondContact O-CB 3.3Å; F410-E414 PolarHBondContact O-N 3.35Å
411	V	84.1	Confident	80.7	Confident	68 Å²	68	117.6 Å²	117.6	41%	0.412	58%	0.583	S	S	.	*	H	α-helix	trans	-61.7	-39	176	178.7	0	0	0	0	111.3	L406 P407 D408 K415	L406-V411 HydrophobicContact CB-CG2 4.01Å; P407-V411 PolarHBondContact O-N 2.86Å; P407-V411 VanDerWaalsContact O-N 3.1Å; D408-V411 PolarHBondContact O-N 3.44Å; V411-K415 VanDerWaalsContact O-CB 3.24Å; V411-K415 WeakPolarHBondContact O-CB 3.45Å; V411-K415 PolarHBondContact O-N 3.01Å
412	A	84.6	Confident	81	Confident	66 Å²	66	114 Å²	114	55%	0.545	57%	0.57	S	S	.	*	H	α-helix	trans	-66.6	-43.7	176.6	0	0	0	0	0	112.5	D408 W409 F410 K416	D408-A412 WeakPolarHBondContact O-CB 3.45Å; D408-A412 PolarHBondContact O-N 2.83Å; W409-A412 PolarHBondContact O-N 3.37Å; F410-A412 VanDerWaalsContact C-N 3.29Å; F410-A412 PolarHBondContact O-N 3Å; A412-K416 PolarHBondContact O-N 3.4Å
413	D	84.6	Confident	81.4	Confident	80 Å²	80	112 Å²	112	43%	0.428	56%	0.563	S	S	.	*	H	α-helix	trans	-68.4	-45.1	177.8	-166.2	60.9	0	0	0	111.7	W409 F410 K415 K416 H417	W409-D413 WeakPolarHBondContact O-CB 3.43Å; W409-D413 PolarHBondContact O-N 2.79Å; F410-D413 PolarHBondContact O-N 2.93Å; D413-K415 PolarHBondContact O-N 3.03Å; D413-K416 WeakPolarHBondContact O-CB 3.24Å; D413-K416 PolarHBondContact O-N 3.34Å; D413-H417 PolarHBondContact O-CD2 2.92Å; D413-H417 PolarHBondContact O-N 3.34Å; D413-H417 VanDerWaalsContact O-N 3.11Å; D413-H417 IonicContact OD1-CD2 3.93Å; D413-H417 IonicContact OD1-NE2 3.17Å
414	E	82.4	Confident	81.6	Confident	56 Å²	56	107 Å²	107	26%	0.262	54%	0.537	S	S	.	.	H	α-helix	trans	-57.9	-48.1	174.8	-169.6	179.5	-153.2	0	0	109.9	F410 K416 H417 Y418	F410-E414 HydrophobicContact CE1-CB 4.44Å; F410-E414 WeakPolarHBondContact O-CB 3.3Å; F410-E414 PolarHBondContact O-N 3.35Å; E414-K416 PolarHBondContact O-N 3.45Å; E414-K416 VanDerWaalsContact O-N 3.07Å; E414-H417 PolarHBondContact O-N 3.45Å; E414-H417 VanDerWaalsContact O-N 3.1Å; E414-Y418 HydrophobicContact CG-CD1 3.84Å; E414-Y418 HydrophobicContact CG-CG 3.85Å; E414-Y418 VanDerWaalsContact O-CA 3.31Å; E414-Y418 WeakPolarHBondContact O-CA 3.46Å; E414-Y418 WeakPolarHBondContact O-CB 3.44Å; E414-Y418 PolarHBondContact O-N 3.06Å
415	K	79.9	Confident	81.9	Confident	170 Å²	170	102.8 Å²	102.8	74%	0.739	52%	0.523	S	S	*	.	H	α-helix	trans	-59.2	-28	178	-168.7	175.4	-176.2	177.8	0	113.7	V411 D413	V411-K415 VanDerWaalsContact O-CB 3.24Å; V411-K415 WeakPolarHBondContact O-CB 3.45Å; V411-K415 PolarHBondContact O-N 3.01Å; D413-K415 PolarHBondContact O-N 3.03Å
416	K	80.2	Confident	82	Confident	141 Å²	141	102.5 Å²	102.5	61%	0.613	51%	0.514	S	S	*	.	H	α-helix	trans	-75.8	-41.6	177.5	-170.6	-178.9	177	-171.7	0	111.7	A412 D413 E414	A412-K416 PolarHBondContact O-N 3.4Å; D413-K416 WeakPolarHBondContact O-CB 3.24Å; D413-K416 PolarHBondContact O-N 3.34Å; E414-K416 PolarHBondContact O-N 3.45Å; E414-K416 VanDerWaalsContact O-N 3.07Å
417	H	78.2	Confident	82.2	Confident	132 Å²	132	107.1 Å²	107.1	61%	0.611	53%	0.534	S	S	*	.	H	α-helix	trans	-100.1	-20.7	-172.4	-69.4	-70.9	0	0	0	114.6	D413 E414	D413-H417 PolarHBondContact O-CD2 2.92Å; D413-H417 PolarHBondContact O-N 3.34Å; D413-H417 VanDerWaalsContact O-N 3.11Å; D413-H417 IonicContact OD1-CD2 3.93Å; D413-H417 IonicContact OD1-NE2 3.17Å; E414-H417 PolarHBondContact O-N 3.45Å; E414-H417 VanDerWaalsContact O-N 3.1Å
418	Y	74.4	Confident	82.1	Confident	78 Å²	78	105.2 Å²	105.2	31%	0.306	52%	0.524	S	S	.	.			trans	-101.6	88.7	-173	-157.6	-128.5	0	0	0	109.7	R398 Y399 E414	R398-Y418 VanDerWaalsContact C-OH 3.25Å; R398-Y418 PolarHBondContact O-OH 2.79Å; R398-Y418 VanDerWaalsContact O-OH 3.05Å; Y399-Y418 AromaticContact CD1-CD1 3.64Å; Y399-Y418 HydrophobicContact CD1-CD1 3.64Å; Y399-Y418 HydrophobicContact CD1-CD2 4.13Å; Y399-Y418 AromaticContact CD1-CE1 3.14Å; Y399-Y418 HydrophobicContact CD1-CE1 3.14Å; Y399-Y418 AromaticContact CD1-CE2 3.64Å; Y399-Y418 HydrophobicContact CD1-CE2 3.64Å; Y399-Y418 HydrophobicContact CD1-CG 4.1Å; Y399-Y418 AromaticContact CD1-CZ 3.11Å; Y399-Y418 WeakPolarHBondContact CD1-OH 3.31Å; Y399-Y418 AromaticContact CE1-CD1 3.77Å; Y399-Y418 HydrophobicContact CE1-CD1 3.77Å; Y399-Y418 AromaticContact CE1-CD2 3.49Å; Y399-Y418 HydrophobicContact CE1-CD2 3.49Å; Y399-Y418 VanDerWaalsContact CE1-CD2 3.49Å; Y399-Y418 AromaticContact CE1-CE1 3.59Å; Y399-Y418 HydrophobicContact CE1-CE1 3.59Å; Y399-Y418 AromaticContact CE1-CE2 3.23Å; Y399-Y418 HydrophobicContact CE1-CE2 3.23Å; Y399-Y418 AromaticContact CE1-CG 3.73Å; Y399-Y418 HydrophobicContact CE1-CG 3.73Å; Y399-Y418 AromaticContact CE1-CZ 3.29Å; Y399-Y418 HydrophobicContact CG-CE1 4.13Å; Y399-Y418 AromaticContact CG-CZ 3.94Å; Y399-Y418 PolarHBondContact N-OH 2.92Å; E414-Y418 HydrophobicContact CG-CD1 3.84Å; E414-Y418 HydrophobicContact CG-CG 3.85Å; E414-Y418 VanDerWaalsContact O-CA 3.31Å; E414-Y418 WeakPolarHBondContact O-CA 3.46Å; E414-Y418 WeakPolarHBondContact O-CB 3.44Å; E414-Y418 PolarHBondContact O-N 3.06Å
419	R	72	Confident	82.1	Confident	191 Å²	191	99.2 Å²	99.2	72%	0.721	49%	0.492	S	S	*	.			trans	-115.9	115.1	178.6	-66.6	-177	-178.6	179.3	-0.3	110.2	Y399 N421	Y399-R419 PolarHBondContact OH-O 2.87Å; R419-N421 PolarHBondContact O-N 3.38Å
420	A	73.5	Confident	82.1	Confident	62 Å²	62	94 Å²	94	51%	0.512	48%	0.475	S	S	.	.			trans	-65	129	171.8	0	0	0	0	0	110.3	Y399	Y399-A420 HydrophobicContact CD1-CB 4.24Å; Y399-A420 HydrophobicContact CD2-CB 4.19Å; Y399-A420 HydrophobicContact CE1-CB 4.32Å; Y399-A420 HydrophobicContact CE2-CB 4.24Å; Y399-A420 HydrophobicContact CG-CB 4.23Å
421	N	78.1	Confident	82.3	Confident	139 Å²	139	95.4 Å²	95.4	74%	0.743	49%	0.486	S	S	*	.			trans	-84.9	113	171.9	55.7	-25.7	0	0	0	109.5	R419	R419-N421 PolarHBondContact O-N 3.38Å
422	L	77.1	Confident	82.6	Confident	91 Å²	91	93.9 Å²	93.9	48%	0.476	47%	0.473	S	S	.	.			trans	-72.5	143.6	174.7	-67	174.2	0	0	0	110.3	E373 L377 V424	E373-L422 HydrophobicContact CB-CD1 4.08Å; E373-L422 HydrophobicContact CG-CD1 4.41Å; L377-L422 HydrophobicContact CD1-CD1 4.47Å; L377-L422 HydrophobicContact CD1-CD2 4.15Å; L422-V424 HydrophobicContact CB-CG2 4.42Å; L422-V424 PolarHBondContact O-N 3.38Å
423	P	80.8	Confident	82.9	Confident	74 Å²	74	95 Å²	95	48%	0.481	47%	0.466	S	S	.	.	S	Bend	trans	-76	40.5	176.8	33.8	-37.3	0	0	0	112.1	L377 I391	L377-P423 HydrophobicContact CD2-CG 4.19Å; I391-P423 HydrophobicContact CG1-CG 4.05Å
424	V	82.6	Confident	83.2	Confident	25 Å²	25	99.4 Å²	99.4	15%	0.152	48%	0.476	C	S	.	.	S	Bend	trans	-127.8	138.1	-177.4	-170	0	0	0	0	109	A376 L377 L380 L422 A428 V429	A376-V424 HydrophobicContact CB-CG1 3.73Å; L377-V424 HydrophobicContact CD2-CG2 3.44Å; L377-V424 VanDerWaalsContact CD2-CG2 3.44Å; L377-V424 HydrophobicContact CG-CG2 3.63Å; L380-V424 HydrophobicContact CD1-CB 4.4Å; L380-V424 HydrophobicContact CD1-CG1 4.3Å; L380-V424 HydrophobicContact CD1-CG2 3.84Å; L422-V424 HydrophobicContact CB-CG2 4.42Å; L422-V424 PolarHBondContact O-N 3.38Å; V424-A428 HydrophobicContact CG1-CB 3.95Å; V424-V429 HydrophobicContact CB-CG2 4.46Å; V424-V429 HydrophobicContact CG1-CG2 3.93Å
425	T	87.4	Confident	83.4	Confident	87 Å²	87	103.9 Å²	103.9	53%	0.534	49%	0.491	S	S	.	.			trans	-69.6	145.2	176.5	63.8	0	0	0	0	110.9	E427 A428 V429	T425-E427 PolarHBondContact O-N 3.21Å; T425-A428 PolarHBondContact O-N 2.92Å; T425-A428 VanDerWaalsContact O-N 3.15Å; T425-A428 WeakPolarHBondContact OG1-CB 3.37Å; T425-A428 PolarHBondContact OG1-N 3.12Å; T425-V429 PolarHBondContact O-N 3.35Å
426	K	85.9	Confident	83.6	Confident	160 Å²	160	98.3 Å²	98.3	70%	0.696	47%	0.468	S	S	*	.	H	α-helix	trans	-57.1	-38.3	176.7	-169.6	-173.5	179.9	-160	0	111.6	A428 V429 E430	K426-A428 PolarHBondContact O-N 2.92Å; K426-V429 PolarHBondContact O-N 3.1Å; K426-E430 WeakPolarHBondContact CE-OE1 3.46Å; K426-E430 IonicContact NZ-OE1 3.6Å; K426-E430 WeakPolarHBondContact O-CG 3.44Å; K426-E430 PolarHBondContact O-N 2.71Å
427	E	87.7	Confident	83.8	Confident	157 Å²	157	97.9 Å²	97.9	73%	0.734	47%	0.47	S	S	*	.	H	α-helix	trans	-60	-42.6	177.3	-61.7	178.5	174.1	0	0	112.5	T425 E430 L431	T425-E427 PolarHBondContact O-N 3.21Å; E427-E430 PolarHBondContact O-N 3.28Å; E427-L431 PolarHBondContact O-N 2.89Å
428	A	86.6	Confident	84.2	Confident	28 Å²	28	96.6 Å²	96.6	23%	0.231	46%	0.464	C	S	.	.	H	α-helix	trans	-64.8	-41.4	177.5	0	0	0	0	0	111.4	V424 T425 K426 L431 Y432	V424-A428 HydrophobicContact CG1-CB 3.95Å; T425-A428 PolarHBondContact O-N 2.92Å; T425-A428 VanDerWaalsContact O-N 3.15Å; T425-A428 WeakPolarHBondContact OG1-CB 3.37Å; T425-A428 PolarHBondContact OG1-N 3.12Å; K426-A428 PolarHBondContact O-N 2.92Å; A428-L431 WeakPolarHBondContact O-CB 3.45Å; A428-L431 PolarHBondContact O-N 3.48Å; A428-Y432 VanDerWaalsContact O-CD2 3.31Å; A428-Y432 WeakPolarHBondContact O-CD2 3.46Å; A428-Y432 PolarHBondContact O-N 2.93Å
429	V	87.9	Confident	84.5	Confident	19 Å²	19	96.8 Å²	96.8	12%	0.115	47%	0.469	C	S	.	.	H	α-helix	trans	-65.4	-42.1	175.9	178.4	0	0	0	0	111.2	E373 A376 V424 T425 K426 L431 Y432 K433	E373-V429 HydrophobicContact CG-CG1 3.89Å; E373-V429 HydrophobicContact CG-CG2 4.41Å; A376-V429 HydrophobicContact CB-CG2 4.36Å; V424-V429 HydrophobicContact CB-CG2 4.46Å; V424-V429 HydrophobicContact CG1-CG2 3.93Å; T425-V429 PolarHBondContact O-N 3.35Å; K426-V429 PolarHBondContact O-N 3.1Å; V429-L431 VanDerWaalsContact C-N 3.31Å; V429-L431 PolarHBondContact O-N 3.44Å; V429-Y432 PolarHBondContact O-N 3.39Å; V429-K433 HydrophobicContact CG1-CD 4.23Å; V429-K433 WeakPolarHBondContact O-CG 3.43Å; V429-K433 PolarHBondContact O-N 3.45Å
430	E	89.8	Confident	84.9	Confident	70 Å²	70	93.2 Å²	93.2	33%	0.327	46%	0.464	S	S	.	.	H	α-helix	trans	-62.2	-37.7	177.2	-77.1	-179.7	-167.7	0	0	112.4	K426 E427 Y432 K433 R434	K426-E430 WeakPolarHBondContact CE-OE1 3.46Å; K426-E430 IonicContact NZ-OE1 3.6Å; K426-E430 WeakPolarHBondContact O-CG 3.44Å; K426-E430 PolarHBondContact O-N 2.71Å; E427-E430 PolarHBondContact O-N 3.28Å; E430-Y432 VanDerWaalsContact C-N 3.34Å; E430-Y432 PolarHBondContact O-N 2.92Å; E430-K433 PolarHBondContact O-N 3Å; E430-R434 WeakPolarHBondContact O-CG 3.33Å; E430-R434 PolarHBondContact O-N 3.31Å
431	L	91.6	Very high	85.5	Confident	110 Å²	110	94.2 Å²	94.2	58%	0.576	47%	0.473	S	S	*	.	H	α-helix	trans	-57.2	-46.8	173.8	-179.6	67.9	0	0	0	111.6	E427 A428 V429 R434 R435	E427-L431 PolarHBondContact O-N 2.89Å; A428-L431 WeakPolarHBondContact O-CB 3.45Å; A428-L431 PolarHBondContact O-N 3.48Å; V429-L431 VanDerWaalsContact C-N 3.31Å; V429-L431 PolarHBondContact O-N 3.44Å; L431-R434 PolarHBondContact O-N 3.14Å; L431-R435 WeakPolarHBondContact O-CB 3.44Å; L431-R435 PolarHBondContact O-N 3.4Å
432	Y	89.9	Confident	85.8	Confident	35 Å²	35	94.9 Å²	94.9	14%	0.137	47%	0.465	C	S	.	.	H	α-helix	trans	-68.3	-37	177.9	-81.8	-75.5	0	0	0	112.9	L375 A376 Q379 A428 V429 E430 R435 Q436	L375-Y432 HydrophobicContact CB-CD1 3.71Å; L375-Y432 HydrophobicContact CB-CE1 3.79Å; L375-Y432 HydrophobicContact CB-CG 4.14Å; L375-Y432 HydrophobicContact CD1-CD1 4.06Å; L375-Y432 HydrophobicContact CD1-CE1 4.48Å; A376-Y432 HydrophobicContact CB-CD2 3.71Å; A376-Y432 HydrophobicContact CB-CE2 3.9Å; Q379-Y432 HydrophobicContact CB-CE2 4.49Å; Q379-Y432 WeakPolarHBondContact CB-OH 3.49Å; Q379-Y432 VanDerWaalsContact OE1-CE2 3.27Å; Q379-Y432 PolarHBondContact OE1-OH 3.38Å; A428-Y432 VanDerWaalsContact O-CD2 3.31Å; A428-Y432 WeakPolarHBondContact O-CD2 3.46Å; A428-Y432 PolarHBondContact O-N 2.93Å; V429-Y432 PolarHBondContact O-N 3.39Å; E430-Y432 VanDerWaalsContact C-N 3.34Å; E430-Y432 PolarHBondContact O-N 2.92Å; Y432-R435 PolarHBondContact O-N 2.89Å; Y432-Q436 PolarHBondContact O-N 3.32Å
433	K	90.8	Very high	86.2	Confident	90 Å²	90	94.7 Å²	94.7	39%	0.391	47%	0.469	S	S	.	.	H	α-helix	trans	-61	-47.3	173.6	-74.3	178.5	178	170.4	0	111.4	A372 E373 V429 E430 R435 Q436 M437	A372-K433 HydrophobicContact CB-CG 3.7Å; E373-K433 WeakPolarHBondContact OE1-CE 3.34Å; E373-K433 IonicContact OE1-NZ 2.79Å; E373-K433 PolarHBondContact OE1-NZ 3.18Å; V429-K433 HydrophobicContact CG1-CD 4.23Å; V429-K433 WeakPolarHBondContact O-CG 3.43Å; V429-K433 PolarHBondContact O-N 3.45Å; E430-K433 PolarHBondContact O-N 3Å; K433-R435 VanDerWaalsContact C-N 3.34Å; K433-R435 PolarHBondContact O-N 3.45Å; K433-Q436 PolarHBondContact O-N 3.17Å; K433-M437 WeakPolarHBondContact O-CG 3.29Å; K433-M437 PolarHBondContact O-N 3Å
434	R	89.6	Confident	86.3	Confident	172 Å²	172	96.9 Å²	96.9	65%	0.649	48%	0.475	S	S	*	.	H	α-helix	trans	-60	-43.5	175.6	-72.5	179.8	-174.7	172	5.4	111.7	E430 L431 Q436 M437 E438	E430-R434 WeakPolarHBondContact O-CG 3.33Å; E430-R434 PolarHBondContact O-N 3.31Å; L431-R434 PolarHBondContact O-N 3.14Å; R434-Q436 VanDerWaalsContact C-N 3.34Å; R434-Q436 PolarHBondContact O-N 3.01Å; R434-M437 WeakPolarHBondContact O-CB 3.33Å; R434-M437 PolarHBondContact O-N 3.2Å; R434-E438 PolarHBondContact O-N 3.18Å
435	R	87.4	Confident	86.1	Confident	150 Å²	150	104 Å²	104	57%	0.566	51%	0.505	S	S	*	.	H	α-helix	trans	-60.6	-42.1	176.7	-171.5	176	-176.9	170.5	2	112.3	L431 Y432 K433 E438 I439	L431-R435 WeakPolarHBondContact O-CB 3.44Å; L431-R435 PolarHBondContact O-N 3.4Å; Y432-R435 PolarHBondContact O-N 2.89Å; K433-R435 VanDerWaalsContact C-N 3.34Å; K433-R435 PolarHBondContact O-N 3.45Å; R435-E438 PolarHBondContact O-N 3.2Å; R435-I439 HydrophobicContact CG-CD1 4.3Å; R435-I439 VanDerWaalsContact O-CG1 3.32Å; R435-I439 WeakPolarHBondContact O-CG1 3.4Å; R435-I439 PolarHBondContact O-N 3.44Å
436	Q	85.1	Confident	85.8	Confident	54 Å²	54	108 Å²	108	25%	0.252	51%	0.514	S	S	.	.	H	α-helix	trans	-66.5	-40.7	176.8	-169	64	51.5	0	0	111.8	Y432 K433 R434 E438 I439 N440	Y432-Q436 PolarHBondContact O-N 3.32Å; K433-Q436 PolarHBondContact O-N 3.17Å; R434-Q436 VanDerWaalsContact C-N 3.34Å; R434-Q436 PolarHBondContact O-N 3.01Å; Q436-E438 VanDerWaalsContact C-N 3.34Å; Q436-E438 PolarHBondContact O-N 3.33Å; Q436-I439 PolarHBondContact O-N 2.88Å; Q436-N440 PolarHBondContact NE2-OD1 3.38Å; Q436-N440 WeakPolarHBondContact O-CB 3.42Å; Q436-N440 PolarHBondContact O-N 3.25Å; Q436-N440 PolarHBondContact O-OD1 3.14Å
437	M	84.1	Confident	85.7	Confident	132 Å²	132	103.8 Å²	103.8	65%	0.65	50%	0.502	S	S	*	.	H	α-helix	trans	-60.9	-42.9	174.6	-69.6	173	-177.8	0	0	111.7	K433 R434 N440 A441	K433-M437 WeakPolarHBondContact O-CG 3.29Å; K433-M437 PolarHBondContact O-N 3Å; R434-M437 WeakPolarHBondContact O-CB 3.33Å; R434-M437 PolarHBondContact O-N 3.2Å; M437-N440 PolarHBondContact O-N 3.35Å; M437-A441 WeakPolarHBondContact O-CB 3.43Å; M437-A441 PolarHBondContact O-N 3.46Å
438	E	85.5	Confident	85.4	Confident	105 Å²	105	99.1 Å²	99.1	49%	0.491	48%	0.484	S	S	.	.	H	α-helix	trans	-62.4	-44	176.8	-165.4	-163.3	154.3	0	0	111.6	R434 R435 Q436 N440 A441 R442	R434-E438 PolarHBondContact O-N 3.18Å; R435-E438 PolarHBondContact O-N 3.2Å; Q436-E438 VanDerWaalsContact C-N 3.34Å; Q436-E438 PolarHBondContact O-N 3.33Å; E438-N440 VanDerWaalsContact C-N 3.32Å; E438-N440 PolarHBondContact O-N 3.42Å; E438-A441 PolarHBondContact O-N 2.84Å; E438-R442 WeakPolarHBondContact O-CG 3.41Å; E438-R442 PolarHBondContact O-N 3.13Å; E438-R442 VanDerWaalsContact O-N 3.14Å; E438-R442 IonicContact OE1-CZ 2.96Å; E438-R442 IonicContact OE1-NE 3.86Å; E438-R442 IonicContact OE1-NH2 2.73Å; E438-R442 PolarHBondContact OE1-NH2 3.38Å
439	I	80.2	Confident	85.6	Confident	81 Å²	81	101.9 Å²	101.9	42%	0.415	49%	0.492	S	S	.	.	H	α-helix	trans	-60.7	-43.3	175.9	-69.7	166.7	0	0	0	110.8	R435 Q436 A441 R442	R435-I439 HydrophobicContact CG-CD1 4.3Å; R435-I439 VanDerWaalsContact O-CG1 3.32Å; R435-I439 WeakPolarHBondContact O-CG1 3.4Å; R435-I439 PolarHBondContact O-N 3.44Å; Q436-I439 PolarHBondContact O-N 2.88Å; I439-A441 VanDerWaalsContact C-N 3.32Å; I439-A441 PolarHBondContact O-N 3.43Å; I439-R442 PolarHBondContact O-N 2.92Å
440	N	82.4	Confident	85.6	Confident	116 Å²	116	103.8 Å²	103.8	62%	0.62	51%	0.509	S	S	*	.	H	α-helix	trans	-69.2	-29.6	179.1	-67.6	-8.6	0	0	0	112.6	Q436 M437 E438	Q436-N440 PolarHBondContact NE2-OD1 3.38Å; Q436-N440 WeakPolarHBondContact O-CB 3.42Å; Q436-N440 PolarHBondContact O-N 3.25Å; Q436-N440 PolarHBondContact O-OD1 3.14Å; M437-N440 PolarHBondContact O-N 3.35Å; E438-N440 VanDerWaalsContact C-N 3.32Å; E438-N440 PolarHBondContact O-N 3.42Å
441	A	85.4	Confident	85.4	Confident	83 Å²	83	107.1 Å²	107.1	69%	0.686	52%	0.523	S	S	*	.	H	α-helix	trans	-76.7	-21.3	176.6	0	0	0	0	0	113.1	M437 E438 I439	M437-A441 WeakPolarHBondContact O-CB 3.43Å; M437-A441 PolarHBondContact O-N 3.46Å; E438-A441 PolarHBondContact O-N 2.84Å; I439-A441 VanDerWaalsContact C-N 3.32Å; I439-A441 PolarHBondContact O-N 3.43Å
442	R	83.8	Confident	85.2	Confident	153 Å²	153	106.8 Å²	106.8	58%	0.577	52%	0.52	S	S	*	.	S	Bend	trans	-67.3	130.9	178.4	-74.2	168.9	-173	-163.9	1.3	110.1	E438 I439 I444	E438-R442 WeakPolarHBondContact O-CG 3.41Å; E438-R442 PolarHBondContact O-N 3.13Å; E438-R442 VanDerWaalsContact O-N 3.14Å; E438-R442 IonicContact OE1-CZ 2.96Å; E438-R442 IonicContact OE1-NE 3.86Å; E438-R442 IonicContact OE1-NH2 2.73Å; E438-R442 PolarHBondContact OE1-NH2 3.38Å; I439-R442 PolarHBondContact O-N 2.92Å; R442-I444 PolarHBondContact O-N 2.91Å
443	P	85.9	Confident	85	Confident	87 Å²	87	112.4 Å²	112.4	57%	0.565	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-67	138.4	178.1	27.6	-34.3	0	0	0	110.8	K445 V448	P443-K445 PolarHBondContact O-N 3.42Å; P443-V448 HydrophobicContact CB-CG2 3.59Å; P443-V448 HydrophobicContact CG-CG2 3.47Å; P443-V448 VanDerWaalsContact CG-CG2 3.47Å
444	I	82	Confident	84.8	Confident	121 Å²	121	115.6 Å²	115.6	62%	0.621	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-58	133.3	176.1	-62.8	169.9	0	0	0	109.1	R442 K446 V447 V448	R442-I444 PolarHBondContact O-N 2.91Å; I444-K446 HydrophobicContact CG2-CB 4.27Å; I444-K446 PolarHBondContact O-N 3.41Å; I444-K446 VanDerWaalsContact O-N 3.08Å; I444-V447 HydrophobicContact CB-CB 4.48Å; I444-V447 HydrophobicContact CB-CG2 4.06Å; I444-V447 WeakPolarHBondContact O-CA 3.5Å; I444-V447 WeakPolarHBondContact O-CB 3.37Å; I444-V447 PolarHBondContact O-N 3.49Å; I444-V448 PolarHBondContact O-N 3.49Å
445	K	79.5	Confident	84.5	Confident	175 Å²	175	114.3 Å²	114.3	76%	0.761	55%	0.554	S	S	*	*	H	α-helix	trans	-48	-42.1	-178.1	-173.9	179.5	178.3	-178.3	0	113	P443 V447 V448 E449	P443-K445 PolarHBondContact O-N 3.42Å; K445-V447 PolarHBondContact O-N 2.99Å; K445-V448 PolarHBondContact O-N 2.99Å; K445-E449 WeakPolarHBondContact O-CB 3.34Å; K445-E449 PolarHBondContact O-N 2.91Å
446	K	80.7	Confident	84.3	Confident	170 Å²	170	116 Å²	116	74%	0.739	56%	0.56	S	S	*	*	H	α-helix	trans	-61.5	-38.8	176	-68.5	-173.6	178.2	-179.2	0	113	I444 E449 A450	I444-K446 HydrophobicContact CG2-CB 4.27Å; I444-K446 PolarHBondContact O-N 3.41Å; I444-K446 VanDerWaalsContact O-N 3.08Å; K446-E449 PolarHBondContact O-N 3.44Å; K446-A450 VanDerWaalsContact O-CB 3.3Å; K446-A450 WeakPolarHBondContact O-CB 3.45Å; K446-A450 PolarHBondContact O-N 2.93Å
447	V	84.1	Confident	84.1	Confident	71 Å²	71	122 Å²	122	43%	0.43	58%	0.58	S	S	.	*	H	α-helix	trans	-70.1	-41.5	177.5	177.8	0	0	0	0	110.5	I444 K445 A450 K451	I444-V447 HydrophobicContact CB-CB 4.48Å; I444-V447 HydrophobicContact CB-CG2 4.06Å; I444-V447 WeakPolarHBondContact O-CA 3.5Å; I444-V447 WeakPolarHBondContact O-CB 3.37Å; I444-V447 PolarHBondContact O-N 3.49Å; K445-V447 PolarHBondContact O-N 2.99Å; V447-A450 PolarHBondContact O-N 3.04Å; V447-K451 WeakPolarHBondContact O-CB 3.4Å; V447-K451 WeakPolarHBondContact O-CG 3.38Å; V447-K451 PolarHBondContact O-N 3.43Å
448	V	81.6	Confident	84.1	Confident	59 Å²	59	119.6 Å²	119.6	36%	0.358	57%	0.573	S	S	.	*	H	α-helix	trans	-61.4	-46.9	173.3	-178.6	0	0	0	0	110.3	P443 I444 K445 A450 K451 M452	P443-V448 HydrophobicContact CB-CG2 3.59Å; P443-V448 HydrophobicContact CG-CG2 3.47Å; P443-V448 VanDerWaalsContact CG-CG2 3.47Å; I444-V448 PolarHBondContact O-N 3.49Å; K445-V448 PolarHBondContact O-N 2.99Å; V448-A450 PolarHBondContact O-N 3.27Å; V448-K451 PolarHBondContact O-N 3.26Å; V448-M452 HydrophobicContact CG1-CG 4.35Å; V448-M452 WeakPolarHBondContact O-CB 3.4Å; V448-M452 VanDerWaalsContact O-CG 3.24Å; V448-M452 WeakPolarHBondContact O-CG 3.43Å; V448-M452 PolarHBondContact O-N 3.18Å
449	E	89.6	Confident	83.6	Confident	87 Å²	87	121.7 Å²	121.7	41%	0.407	58%	0.581	S	S	.	*	H	α-helix	trans	-61.3	-44.3	178.2	-169.8	-177.1	164.7	0	0	111.7	K445 K446 M452 R453	K445-E449 WeakPolarHBondContact O-CB 3.34Å; K445-E449 PolarHBondContact O-N 2.91Å; K446-E449 PolarHBondContact O-N 3.44Å; E449-M452 PolarHBondContact O-N 3.02Å; E449-R453 WeakPolarHBondContact O-CG 3.36Å; E449-R453 PolarHBondContact O-N 3.02Å; E449-R453 IonicContact OE1-CZ 3.64Å; E449-R453 IonicContact OE1-NE 3.8Å; E449-R453 PolarHBondContact OE1-NE 3.14Å; E449-R453 IonicContact OE1-NH2 2.74Å; E449-R453 PolarHBondContact OE1-NH2 3.37Å
450	A	88.9	Confident	83.3	Confident	58 Å²	58	126 Å²	126	48%	0.479	60%	0.596	S	S	.	*	H	α-helix	trans	-61.8	-44.1	175.3	0	0	0	0	0	112	K446 V447 V448 M452 R453 K454	K446-A450 VanDerWaalsContact O-CB 3.3Å; K446-A450 WeakPolarHBondContact O-CB 3.45Å; K446-A450 PolarHBondContact O-N 2.93Å; V447-A450 PolarHBondContact O-N 3.04Å; V448-A450 PolarHBondContact O-N 3.27Å; A450-M452 VanDerWaalsContact C-N 3.33Å; A450-M452 PolarHBondContact O-N 3.02Å; A450-R453 PolarHBondContact O-N 3.21Å; A450-K454 PolarHBondContact O-N 3.14Å
451	K	86	Confident	83	Confident	141 Å²	141	127.3 Å²	127.3	61%	0.613	60%	0.602	S	S	*	*	H	α-helix	trans	-59.9	-42.4	173.7	-81.1	-175.7	176.5	-178.6	0	111.6	V447 V448 K454 K455	V447-K451 WeakPolarHBondContact O-CB 3.4Å; V447-K451 WeakPolarHBondContact O-CG 3.38Å; V447-K451 PolarHBondContact O-N 3.43Å; V448-K451 PolarHBondContact O-N 3.26Å; K451-K454 PolarHBondContact O-N 3.12Å; K451-K455 PolarHBondContact O-N 3.16Å
452	M	86.5	Confident	82.1	Confident	103 Å²	103	128.8 Å²	128.8	51%	0.507	60%	0.602	S	S	.	*	H	α-helix	trans	-67.8	-40.6	178.1	-69.9	-66.1	-81.5	0	0	112.1	V448 E449 A450 K455 R456	V448-M452 HydrophobicContact CG1-CG 4.35Å; V448-M452 WeakPolarHBondContact O-CB 3.4Å; V448-M452 VanDerWaalsContact O-CG 3.24Å; V448-M452 WeakPolarHBondContact O-CG 3.43Å; V448-M452 PolarHBondContact O-N 3.18Å; E449-M452 PolarHBondContact O-N 3.02Å; A450-M452 VanDerWaalsContact C-N 3.33Å; A450-M452 PolarHBondContact O-N 3.02Å; M452-K455 PolarHBondContact O-N 2.85Å; M452-R456 WeakPolarHBondContact O-CG 3.26Å; M452-R456 PolarHBondContact O-N 3.01Å
453	R	86.3	Confident	80.5	Confident	153 Å²	153	130.9 Å²	130.9	58%	0.577	62%	0.624	S	S	*	*	H	α-helix	trans	-61.4	-43	172.6	-75	-175.4	-172.9	-162.8	3.5	111.4	E449 A450 R456 R457	E449-R453 WeakPolarHBondContact O-CG 3.36Å; E449-R453 PolarHBondContact O-N 3.02Å; E449-R453 IonicContact OE1-CZ 3.64Å; E449-R453 IonicContact OE1-NE 3.8Å; E449-R453 PolarHBondContact OE1-NE 3.14Å; E449-R453 IonicContact OE1-NH2 2.74Å; E449-R453 PolarHBondContact OE1-NH2 3.37Å; A450-R453 PolarHBondContact O-N 3.21Å; R453-R456 PolarHBondContact O-N 3.42Å; R453-R457 WeakPolarHBondContact O-CG 3.4Å; R453-R457 PolarHBondContact O-N 2.89Å
454	K	86.7	Confident	80.3	Confident	156 Å²	156	133.1 Å²	133.1	68%	0.678	63%	0.627	S	S	*	*	H	α-helix	trans	-62.8	-46.6	175.9	-166.9	173.5	-178	177.4	0	111.4	A450 K451 R456 R457 V458	A450-K454 PolarHBondContact O-N 3.14Å; K451-K454 PolarHBondContact O-N 3.12Å; K454-R456 VanDerWaalsContact C-N 3.33Å; K454-R456 PolarHBondContact O-N 2.85Å; K454-R457 PolarHBondContact O-N 3.41Å; K454-V458 WeakPolarHBondContact O-CG2 3.4Å; K454-V458 PolarHBondContact O-N 3.43Å
455	K	83	Confident	80.2	Confident	145 Å²	145	133.7 Å²	133.7	63%	0.63	63%	0.627	S	S	*	*	H	α-helix	trans	-58	-42	174	-79.9	-173.3	175.2	-174.4	0	112.6	K451 M452 V458 K459	K451-K455 PolarHBondContact O-N 3.16Å; M452-K455 PolarHBondContact O-N 2.85Å; K455-V458 PolarHBondContact O-N 2.84Å; K455-K459 PolarHBondContact O-N 3.31Å
456	R	82.9	Confident	80.2	Confident	186 Å²	186	131.4 Å²	131.4	70%	0.702	62%	0.62	S	S	*	*	H	α-helix	trans	-64.5	-38.2	176.2	-77.4	-177	176.7	-165.5	-0.9	112.5	M452 R453 K454 K460	M452-R456 WeakPolarHBondContact O-CG 3.26Å; M452-R456 PolarHBondContact O-N 3.01Å; R453-R456 PolarHBondContact O-N 3.42Å; K454-R456 VanDerWaalsContact C-N 3.33Å; K454-R456 PolarHBondContact O-N 2.85Å; R456-K460 PolarHBondContact O-N 3.25Å; R456-K460 VanDerWaalsContact O-N 3.14Å
457	R	82.1	Confident	80.2	Confident	179 Å²	179	129.2 Å²	129.2	68%	0.675	61%	0.613	S	S	*	*	H	α-helix	trans	-65.9	-45.8	175.1	-72.2	-176.4	-170.2	-162.1	1.9	111.8	R453 K454 K459 K460 I461	R453-R457 WeakPolarHBondContact O-CG 3.4Å; R453-R457 PolarHBondContact O-N 2.89Å; K454-R457 PolarHBondContact O-N 3.41Å; R457-K459 VanDerWaalsContact C-N 3.33Å; R457-K459 PolarHBondContact O-N 2.92Å; R457-K460 PolarHBondContact O-N 3.18Å; R457-K460 VanDerWaalsContact O-N 3.14Å; R457-I461 WeakPolarHBondContact O-CG1 3.34Å; R457-I461 PolarHBondContact O-N 2.99Å
458	V	83.7	Confident	79.9	Confident	83 Å²	83	132.8 Å²	132.8	50%	0.503	62%	0.624	S	S	.	*	H	α-helix	trans	-59.1	-46.4	176.7	175.9	0	0	0	0	110.5	K454 K455 K460 I461 T462	K454-V458 WeakPolarHBondContact O-CG2 3.4Å; K454-V458 PolarHBondContact O-N 3.43Å; K455-V458 PolarHBondContact O-N 2.84Å; V458-K460 VanDerWaalsContact C-N 3.27Å; V458-K460 PolarHBondContact O-N 2.92Å; V458-I461 PolarHBondContact O-N 2.87Å; V458-T462 PolarHBondContact O-N 3.24Å; V458-T462 VanDerWaalsContact O-N 3.14Å; V458-T462 PolarHBondContact O-OG1 3.12Å
459	K	75	Confident	79.8	Confident	149 Å²	149	137.7 Å²	137.7	65%	0.648	64%	0.642	S	S	*	*	H	α-helix	trans	-58.2	-35.8	176.4	-79.5	-169.4	174.6	-165.7	0	113.7	K455 R457 I461 T462 L463	K455-K459 PolarHBondContact O-N 3.31Å; R457-K459 VanDerWaalsContact C-N 3.33Å; R457-K459 PolarHBondContact O-N 2.92Å; K459-I461 VanDerWaalsContact C-N 3.31Å; K459-T462 WeakPolarHBondContact CA-OG1 3.36Å; K459-T462 PolarHBondContact O-OG1 3.25Å; K459-T462 VanDerWaalsContact O-OG1 3.12Å; K459-L463 PolarHBondContact O-N 2.97Å
460	K	74.4	Confident	79.1	Confident	172 Å²	172	141.4 Å²	141.4	75%	0.748	66%	0.659	S	S	*	*	H	α-helix	trans	-74.1	-17.1	176.7	-82	-169	175	-165.6	0	114.3	R456 R457 V458	R456-K460 PolarHBondContact O-N 3.25Å; R456-K460 VanDerWaalsContact O-N 3.14Å; R457-K460 PolarHBondContact O-N 3.18Å; R457-K460 VanDerWaalsContact O-N 3.14Å; V458-K460 VanDerWaalsContact C-N 3.27Å; V458-K460 PolarHBondContact O-N 2.92Å
461	I	75.9	Confident	78.4	Confident	142 Å²	142	147.8 Å²	147.8	73%	0.728	67%	0.673	S	S	*	*	H	α-helix	trans	-91.8	-29.6	178.3	-65.5	167.5	0	0	0	110.3	R457 V458 K459	R457-I461 WeakPolarHBondContact O-CG1 3.34Å; R457-I461 PolarHBondContact O-N 2.99Å; V458-I461 PolarHBondContact O-N 2.87Å; K459-I461 VanDerWaalsContact C-N 3.31Å
462	T	65	Low	77.7	Confident	114 Å²	114	148.3 Å²	148.3	70%	0.699	68%	0.678	S	S	*	*			trans	-83.1	-11.2	176.1	42	0	0	0	0	114.7	V458 K459	V458-T462 PolarHBondContact O-N 3.24Å; V458-T462 VanDerWaalsContact O-N 3.14Å; V458-T462 PolarHBondContact O-OG1 3.12Å; K459-T462 WeakPolarHBondContact CA-OG1 3.36Å; K459-T462 PolarHBondContact O-OG1 3.25Å; K459-T462 VanDerWaalsContact O-OG1 3.12Å
463	L	51.5	Low	76.9	Confident	198 Å²	198	152.5 Å²	152.5	100%	1.037	69%	0.693	S	S	*	*			trans	-101.4	0	169.6	-88.1	157.6	0	0	0	107.5	K459	K459-L463 PolarHBondContact O-N 2.97Å

Retrieved 463 of 463 residues in 76.7 ms (Link to these results)

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