A0A077ZD02_TRITR Loading...

RRM 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZD02, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 473 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	33.4	Very low	29.9	Very low	217 Å²	217	169.1 Å²	169.1	100%	1.069	78%	0.783	S	S	*	*				0	50.5	0	-57.4	-172.2	-162.5	0	0	109.6
2	E	30.9	Very low	30.1	Very low	154 Å²	154	158.7 Å²	158.7	72%	0.72	74%	0.743	S	S	*	*				85.6	83.6	70.6	-77.1	143	-126.9	0	0	111.1
3	R	27.7	Very low	30.2	Very low	238 Å²	238	154.2 Å²	154.2	90%	0.898	73%	0.727	S	S	*	*				58.9	57.5	88	-66.5	-168	-172.7	178.6	3.4	114.7
4	Y	29.2	Very low	30.3	Very low	203 Å²	203	147.8 Å²	147.8	80%	0.796	70%	0.699	S	S	*	*			trans	-153.1	73.1	164.1	-79	-77.6	0	0	0	112.3
5	W	29.5	Very low	30.5	Very low	255 Å²	255	146.1 Å²	146.1	97%	0.966	70%	0.695	S	S	*	*			trans	-147.5	2.2	161	-84.4	100.9	0	0	0	114.1	L7	W5-L7 PolarHBondContact O-N 3.45Å
6	Y	27	Very low	30.6	Very low	218 Å²	218	145.3 Å²	145.3	86%	0.855	69%	0.694	S	S	*	*			trans	-97.6	83.9	176.3	-81.7	-90	0	0	0	110.6
7	L	26.4	Very low	30.4	Very low	161 Å²	161	142.5 Å²	142.5	84%	0.843	69%	0.692	S	S	*	*			trans	-162.4	124.5	158.4	-109.6	126.3	0	0	0	110.2	W5	W5-L7 PolarHBondContact O-N 3.45Å
8	C	26.9	Very low	30.4	Very low	106 Å²	106	147.1 Å²	147.1	72%	0.716	70%	0.701	S	S	*	*			trans	74.9	77	160.6	-71.4	0	0	0	0	119.3
9	L	30.8	Very low	30.3	Very low	145 Å²	145	150.9 Å²	150.9	76%	0.759	71%	0.708	S	S	*	*			trans	-128.7	70.7	143.4	-76.3	172.4	0	0	0	108.4	P53	L9-P53 HydrophobicContact CD2-CG 4.35Å
10	A	31.8	Very low	30.4	Very low	42 Å²	42	148.8 Å²	148.8	35%	0.347	71%	0.71	S	S	.	*			trans	-101.6	4.5	-168.7	0	0	0	0	0	115.7	I127	A10-I127 HydrophobicContact CB-CD1 3.84Å
11	N	35.1	Very low	30.3	Very low	121 Å²	121	151.4 Å²	151.4	65%	0.647	72%	0.719	S	S	*	*			trans	-136.3	17.4	-167.2	-78.5	-24.9	0	0	0	117.4	D13 N51	N11-D13 PolarHBondContact O-N 3.27Å; N11-N51 WeakPolarHBondContact CB-ND2 3.32Å; N11-N51 VanDerWaalsContact O-CB 3.29Å; N11-N51 WeakPolarHBondContact O-CB 3.25Å; N11-N51 PolarHBondContact O-ND2 3.3Å
12	C	32.9	Very low	30.3	Very low	44 Å²	44	152 Å²	152	30%	0.297	71%	0.709	S	S	.	*			trans	-86.8	107.6	-179.5	-63.7	0	0	0	0	113.6	N51	C12-N51 PolarHBondContact SG-O 3.21Å
13	D	31	Very low	30.6	Very low	100 Å²	100	153.2 Å²	153.2	54%	0.535	72%	0.715	S	S	.	*			trans	-82.1	127.5	167.8	-78.4	-28.5	0	0	0	111	N11 S50	N11-D13 PolarHBondContact O-N 3.27Å; D13-S50 WeakPolarHBondContact CB-OG 3.42Å; D13-S50 PolarHBondContact O-N 2.87Å; D13-S50 VanDerWaalsContact O-N 3.11Å; D13-S50 PolarHBondContact O-OG 2.81Å
14	I	32.2	Very low	30.9	Very low	65 Å²	65	149.7 Å²	149.7	33%	0.333	71%	0.714	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.4	113.8	171.4	-71.6	172.5	0	0	0	108.5	I16 I49 F118	I14-I16 HydrophobicContact CG2-CG1 4.07Å; I14-I49 HydrophobicContact CD1-CD1 4.44Å; I14-I49 HydrophobicContact CD1-CG1 4.27Å; I14-I49 HydrophobicContact CD1-CG2 4.23Å; I14-I49 HydrophobicContact CG1-CB 4.15Å; I14-I49 HydrophobicContact CG1-CG1 3.97Å; I14-I49 HydrophobicContact CG1-CG2 3.56Å; I14-F118 HydrophobicContact CD1-CE1 3.99Å; I14-F118 HydrophobicContact CD1-CE2 4.32Å; I14-F118 HydrophobicContact CD1-CZ 3.47Å; I14-F118 VanDerWaalsContact CD1-CZ 3.47Å
15	L	32	Very low	31.2	Very low	123 Å²	123	149 Å²	149	64%	0.644	72%	0.715	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.7	105.2	174.2	-100.8	150.1	0	0	0	109.4	C17	L15-C17 PolarHBondContact O-N 3.08Å
16	I	32.2	Very low	31.5	Very low	132 Å²	132	148.6 Å²	148.6	68%	0.677	71%	0.713	S	S	*	*			trans	-87.4	96.4	168.3	-59.2	174.1	0	0	0	107.8	I14 R18	I14-I16 HydrophobicContact CG2-CG1 4.07Å; I16-R18 PolarHBondContact O-N 3.21Å
17	C	27.8	Very low	31.8	Very low	99 Å²	99	142.6 Å²	142.6	67%	0.669	71%	0.709	S	S	*	*			trans	-82.6	96.5	178.1	-148.7	0	0	0	0	110.2	L15 R19	L15-C17 PolarHBondContact O-N 3.08Å; C17-R19 PolarHBondContact O-N 2.94Å
18	R	29.5	Very low	32.3	Very low	225 Å²	225	146.3 Å²	146.3	85%	0.849	71%	0.712	S	S	*	*			trans	-86.6	86.6	169.3	-122.4	-174.2	-177.9	-173.6	1.7	108.7	I16 S20	I16-R18 PolarHBondContact O-N 3.21Å; R18-S20 PolarHBondContact O-N 3.14Å; R18-S20 VanDerWaalsContact O-N 3.16Å
19	R	30.3	Very low	32.8	Very low	220 Å²	220	146.2 Å²	146.2	83%	0.83	71%	0.713	S	S	*	*			trans	-80	89.8	166	-108.5	-179.5	-179.7	-169.9	0.3	108.4	C17 F21	C17-R19 PolarHBondContact O-N 2.94Å; R19-F21 PolarHBondContact O-N 2.98Å
20	S	31.8	Very low	33.2	Very low	107 Å²	107	150.9 Å²	150.9	75%	0.748	72%	0.72	S	S	*	*			trans	-67.6	96.1	167.9	-74.3	0	0	0	0	109.5	R18 R22	R18-S20 PolarHBondContact O-N 3.14Å; R18-S20 VanDerWaalsContact O-N 3.16Å; S20-R22 PolarHBondContact O-N 3.37Å
21	F	27.8	Very low	33.6	Very low	205 Å²	205	154 Å²	154	90%	0.899	74%	0.739	S	S	*	*			trans	-73.3	109.3	164.3	-140.1	-96.1	0	0	0	107.6	R19 E23	R19-F21 PolarHBondContact O-N 2.98Å; F21-E23 PolarHBondContact O-N 3.06Å
22	R	34.4	Very low	33.6	Very low	228 Å²	228	154.8 Å²	154.8	86%	0.86	75%	0.751	S	S	*	*			trans	-74.5	97	-178.2	-162	175.3	-177.5	-176.1	-0.1	108.2	S20 N24	S20-R22 PolarHBondContact O-N 3.37Å; R22-N24 PolarHBondContact O-N 3.42Å; R22-N24 VanDerWaalsContact O-N 3.11Å
23	E	37.1	Very low	33.9	Very low	181 Å²	181	164.1 Å²	164.1	85%	0.846	78%	0.78	S	S	*	*			trans	-66.4	103.9	179.8	-156.7	169	-165.9	0	0	110.2	F21 K25	F21-E23 PolarHBondContact O-N 3.06Å; E23-K25 PolarHBondContact O-N 3.45Å; E23-K25 VanDerWaalsContact O-N 3.11Å
24	N	32.5	Very low	34.5	Very low	163 Å²	163	170.2 Å²	170.2	87%	0.872	80%	0.796	S	S	*	*			trans	-79	98.1	179.9	-147.8	4.2	0	0	0	108.9	R22 R26	R22-N24 PolarHBondContact O-N 3.42Å; R22-N24 VanDerWaalsContact O-N 3.11Å; N24-R26 PolarHBondContact O-N 3.29Å
25	K	35.4	Very low	34.6	Very low	190 Å²	190	173.2 Å²	173.2	83%	0.826	82%	0.819	S	S	*	*			trans	-60.4	114.5	172.7	-70.5	-179.2	-179.9	178.7	0	110.1	E23	E23-K25 PolarHBondContact O-N 3.45Å; E23-K25 VanDerWaalsContact O-N 3.11Å
26	R	37.6	Very low	34.9	Very low	245 Å²	245	175.2 Å²	175.2	93%	0.925	83%	0.83	S	S	*	*			trans	-150.8	103.2	144.6	-107.5	161.7	-163.9	-171.1	4.3	110.1	N24	N24-R26 PolarHBondContact O-N 3.29Å
27	A	32.1	Very low	34.8	Very low	93 Å²	93	178.3 Å²	178.3	77%	0.769	84%	0.843	S	S	*	*			trans	-60.4	146.1	173.1	0	0	0	0	0	111.7
28	R	37.8	Very low	35	Very low	238 Å²	238	176.4 Å²	176.4	90%	0.898	84%	0.841	S	S	*	*			trans	-163.8	95.9	138.3	-103.4	158.6	-169.4	-166	3.5	110.6
29	S	36.3	Very low	35.4	Very low	105 Å²	105	175 Å²	175	73%	0.734	84%	0.836	S	S	*	*			trans	52.5	104.8	133	-39.2	0	0	0	0	118.9
30	R	38.8	Very low	35.7	Very low	242 Å²	242	172.9 Å²	172.9	91%	0.913	84%	0.835	S	S	*	*				-176.3	111.7	129.8	-97.6	155.1	-170.2	-148.2	3.7	111.8
31	S	40.3	Very low	36.3	Very low	108 Å²	108	173.9 Å²	173.9	76%	0.755	83%	0.831	S	S	*	*			trans	66.6	121.7	149.6	-51.7	0	0	0	0	120	R33	S31-R33 PolarHBondContact O-N 3.14Å
32	P	35.5	Very low	36.9	Very low	137 Å²	137	167.7 Å²	167.7	89%	0.89	81%	0.808	S	S	*	*			trans	-81.2	114.1	-177.3	31.7	-30.3	0	0	0	111.5
33	R	39.7	Very low	37.8	Very low	241 Å²	241	161.2 Å²	161.2	91%	0.909	80%	0.798	S	S	*	*			trans	-118.1	132.4	160.3	-73.8	-167.3	175.7	-172	0.5	108.8	S31	S31-R33 PolarHBondContact O-N 3.14Å
34	R	43.8	Very low	38.6	Very low	228 Å²	228	158.3 Å²	158.3	86%	0.86	79%	0.788	S	S	*	*			trans	-43.3	133.6	-173.5	-66.1	173.6	176.1	179.8	-2.5	111.8	L36	R34-L36 PolarHBondContact O-N 2.68Å
35	P	34.8	Very low	39.8	Very low	128 Å²	128	154.9 Å²	154.9	83%	0.831	77%	0.765	S	S	*	*			trans	-66	106.4	170.3	-7.4	22.3	0	0	0	107.9	M37	P35-M37 PolarHBondContact O-N 2.88Å
36	L	36.6	Very low	40.9	Very low	164 Å²	164	149.3 Å²	149.3	86%	0.859	74%	0.743	S	S	*	*			trans	-63.7	128.7	161.5	-92.3	96.9	0	0	0	107.2	R34 G38	R34-L36 PolarHBondContact O-N 2.68Å; L36-G38 VanDerWaalsContact C-N 3.27Å; L36-G38 PolarHBondContact O-N 2.9Å
37	M	30.1	Very low	42.1	Very low	197 Å²	197	140.2 Å²	140.2	97%	0.97	72%	0.715	S	S	*	*			trans	-61.6	82.3	177.2	-71.8	179.5	122.6	0	0	111.2	P35	P35-M37 PolarHBondContact O-N 2.88Å
38	G	33.6	Very low	43.2	Very low	60 Å²	60	140.5 Å²	140.5	62%	0.619	70%	0.697	S	S	*	*			trans	-81.1	109.2	154.7	0	0	0	0	0	106.9	L36 E40	L36-G38 VanDerWaalsContact C-N 3.27Å; L36-G38 PolarHBondContact O-N 2.9Å; G38-E40 PolarHBondContact O-N 2.92Å
39	R	37.2	Very low	44.4	Very low	194 Å²	194	130.9 Å²	130.9	73%	0.732	66%	0.663	S	S	*	*			trans	-72.3	78.5	-179.1	-162.6	176.4	-175.7	176.3	0.1	108.3	L41 H94	R39-L41 PolarHBondContact O-N 3.14Å; R39-H94 PolarHBondContact NH2-NE2 3.25Å
40	E	36.8	Very low	45.2	Very low	176 Å²	176	127.2 Å²	127.2	82%	0.822	64%	0.637	S	S	*	*			trans	-51.2	106.8	157.6	-83.2	167.2	147.8	0	0	105.9	G38 N42	G38-E40 PolarHBondContact O-N 2.92Å; E40-N42 PolarHBondContact O-N 3.27Å
41	L	43.7	Very low	45.8	Very low	128 Å²	128	118.9 Å²	118.9	67%	0.67	61%	0.61	S	S	*	*			trans	-65.7	85.7	164.8	-72.6	168.7	0	0	0	104.8	R39 S43 V92	R39-L41 PolarHBondContact O-N 3.14Å; L41-S43 PolarHBondContact O-N 3.41Å; L41-V92 HydrophobicContact CD2-CG2 4.09Å
42	N	41.8	Very low	46.9	Very low	76 Å²	76	114.7 Å²	114.7	41%	0.406	58%	0.579	S	S	.	*			trans	-56.5	110.8	-175.5	-159.3	11.9	0	0	0	106.8	E40 D44 K45	E40-N42 PolarHBondContact O-N 3.27Å; N42-D44 PolarHBondContact ND2-OD2 3.15Å; N42-D44 VanDerWaalsContact ND2-OD2 3.16Å; N42-D44 PolarHBondContact O-N 3.42Å; N42-D44 PolarHBondContact OD1-OD2 3.07Å; N42-K45 PolarHBondContact O-N 3.43Å
43	S	52.4	Low	48.2	Very low	92 Å²	92	110.4 Å²	110.4	64%	0.643	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-54.7	-22.4	-176.8	49.1	0	0	0	0	111.6	L41 K45 M46	L41-S43 PolarHBondContact O-N 3.41Å; S43-K45 PolarHBondContact O-N 2.98Å; S43-K45 VanDerWaalsContact O-N 3.08Å; S43-M46 WeakPolarHBondContact O-CB 3.49Å; S43-M46 PolarHBondContact O-N 2.64Å; S43-M46 VanDerWaalsContact O-N 3.08Å
44	D	54.2	Low	49.2	Very low	120 Å²	120	106 Å²	106	64%	0.642	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-54.7	-19.6	170.6	-66.5	-20.3	0	0	0	115.3	N42	N42-D44 PolarHBondContact ND2-OD2 3.15Å; N42-D44 VanDerWaalsContact ND2-OD2 3.16Å; N42-D44 PolarHBondContact O-N 3.42Å; N42-D44 PolarHBondContact OD1-OD2 3.07Å
45	K	56.8	Low	50.5	Low	90 Å²	90	101 Å²	101	39%	0.391	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-103.8	-1.2	-179.2	-64.1	179	-175.3	174	0	113.4	N42 S43 F91 V92 Y93	N42-K45 PolarHBondContact O-N 3.43Å; S43-K45 PolarHBondContact O-N 2.98Å; S43-K45 VanDerWaalsContact O-N 3.08Å; K45-F91 CarbonylContact C-O 3.56Å; K45-V92 HydrophobicContact CB-CG1 3.93Å; K45-V92 HydrophobicContact CD-CG1 4.15Å; K45-V92 WeakPolarHBondContact O-CA 3.4Å; K45-Y93 PolarHBondContact O-N 3.28Å
46	M	59.7	Low	52.1	Low	74 Å²	74	96.1 Å²	96.1	37%	0.365	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.5	-178.7	-163.7	169.3	169.1	0	0	110.8	S43 Y48 F91	S43-M46 WeakPolarHBondContact O-CB 3.49Å; S43-M46 PolarHBondContact O-N 2.64Å; S43-M46 VanDerWaalsContact O-N 3.08Å; M46-Y48 HydrophobicContact CE-CD1 4.39Å; M46-Y48 HydrophobicContact CE-CE1 3.51Å; M46-Y48 HydrophobicContact CE-CE2 4.15Å; M46-Y48 VanDerWaalsContact CE-OH 3.23Å; M46-Y48 WeakPolarHBondContact CE-OH 3.46Å; M46-Y48 HydrophobicContact CG-CE2 4.03Å; M46-Y48 HydrophobicContact SD-CE2 4.11Å; M46-Y48 PolarHBondContact SD-OH 3.5Å; M46-F91 WeakPolarHBondContact CA-O 3.28Å
47	V	61.3	Low	53.7	Low	54 Å²	54	95.3 Å²	95.3	33%	0.327	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	130.7	172.3	-178.8	0	0	0	0	109.6	F89 G90 F91	V47-F89 VanDerWaalsContact O-CD2 3.28Å; V47-F89 WeakPolarHBondContact O-CD2 3.24Å; V47-F89 WeakPolarHBondContact O-CE2 3.46Å; V47-F89 VanDerWaalsContact O-O 3.11Å; V47-G90 WeakPolarHBondContact O-CA 3.35Å; V47-F91 HydrophobicContact CB-CD2 3.84Å; V47-F91 HydrophobicContact CB-CE2 4.34Å; V47-F91 HydrophobicContact CG1-CD2 4.39Å; V47-F91 HydrophobicContact CG1-CE2 4.41Å; V47-F91 PolarHBondContact N-O 3.05Å; V47-F91 PolarHBondContact O-N 3.43Å
48	Y	57	Low	55.7	Low	99 Å²	99	91.8 Å²	91.8	39%	0.388	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.5	172.1	-61.3	-98.2	0	0	0	109.7	M46 F89	M46-Y48 HydrophobicContact CE-CD1 4.39Å; M46-Y48 HydrophobicContact CE-CE1 3.51Å; M46-Y48 HydrophobicContact CE-CE2 4.15Å; M46-Y48 VanDerWaalsContact CE-OH 3.23Å; M46-Y48 WeakPolarHBondContact CE-OH 3.46Å; M46-Y48 HydrophobicContact CG-CE2 4.03Å; M46-Y48 HydrophobicContact SD-CE2 4.11Å; M46-Y48 PolarHBondContact SD-OH 3.5Å; Y48-F89 WeakPolarHBondContact CA-O 3.49Å; Y48-F89 WeakPolarHBondContact CD1-O 3.36Å; Y48-F89 VanDerWaalsContact CG-O 3.29Å
49	I	62.3	Low	57.9	Low	36 Å²	36	93 Å²	93	19%	0.185	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	143.4	163.4	-39.5	166.1	0	0	0	106.2	I14 F89 F91	I14-I49 HydrophobicContact CD1-CD1 4.44Å; I14-I49 HydrophobicContact CD1-CG1 4.27Å; I14-I49 HydrophobicContact CD1-CG2 4.23Å; I14-I49 HydrophobicContact CG1-CB 4.15Å; I14-I49 HydrophobicContact CG1-CG1 3.97Å; I14-I49 HydrophobicContact CG1-CG2 3.56Å; I49-F89 VanDerWaalsContact CA-CE1 3.5Å; I49-F89 HydrophobicContact CB-CD1 4.48Å; I49-F89 HydrophobicContact CB-CE1 3.31Å; I49-F89 HydrophobicContact CB-CE2 3.53Å; I49-F89 HydrophobicContact CB-CZ 2.86Å; I49-F89 HydrophobicContact CD1-CE1 4.46Å; I49-F89 HydrophobicContact CD1-CE2 3.87Å; I49-F89 HydrophobicContact CD1-CZ 3.38Å; I49-F89 HydrophobicContact CG1-CE1 4.01Å; I49-F89 HydrophobicContact CG1-CE2 3.31Å; I49-F89 HydrophobicContact CG1-CZ 3.02Å; I49-F89 HydrophobicContact CG2-CE1 4.39Å; I49-F89 HydrophobicContact CG2-CZ 4.15Å; I49-F89 WeakPolarHBondContact O-CD1 3.27Å; I49-F89 WeakPolarHBondContact O-CE1 3.38Å; I49-F91 HydrophobicContact CD1-CE2 3.92Å; I49-F91 HydrophobicContact CD1-CZ 4Å; I49-F91 HydrophobicContact CG1-CE2 4.24Å; I49-F91 HydrophobicContact CG1-CZ 4.44Å
50	S	52.5	Low	59.8	Low	27 Å²	27	87.2 Å²	87.2	19%	0.189	43%	0.428	C	S	.	.			trans	-111.8	168	176.9	64	0	0	0	0	110.5	D13	D13-S50 WeakPolarHBondContact CB-OG 3.42Å; D13-S50 PolarHBondContact O-N 2.87Å; D13-S50 VanDerWaalsContact O-N 3.11Å; D13-S50 PolarHBondContact O-OG 2.81Å
51	N	52.3	Low	61.5	Low	68 Å²	68	79.7 Å²	79.7	36%	0.364	39%	0.393	S	S	.	.			trans	61.3	53.8	176.4	-170.9	71	0	0	0	114.1	N11 C12	N11-N51 WeakPolarHBondContact CB-ND2 3.32Å; N11-N51 VanDerWaalsContact O-CB 3.29Å; N11-N51 WeakPolarHBondContact O-CB 3.25Å; N11-N51 PolarHBondContact O-ND2 3.3Å; C12-N51 PolarHBondContact SG-O 3.21Å
52	I	63.8	Low	63	Low	19 Å²	19	76.7 Å²	76.7	10%	0.097	37%	0.374	C	S	.	.			trans	-80.4	134.2	171.1	-57.2	161.2	0	0	0	109.1	V56 L61 F89	I52-V56 HydrophobicContact CG2-CB 3.74Å; I52-V56 HydrophobicContact CG2-CG1 3.95Å; I52-V56 HydrophobicContact CG2-CG2 4.38Å; I52-L61 HydrophobicContact CD1-CD1 4.04Å; I52-L61 HydrophobicContact CD1-CD2 3.7Å; I52-L61 HydrophobicContact CG1-CD1 4.12Å; I52-L61 HydrophobicContact CG2-CD1 4.25Å; I52-F89 HydrophobicContact CD1-CD1 3.49Å; I52-F89 VanDerWaalsContact CD1-CD1 3.49Å; I52-F89 HydrophobicContact CD1-CE1 3.34Å; I52-F89 HydrophobicContact CG1-CD1 4.43Å; I52-F89 HydrophobicContact CG1-CE1 3.87Å
53	P	60.9	Low	64.8	Low	48 Å²	48	77.5 Å²	77.5	31%	0.312	38%	0.379	S	S	.	.			trans	-55.6	140.8	172	-23	32.9	0	0	0	112.6	L9 D55 V56	L9-P53 HydrophobicContact CD2-CG 4.35Å; P53-D55 WeakPolarHBondContact CB-OD1 3.11Å; P53-D55 PolarHBondContact O-N 3.08Å; P53-D55 VanDerWaalsContact O-N 3.14Å; P53-V56 HydrophobicContact CB-CG2 4.02Å; P53-V56 HydrophobicContact CG-CG2 4.19Å; P53-V56 PolarHBondContact O-N 3.17Å; P53-V56 VanDerWaalsContact O-N 3.09Å
54	Y	62.2	Low	65.8	Low	147 Å²	147	77.7 Å²	77.7	58%	0.576	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.3	-174.9	-65.7	-95.1	0	0	0	114.7	S85	Y54-S85 VanDerWaalsContact CE1-CA 3.45Å; Y54-S85 WeakPolarHBondContact CE1-OG 3.48Å; Y54-S85 WeakPolarHBondContact CE2-OG 3.44Å; Y54-S85 WeakPolarHBondContact OH-CB 3.14Å; Y54-S85 PolarHBondContact OH-OG 2.84Å
55	D	69.8	Low	66.6	Low	125 Å²	125	72.7 Å²	72.7	67%	0.668	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-19.6	-178.9	54.3	-41.2	0	0	0	113	P53 R57	P53-D55 WeakPolarHBondContact CB-OD1 3.11Å; P53-D55 PolarHBondContact O-N 3.08Å; P53-D55 VanDerWaalsContact O-N 3.14Å; D55-R57 PolarHBondContact O-N 3.49Å
56	V	69.3	Low	67.4	Low	25 Å²	25	75.5 Å²	75.5	15%	0.152	35%	0.354	C	S	.	.			trans	-77.5	121	-178.8	176.3	0	0	0	0	110.5	I52 P53 E60 L61	I52-V56 HydrophobicContact CG2-CB 3.74Å; I52-V56 HydrophobicContact CG2-CG1 3.95Å; I52-V56 HydrophobicContact CG2-CG2 4.38Å; P53-V56 HydrophobicContact CB-CG2 4.02Å; P53-V56 HydrophobicContact CG-CG2 4.19Å; P53-V56 PolarHBondContact O-N 3.17Å; P53-V56 VanDerWaalsContact O-N 3.09Å; V56-E60 HydrophobicContact CG1-CB 4.09Å; V56-L61 HydrophobicContact CG1-CB 4.07Å; V56-L61 HydrophobicContact CG1-CD1 4.44Å
57	R	69.6	Low	68.1	Low	146 Å²	146	78.5 Å²	78.5	55%	0.551	37%	0.367	S	S	*	.			trans	-84.5	157.1	174.2	-63.3	-179.3	-64.4	160.4	2.9	110.8	D55 M59 E60 L61	D55-R57 PolarHBondContact O-N 3.49Å; R57-M59 PolarHBondContact O-N 3.19Å; R57-E60 IonicContact CZ-OE1 3.21Å; R57-E60 PolarHBondContact N-OE2 3.3Å; R57-E60 IonicContact NE-OE1 2.91Å; R57-E60 PolarHBondContact NE-OE1 2.93Å; R57-E60 IonicContact NH2-OE1 2.75Å; R57-E60 PolarHBondContact NH2-OE1 2.86Å; R57-E60 PolarHBondContact O-N 3Å; R57-L61 PolarHBondContact O-N 2.98Å
58	W	72.6	Confident	68.3	Low	124 Å²	124	83.4 Å²	83.4	47%	0.47	38%	0.384	S	S	.	.	H	α-helix	trans	-53.6	-31.3	177.2	62.3	-89.8	0	0	0	112.9	K62 V75 M77	W58-K62 HydrophobicContact CZ3-CD 4.27Å; W58-K62 WeakPolarHBondContact O-CB 3.18Å; W58-K62 PolarHBondContact O-N 3.09Å; W58-V75 HydrophobicContact CB-CG1 4.33Å; W58-M77 VanDerWaalsContact CA-SD 3.51Å; W58-M77 HydrophobicContact CB-CG 3.92Å; W58-M77 HydrophobicContact CB-SD 3.35Å; W58-M77 WeakPolarHBondContact CB-SD 3.35Å; W58-M77 HydrophobicContact CG-SD 4.28Å; W58-M77 PolarHBondContact N-SD 3.32Å
59	M	79.1	Confident	68.6	Low	86 Å²	86	81.6 Å²	81.6	42%	0.424	39%	0.39	S	S	.	.	H	α-helix	trans	-64.1	-50.8	177.1	-65.2	-179.3	-165.3	0	0	111.1	R57 L61 K62 D63	R57-M59 PolarHBondContact O-N 3.19Å; M59-L61 VanDerWaalsContact C-N 3.34Å; M59-L61 PolarHBondContact O-N 3.1Å; M59-K62 PolarHBondContact O-N 3.21Å; M59-D63 PolarHBondContact O-N 2.89Å
60	E	77.5	Confident	68.8	Low	72 Å²	72	81 Å²	81	34%	0.336	39%	0.392	S	S	.	.	H	α-helix	trans	-62.9	-43.1	179.7	-71	152.4	-149.4	0	0	110.5	V56 R57 K62 D63 L64	V56-E60 HydrophobicContact CG1-CB 4.09Å; R57-E60 IonicContact CZ-OE1 3.21Å; R57-E60 PolarHBondContact N-OE2 3.3Å; R57-E60 IonicContact NE-OE1 2.91Å; R57-E60 PolarHBondContact NE-OE1 2.93Å; R57-E60 IonicContact NH2-OE1 2.75Å; R57-E60 PolarHBondContact NH2-OE1 2.86Å; R57-E60 PolarHBondContact O-N 3Å; E60-K62 PolarHBondContact O-N 2.88Å; E60-D63 PolarHBondContact O-N 2.83Å; E60-L64 WeakPolarHBondContact O-CB 3.49Å; E60-L64 WeakPolarHBondContact O-CD1 3.12Å; E60-L64 PolarHBondContact O-N 3Å
61	L	73.5	Confident	69.7	Low	18 Å²	18	83.6 Å²	83.6	9%	0.094	40%	0.404	C	S	.	.	H	α-helix	trans	-61.1	-44.5	174.2	-167.8	79.9	0	0	0	111.8	I52 V56 R57 M59 D63 L64 V65 V75 F89 F91	I52-L61 HydrophobicContact CD1-CD1 4.04Å; I52-L61 HydrophobicContact CD1-CD2 3.7Å; I52-L61 HydrophobicContact CG1-CD1 4.12Å; I52-L61 HydrophobicContact CG2-CD1 4.25Å; V56-L61 HydrophobicContact CG1-CB 4.07Å; V56-L61 HydrophobicContact CG1-CD1 4.44Å; R57-L61 PolarHBondContact O-N 2.98Å; M59-L61 VanDerWaalsContact C-N 3.34Å; M59-L61 PolarHBondContact O-N 3.1Å; L61-D63 VanDerWaalsContact C-N 3.33Å; L61-D63 PolarHBondContact O-N 2.6Å; L61-L64 PolarHBondContact O-N 3.48Å; L61-V65 WeakPolarHBondContact O-CG2 3.45Å; L61-V65 PolarHBondContact O-N 2.85Å; L61-V75 HydrophobicContact CD2-CG1 4.3Å; L61-F89 HydrophobicContact CD2-CD1 4.35Å; L61-F89 HydrophobicContact CD2-CE1 4.15Å; L61-F89 HydrophobicContact CD2-CZ 4.37Å; L61-F91 HydrophobicContact CD2-CE1 4.29Å
62	K	75.2	Confident	70.4	Confident	64 Å²	64	80.8 Å²	80.8	28%	0.278	39%	0.389	S	S	.	.	H	α-helix	trans	-62.5	-42	178.6	-172.1	176.1	-179.2	178.6	0	111.1	W58 M59 E60 V65 R66 V72 V75	W58-K62 HydrophobicContact CZ3-CD 4.27Å; W58-K62 WeakPolarHBondContact O-CB 3.18Å; W58-K62 PolarHBondContact O-N 3.09Å; M59-K62 PolarHBondContact O-N 3.21Å; E60-K62 PolarHBondContact O-N 2.88Å; K62-V65 PolarHBondContact O-N 3.4Å; K62-R66 WeakPolarHBondContact O-CB 3.33Å; K62-R66 PolarHBondContact O-N 2.95Å; K62-V72 HydrophobicContact CG-CB 4.2Å; K62-V72 HydrophobicContact CG-CG1 4.28Å; K62-V75 HydrophobicContact CB-CG2 3.97Å; K62-V75 HydrophobicContact CD-CG2 4.2Å; K62-V75 HydrophobicContact CG-CG2 3.94Å
63	D	78.2	Confident	70.7	Confident	94 Å²	94	82.4 Å²	82.4	50%	0.503	41%	0.405	S	S	.	.	H	α-helix	trans	-68.8	-41.9	178.9	-71.2	-20.2	0	0	0	111.5	M59 E60 L61 V65 R66 E67	M59-D63 PolarHBondContact O-N 2.89Å; E60-D63 PolarHBondContact O-N 2.83Å; L61-D63 VanDerWaalsContact C-N 3.33Å; L61-D63 PolarHBondContact O-N 2.6Å; D63-V65 PolarHBondContact O-N 3.09Å; D63-R66 PolarHBondContact O-N 2.91Å; D63-E67 VanDerWaalsContact O-CB 3.31Å; D63-E67 WeakPolarHBondContact O-CB 3.46Å; D63-E67 PolarHBondContact O-N 2.88Å
64	L	74.2	Confident	70.8	Confident	95 Å²	95	86.1 Å²	86.1	50%	0.497	41%	0.414	S	S	.	.	H	α-helix	trans	-56.7	-46.8	172.4	-92.6	146.9	0	0	0	112	E60 L61 K68	E60-L64 WeakPolarHBondContact O-CB 3.49Å; E60-L64 WeakPolarHBondContact O-CD1 3.12Å; E60-L64 PolarHBondContact O-N 3Å; L61-L64 PolarHBondContact O-N 3.48Å; L64-K68 WeakPolarHBondContact O-CB 3.36Å; L64-K68 WeakPolarHBondContact O-CG 3.37Å; L64-K68 PolarHBondContact O-N 3.31Å
65	V	70.6	Confident	71.1	Confident	16 Å²	16	80.1 Å²	80.1	10%	0.097	39%	0.393	C	S	.	.	H	α-helix	trans	-71.6	-36.4	178.8	179.9	0	0	0	0	110.6	L61 K62 D63 E67 K68 A69 G70 V72 F91	L61-V65 WeakPolarHBondContact O-CG2 3.45Å; L61-V65 PolarHBondContact O-N 2.85Å; K62-V65 PolarHBondContact O-N 3.4Å; D63-V65 PolarHBondContact O-N 3.09Å; V65-E67 VanDerWaalsContact C-N 3.33Å; V65-E67 PolarHBondContact O-N 3.17Å; V65-K68 PolarHBondContact O-N 3.47Å; V65-A69 HydrophobicContact CG1-CB 3.9Å; V65-A69 WeakPolarHBondContact O-CA 3.48Å; V65-A69 WeakPolarHBondContact O-CB 3.42Å; V65-A69 PolarHBondContact O-N 3.23Å; V65-G70 PolarHBondContact O-N 3.39Å; V65-V72 HydrophobicContact CB-CG2 3.77Å; V65-V72 HydrophobicContact CG1-CG2 3.32Å; V65-F91 HydrophobicContact CB-CZ 4.44Å; V65-F91 HydrophobicContact CG1-CD2 4.1Å; V65-F91 HydrophobicContact CG1-CE2 3.98Å; V65-F91 HydrophobicContact CG1-CG 4.44Å; V65-F91 HydrophobicContact CG1-CZ 4.21Å; V65-F91 HydrophobicContact CG2-CE1 4.12Å; V65-F91 HydrophobicContact CG2-CE2 3.94Å; V65-F91 HydrophobicContact CG2-CZ 3.51Å
66	R	73	Confident	70.9	Confident	148 Å²	148	78.4 Å²	78.4	56%	0.558	38%	0.381	S	S	*	.	H	α-helix	trans	-66	-35.4	176.4	-165.1	176.1	-167.6	-155	-3.4	112.9	K62 D63 G70 D71	K62-R66 WeakPolarHBondContact O-CB 3.33Å; K62-R66 PolarHBondContact O-N 2.95Å; D63-R66 PolarHBondContact O-N 2.91Å; R66-G70 VanDerWaalsContact CA-O 3.3Å; R66-G70 WeakPolarHBondContact CA-O 3.22Å; R66-D71 IonicContact CZ-OD1 2.92Å; R66-D71 IonicContact NE-OD1 2.71Å; R66-D71 PolarHBondContact NE-OD1 3.44Å; R66-D71 IonicContact NH2-OD1 3.02Å
67	E	75.4	Confident	70.7	Confident	138 Å²	138	79.5 Å²	79.5	65%	0.645	39%	0.385	S	S	*	.	H	α-helix	trans	-73.6	-43.7	177	-166.3	-163.9	139.3	0	0	112	D63 V65	D63-E67 VanDerWaalsContact O-CB 3.31Å; D63-E67 WeakPolarHBondContact O-CB 3.46Å; D63-E67 PolarHBondContact O-N 2.88Å; V65-E67 VanDerWaalsContact C-N 3.33Å; V65-E67 PolarHBondContact O-N 3.17Å
68	K	65.2	Low	70.4	Confident	157 Å²	157	76 Å²	76	68%	0.683	38%	0.376	S	S	*	.	H	α-helix	trans	-99	-32.9	-170.7	-57.2	-56.2	-170.6	-157.4	0	115.2	L64 V65	L64-K68 WeakPolarHBondContact O-CB 3.36Å; L64-K68 WeakPolarHBondContact O-CG 3.37Å; L64-K68 PolarHBondContact O-N 3.31Å; V65-K68 PolarHBondContact O-N 3.47Å
69	A	62.8	Low	69.7	Low	61 Å²	61	76.3 Å²	76.3	50%	0.504	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-26.5	-171.9	0	0	0	0	0	113.8	V65 Y93	V65-A69 HydrophobicContact CG1-CB 3.9Å; V65-A69 WeakPolarHBondContact O-CA 3.48Å; V65-A69 WeakPolarHBondContact O-CB 3.42Å; V65-A69 PolarHBondContact O-N 3.23Å; A69-Y93 WeakPolarHBondContact O-CE2 3.12Å
70	G	67.8	Low	68.7	Low	23 Å²	23	76.5 Å²	76.5	24%	0.237	39%	0.386	C	S	.	.			trans	121.8	-170.8	177.7	0	0	0	0	0	113.4	V65 R66 V72	V65-G70 PolarHBondContact O-N 3.39Å; R66-G70 VanDerWaalsContact CA-O 3.3Å; R66-G70 WeakPolarHBondContact CA-O 3.22Å; G70-V72 PolarHBondContact O-N 3.34Å
71	D	70.3	Confident	67.6	Low	82 Å²	82	83.9 Å²	83.9	44%	0.439	42%	0.417	S	S	.	.			trans	-67.6	126.4	-168.9	-153.9	27	0	0	0	112.4	R66	R66-D71 IonicContact CZ-OD1 2.92Å; R66-D71 IonicContact NE-OD1 2.71Å; R66-D71 PolarHBondContact NE-OD1 3.44Å; R66-D71 IonicContact NH2-OD1 3.02Å
72	V	67.9	Low	66.7	Low	8 Å²	8	87.5 Å²	87.5	5%	0.048	44%	0.436	C	S	.	.	B	Isolated β-bridge	trans	-101.2	111.2	-175.1	179.1	0	0	0	0	109.6	K62 V65 G70 Y74 V75 F91	K62-V72 HydrophobicContact CG-CB 4.2Å; K62-V72 HydrophobicContact CG-CG1 4.28Å; V65-V72 HydrophobicContact CB-CG2 3.77Å; V65-V72 HydrophobicContact CG1-CG2 3.32Å; G70-V72 PolarHBondContact O-N 3.34Å; V72-Y74 WeakPolarHBondContact CG1-O 3.38Å; V72-V75 HydrophobicContact CG1-CG2 3.41Å; V72-V75 VanDerWaalsContact CG1-CG2 3.41Å; V72-F91 HydrophobicContact CG1-CB 4.1Å; V72-F91 HydrophobicContact CG1-CD1 4.16Å; V72-F91 HydrophobicContact CG1-CG 4.44Å
73	A	69.4	Low	65.6	Low	53 Å²	53	87.9 Å²	87.9	44%	0.438	46%	0.459	S	S	.	.	S	Bend	trans	-69.7	-37.5	-178.2	0	0	0	0	0	113.1	V92	A73-V92 HydrophobicContact CB-CB 4.01Å; A73-V92 PolarHBondContact N-O 2.83Å
74	Y	62.6	Low	64.4	Low	126 Å²	126	90.9 Å²	90.9	49%	0.494	47%	0.468	S	S	.	.			trans	-155.2	143.7	-173	178.3	-111.9	0	0	0	109.4	V72 E76	V72-Y74 WeakPolarHBondContact CG1-O 3.38Å; Y74-E76 HydrophobicContact CD1-CB 4.47Å; Y74-E76 HydrophobicContact CE1-CB 3.59Å; Y74-E76 HydrophobicContact CE1-CG 4.3Å; Y74-E76 WeakPolarHBondContact CE1-OE2 3.29Å; Y74-E76 VanDerWaalsContact OH-CD 3.27Å; Y74-E76 WeakPolarHBondContact OH-CG 3.41Å; Y74-E76 PolarHBondContact OH-OE2 2.7Å
75	V	68.9	Low	63.2	Low	22 Å²	22	88 Å²	88	13%	0.133	46%	0.455	C	S	.	.			trans	-131.5	124	173.2	-179.5	0	0	0	0	105.9	W58 L61 K62 V72 F91	W58-V75 HydrophobicContact CB-CG1 4.33Å; L61-V75 HydrophobicContact CD2-CG1 4.3Å; K62-V75 HydrophobicContact CB-CG2 3.97Å; K62-V75 HydrophobicContact CD-CG2 4.2Å; K62-V75 HydrophobicContact CG-CG2 3.94Å; V72-V75 HydrophobicContact CG1-CG2 3.41Å; V72-V75 VanDerWaalsContact CG1-CG2 3.41Å; V75-F91 HydrophobicContact CG2-CD1 4.23Å
76	E	66.5	Low	61.9	Low	88 Å²	88	90.2 Å²	90.2	41%	0.411	46%	0.463	S	S	.	.			trans	-112.2	129.4	171.2	-164.2	165.1	154.6	0	0	108.5	Y74 I78 F89	Y74-E76 HydrophobicContact CD1-CB 4.47Å; Y74-E76 HydrophobicContact CE1-CB 3.59Å; Y74-E76 HydrophobicContact CE1-CG 4.3Å; Y74-E76 WeakPolarHBondContact CE1-OE2 3.29Å; Y74-E76 VanDerWaalsContact OH-CD 3.27Å; Y74-E76 WeakPolarHBondContact OH-CG 3.41Å; Y74-E76 PolarHBondContact OH-OE2 2.7Å; E76-I78 HydrophobicContact CG-CG1 4.45Å; E76-F89 WeakPolarHBondContact O-CA 3.07Å; E76-F89 WeakPolarHBondContact O-CB 3.4Å
77	M	64.8	Low	60.5	Low	49 Å²	49	85.9 Å²	85.9	24%	0.241	45%	0.453	C	S	.	.			trans	-103.2	113.3	170.5	-72.7	-175.2	67.1	0	0	108.1	W58 K86	W58-M77 VanDerWaalsContact CA-SD 3.51Å; W58-M77 HydrophobicContact CB-CG 3.92Å; W58-M77 HydrophobicContact CB-SD 3.35Å; W58-M77 WeakPolarHBondContact CB-SD 3.35Å; W58-M77 HydrophobicContact CG-SD 4.28Å; W58-M77 PolarHBondContact N-SD 3.32Å; M77-K86 HydrophobicContact CE-CD 3.19Å; M77-K86 HydrophobicContact CE-CG 4.46Å
78	I	62.3	Low	58.9	Low	73 Å²	73	81.4 Å²	81.4	37%	0.374	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-87.7	121.4	173.9	-56.4	-178	0	0	0	108	E76	E76-I78 HydrophobicContact CG-CG1 4.45Å
79	E	59.8	Low	58.2	Low	130 Å²	130	74.1 Å²	74.1	61%	0.607	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-99.8	119.5	173.3	-61	-172	160.7	0	0	108.4	K86	E79-K86 HydrophobicContact CG-CD 4.15Å; E79-K86 HydrophobicContact CG-CG 4.4Å; E79-K86 WeakPolarHBondContact OE1-CE 3.5Å; E79-K86 IonicContact OE1-NZ 3.43Å; E79-K86 PolarHBondContact OE1-NZ 2.93Å
80	N	56.2	Low	57.2	Low	89 Å²	89	71.4 Å²	71.4	48%	0.476	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-74.1	150.1	169.3	-75.3	-19	0	0	0	109.9	D82	N80-D82 WeakPolarHBondContact CB-OD1 3.4Å; N80-D82 PolarHBondContact O-N 3.36Å; N80-D82 VanDerWaalsContact O-N 3.1Å
81	F	55	Low	56.5	Low	227 Å²	227	70.9 Å²	70.9	100%	0.996	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-8.1	-178.1	-99.7	-92.3	0	0	0	114.6
82	D	55.6	Low	55.3	Low	94 Å²	94	68 Å²	68	50%	0.503	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-1.5	-174	56.3	-4.7	0	0	0	114.2	N80 K84	N80-D82 WeakPolarHBondContact CB-OD1 3.4Å; N80-D82 PolarHBondContact O-N 3.36Å; N80-D82 VanDerWaalsContact O-N 3.1Å; D82-K84 PolarHBondContact O-N 3.49Å
83	G	50.6	Low	54.3	Low	73 Å²	73	72.3 Å²	72.3	75%	0.753	38%	0.376	S	S	*	.	S	Bend	trans	61.7	13.2	179.2	0	0	0	0	0	113.6
84	K	52.8	Low	53.3	Low	157 Å²	157	73.2 Å²	73.2	68%	0.683	37%	0.371	S	S	*	.	S	Bend	trans	-134.1	89.5	-174.5	-69.2	-178.3	-174.5	178.6	0	110.6	D82	D82-K84 PolarHBondContact O-N 3.49Å
85	S	49.1	Very low	52.7	Low	33 Å²	33	70.7 Å²	70.7	23%	0.231	37%	0.37	C	S	.	.			trans	79.1	128.9	165.2	-86.7	0	0	0	0	117.3	Y54	Y54-S85 VanDerWaalsContact CE1-CA 3.45Å; Y54-S85 WeakPolarHBondContact CE1-OG 3.48Å; Y54-S85 WeakPolarHBondContact CE2-OG 3.44Å; Y54-S85 WeakPolarHBondContact OH-CB 3.14Å; Y54-S85 PolarHBondContact OH-OG 2.84Å
86	K	43.4	Very low	51.5	Low	63 Å²	63	80.6 Å²	80.6	27%	0.274	41%	0.405	S	S	.	.			trans	-93.3	110.9	-176.3	-50.2	-175.5	-172.2	-162.7	0	108.1	M77 E79	M77-K86 HydrophobicContact CE-CD 3.19Å; M77-K86 HydrophobicContact CE-CG 4.46Å; E79-K86 HydrophobicContact CG-CD 4.15Å; E79-K86 HydrophobicContact CG-CG 4.4Å; E79-K86 WeakPolarHBondContact OE1-CE 3.5Å; E79-K86 IonicContact OE1-NZ 3.43Å; E79-K86 PolarHBondContact OE1-NZ 2.93Å
87	V	44.9	Very low	50.3	Low	57 Å²	57	82.7 Å²	82.7	35%	0.345	42%	0.424	S	S	.	.			trans	-139.2	87.3	177.8	177.7	0	0	0	0	109.7
88	S	40.2	Very low	48.8	Very low	45 Å²	45	87.8 Å²	87.8	32%	0.315	45%	0.445	S	S	.	.			trans	175.2	138.3	142.7	-80.9	0	0	0	0	108.2
89	F	50.8	Low	47.9	Very low	4 Å²	4	88.9 Å²	88.9	2%	0.018	47%	0.465	C	S	.	.			trans	-149.7	160.2	173.2	54.5	-108.8	0	0	0	109.6	V47 Y48 I49 I52 L61 E76 F91	V47-F89 VanDerWaalsContact O-CD2 3.28Å; V47-F89 WeakPolarHBondContact O-CD2 3.24Å; V47-F89 WeakPolarHBondContact O-CE2 3.46Å; V47-F89 VanDerWaalsContact O-O 3.11Å; Y48-F89 WeakPolarHBondContact CA-O 3.49Å; Y48-F89 WeakPolarHBondContact CD1-O 3.36Å; Y48-F89 VanDerWaalsContact CG-O 3.29Å; I49-F89 VanDerWaalsContact CA-CE1 3.5Å; I49-F89 HydrophobicContact CB-CD1 4.48Å; I49-F89 HydrophobicContact CB-CE1 3.31Å; I49-F89 HydrophobicContact CB-CE2 3.53Å; I49-F89 HydrophobicContact CB-CZ 2.86Å; I49-F89 HydrophobicContact CD1-CE1 4.46Å; I49-F89 HydrophobicContact CD1-CE2 3.87Å; I49-F89 HydrophobicContact CD1-CZ 3.38Å; I49-F89 HydrophobicContact CG1-CE1 4.01Å; I49-F89 HydrophobicContact CG1-CE2 3.31Å; I49-F89 HydrophobicContact CG1-CZ 3.02Å; I49-F89 HydrophobicContact CG2-CE1 4.39Å; I49-F89 HydrophobicContact CG2-CZ 4.15Å; I49-F89 WeakPolarHBondContact O-CD1 3.27Å; I49-F89 WeakPolarHBondContact O-CE1 3.38Å; I52-F89 HydrophobicContact CD1-CD1 3.49Å; I52-F89 VanDerWaalsContact CD1-CD1 3.49Å; I52-F89 HydrophobicContact CD1-CE1 3.34Å; I52-F89 HydrophobicContact CG1-CD1 4.43Å; I52-F89 HydrophobicContact CG1-CE1 3.87Å; L61-F89 HydrophobicContact CD2-CD1 4.35Å; L61-F89 HydrophobicContact CD2-CE1 4.15Å; L61-F89 HydrophobicContact CD2-CZ 4.37Å; E76-F89 WeakPolarHBondContact O-CA 3.07Å; E76-F89 WeakPolarHBondContact O-CB 3.4Å; F89-F91 HydrophobicContact CD2-CD1 4.02Å; F89-F91 HydrophobicContact CD2-CD2 4.43Å; F89-F91 AromaticContact CD2-CE1 3.43Å; F89-F91 HydrophobicContact CD2-CE1 3.43Å; F89-F91 VanDerWaalsContact CD2-CE1 3.43Å; F89-F91 AromaticContact CD2-CE2 3.92Å; F89-F91 HydrophobicContact CD2-CE2 3.92Å; F89-F91 AromaticContact CD2-CZ 3.43Å; F89-F91 HydrophobicContact CD2-CZ 3.43Å; F89-F91 VanDerWaalsContact CD2-CZ 3.43Å; F89-F91 HydrophobicContact CE1-CZ 4.38Å; F89-F91 HydrophobicContact CE2-CD1 4.21Å; F89-F91 HydrophobicContact CE2-CD2 4.06Å; F89-F91 AromaticContact CE2-CE1 3.38Å; F89-F91 HydrophobicContact CE2-CE1 3.38Å; F89-F91 AromaticContact CE2-CE2 3.2Å; F89-F91 HydrophobicContact CE2-CE2 3.2Å; F89-F91 AromaticContact CE2-CZ 2.83Å; F89-F91 HydrophobicContact CE2-CZ 2.83Å; F89-F91 HydrophobicContact CG-CE1 4.13Å; F89-F91 HydrophobicContact CG-CZ 4.34Å; F89-F91 AromaticContact CZ-CE1 3.87Å; F89-F91 HydrophobicContact CZ-CE1 3.87Å; F89-F91 AromaticContact CZ-CE2 3.89Å; F89-F91 HydrophobicContact CZ-CE2 3.89Å; F89-F91 AromaticContact CZ-CZ 3.22Å; F89-F91 HydrophobicContact CZ-CZ 3.22Å
90	G	42.5	Very low	47	Very low	4 Å²	4	91.3 Å²	91.3	4%	0.041	48%	0.476	C	S	.	.			trans	-130.3	127.2	168.1	0	0	0	0	0	111.1	V47	V47-G90 WeakPolarHBondContact O-CA 3.35Å
91	F	53.7	Low	46.2	Very low	12 Å²	12	92.8 Å²	92.8	5%	0.053	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	138	164.4	-28.5	-61.6	0	0	0	109.4	K45 M46 V47 I49 L61 V65 V72 V75 F89	K45-F91 CarbonylContact C-O 3.56Å; M46-F91 WeakPolarHBondContact CA-O 3.28Å; V47-F91 HydrophobicContact CB-CD2 3.84Å; V47-F91 HydrophobicContact CB-CE2 4.34Å; V47-F91 HydrophobicContact CG1-CD2 4.39Å; V47-F91 HydrophobicContact CG1-CE2 4.41Å; V47-F91 PolarHBondContact N-O 3.05Å; V47-F91 PolarHBondContact O-N 3.43Å; I49-F91 HydrophobicContact CD1-CE2 3.92Å; I49-F91 HydrophobicContact CD1-CZ 4Å; I49-F91 HydrophobicContact CG1-CE2 4.24Å; I49-F91 HydrophobicContact CG1-CZ 4.44Å; L61-F91 HydrophobicContact CD2-CE1 4.29Å; V65-F91 HydrophobicContact CB-CZ 4.44Å; V65-F91 HydrophobicContact CG1-CD2 4.1Å; V65-F91 HydrophobicContact CG1-CE2 3.98Å; V65-F91 HydrophobicContact CG1-CG 4.44Å; V65-F91 HydrophobicContact CG1-CZ 4.21Å; V65-F91 HydrophobicContact CG2-CE1 4.12Å; V65-F91 HydrophobicContact CG2-CE2 3.94Å; V65-F91 HydrophobicContact CG2-CZ 3.51Å; V72-F91 HydrophobicContact CG1-CB 4.1Å; V72-F91 HydrophobicContact CG1-CD1 4.16Å; V72-F91 HydrophobicContact CG1-CG 4.44Å; V75-F91 HydrophobicContact CG2-CD1 4.23Å; F89-F91 HydrophobicContact CD2-CD1 4.02Å; F89-F91 HydrophobicContact CD2-CD2 4.43Å; F89-F91 AromaticContact CD2-CE1 3.43Å; F89-F91 HydrophobicContact CD2-CE1 3.43Å; F89-F91 VanDerWaalsContact CD2-CE1 3.43Å; F89-F91 AromaticContact CD2-CE2 3.92Å; F89-F91 HydrophobicContact CD2-CE2 3.92Å; F89-F91 AromaticContact CD2-CZ 3.43Å; F89-F91 HydrophobicContact CD2-CZ 3.43Å; F89-F91 VanDerWaalsContact CD2-CZ 3.43Å; F89-F91 HydrophobicContact CE1-CZ 4.38Å; F89-F91 HydrophobicContact CE2-CD1 4.21Å; F89-F91 HydrophobicContact CE2-CD2 4.06Å; F89-F91 AromaticContact CE2-CE1 3.38Å; F89-F91 HydrophobicContact CE2-CE1 3.38Å; F89-F91 AromaticContact CE2-CE2 3.2Å; F89-F91 HydrophobicContact CE2-CE2 3.2Å; F89-F91 AromaticContact CE2-CZ 2.83Å; F89-F91 HydrophobicContact CE2-CZ 2.83Å; F89-F91 HydrophobicContact CG-CE1 4.13Å; F89-F91 HydrophobicContact CG-CZ 4.34Å; F89-F91 AromaticContact CZ-CE1 3.87Å; F89-F91 HydrophobicContact CZ-CE1 3.87Å; F89-F91 AromaticContact CZ-CE2 3.89Å; F89-F91 HydrophobicContact CZ-CE2 3.89Å; F89-F91 AromaticContact CZ-CZ 3.22Å; F89-F91 HydrophobicContact CZ-CZ 3.22Å
92	V	44.4	Very low	45	Very low	21 Å²	21	92.9 Å²	92.9	13%	0.127	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	112.4	160.7	176.6	0	0	0	0	108.3	L41 K45 A73 H94	L41-V92 HydrophobicContact CD2-CG2 4.09Å; K45-V92 HydrophobicContact CB-CG1 3.93Å; K45-V92 HydrophobicContact CD-CG1 4.15Å; K45-V92 WeakPolarHBondContact O-CA 3.4Å; A73-V92 HydrophobicContact CB-CB 4.01Å; A73-V92 PolarHBondContact N-O 2.83Å; V92-H94 PolarHBondContact O-N 3.29Å
93	Y	48	Very low	43.8	Very low	98 Å²	98	99 Å²	99	38%	0.384	50%	0.498	S	S	.	.	B	Isolated β-bridge	trans	-70.8	120	170.9	177.9	-112.9	0	0	0	110.4	K45 A69 P95	K45-Y93 PolarHBondContact O-N 3.28Å; A69-Y93 WeakPolarHBondContact O-CE2 3.12Å; Y93-P95 HydrophobicContact CD1-CB 4.42Å; Y93-P95 HydrophobicContact CE1-CB 3.64Å; Y93-P95 HydrophobicContact CE1-CG 4.19Å
94	H	48	Very low	43	Very low	72 Å²	72	101.9 Å²	101.9	33%	0.333	50%	0.496	S	S	.	.			trans	-99.6	106.8	163.2	-84.8	-65.3	0	0	0	108.8	R39 V92 R96	R39-H94 PolarHBondContact NH2-NE2 3.25Å; V92-H94 PolarHBondContact O-N 3.29Å; H94-R96 PolarHBondContact O-N 3.19Å
95	P	50.3	Low	42.2	Very low	73 Å²	73	101.8 Å²	101.8	47%	0.474	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-59	133.8	171.1	23	-30.3	0	0	0	108.8	Y93 T97	Y93-P95 HydrophobicContact CD1-CB 4.42Å; Y93-P95 HydrophobicContact CE1-CB 3.64Å; Y93-P95 HydrophobicContact CE1-CG 4.19Å; P95-T97 PolarHBondContact O-N 2.82Å; P95-T97 VanDerWaalsContact O-N 3.08Å
96	R	43.6	Very low	42	Very low	231 Å²	231	102.4 Å²	102.4	87%	0.872	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-51	122.2	167.6	-78.5	-174.2	179.4	173.4	2.1	107.6	H94 K98	H94-R96 PolarHBondContact O-N 3.19Å; R96-K98 PolarHBondContact O-N 3.18Å
97	T	39.6	Very low	41.7	Very low	131 Å²	131	106.2 Å²	106.2	80%	0.804	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-54.7	135.6	-173	-21.7	0	0	0	0	109.7	P95 A99	P95-T97 PolarHBondContact O-N 2.82Å; P95-T97 VanDerWaalsContact O-N 3.08Å; T97-A99 PolarHBondContact O-N 2.99Å
98	K	35	Very low	41.4	Very low	157 Å²	157	107.9 Å²	107.9	68%	0.683	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	19.2	-174.7	-64.7	180	170.1	-174	0	115.7	R96 Q100	R96-K98 PolarHBondContact O-N 3.18Å; K98-Q100 VanDerWaalsContact C-N 3.28Å; K98-Q100 PolarHBondContact O-N 3.4Å
99	A	42.1	Very low	41.5	Very low	95 Å²	95	109.5 Å²	109.5	79%	0.785	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-12.5	-178.2	0	0	0	0	0	113.9	T97	T97-A99 PolarHBondContact O-N 2.99Å
100	Q	41.7	Very low	41	Very low	181 Å²	181	113.6 Å²	113.6	85%	0.846	57%	0.566	S	S	*	*	S	Bend	trans	-106.2	-9.9	-176.9	-142	91.6	17	0	0	115.4	K98	K98-Q100 VanDerWaalsContact C-N 3.28Å; K98-Q100 PolarHBondContact O-N 3.4Å
101	V	38.3	Very low	40.9	Very low	120 Å²	120	119.3 Å²	119.3	73%	0.727	60%	0.595	S	S	*	*			trans	-122.9	96.5	-171.3	-173.7	0	0	0	0	110
102	R	31.4	Very low	40.3	Very low	230 Å²	230	125.4 Å²	125.4	87%	0.868	62%	0.618	S	S	*	*			trans	-55.5	138.6	162.9	-73.3	179.9	172.1	-177.9	-1.9	108.9
103	R	30.6	Very low	40.4	Very low	222 Å²	222	129.3 Å²	129.3	84%	0.838	64%	0.637	S	S	*	*	S	Bend	trans	21	121.5	156.7	-64.4	-178	-171.4	127.4	1.7	116.7
104	N	32.5	Very low	40.1	Very low	133 Å²	133	128.3 Å²	128.3	71%	0.711	64%	0.642	S	S	*	*	S	Bend	trans	145.2	108	139.1	-68.5	-14.4	0	0	0	107.7	A106	N104-A106 WeakPolarHBondContact O-CB 3.31Å; N104-A106 PolarHBondContact O-N 3.15Å
105	D	37.3	Very low	40	Very low	155 Å²	155	127.3 Å²	127.3	83%	0.829	65%	0.646	S	S	*	*	S	Bend	trans	45.1	6.6	145.3	-51.9	-37.3	0	0	0	121.9	Q107	D105-Q107 PolarHBondContact O-N 3.3Å
106	A	44.5	Very low	40	Very low	46 Å²	46	128.4 Å²	128.4	38%	0.38	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.3	8.5	-166.9	0	0	0	0	0	115.2	N104 D108 D109	N104-A106 WeakPolarHBondContact O-CB 3.31Å; N104-A106 PolarHBondContact O-N 3.15Å; A106-D108 PolarHBondContact O-N 3.15Å; A106-D109 HydrophobicContact CB-CB 4.44Å; A106-D109 PolarHBondContact O-N 2.76Å
107	Q	36.1	Very low	39.9	Very low	144 Å²	144	123.8 Å²	123.8	67%	0.673	63%	0.634	S	S	*	*	H	α-helix	trans	-72.7	-22.8	-180	-132.7	177.3	-72.1	0	0	112.4	D105	D105-Q107 PolarHBondContact O-N 3.3Å
108	D	39.3	Very low	40.2	Very low	92 Å²	92	120.3 Å²	120.3	49%	0.492	61%	0.607	S	S	.	*	H	α-helix	trans	-77.9	-28	169.2	-99.5	14.2	0	0	0	112.4	A106 V110 L111 R112	A106-D108 PolarHBondContact O-N 3.15Å; D108-V110 PolarHBondContact O-N 3.14Å; D108-L111 PolarHBondContact O-N 2.64Å; D108-R112 WeakPolarHBondContact O-CB 3.38Å; D108-R112 VanDerWaalsContact O-CG 3.24Å; D108-R112 WeakPolarHBondContact O-CG 3.04Å; D108-R112 PolarHBondContact O-N 2.94Å; D108-R112 IonicContact OD2-CZ 2.88Å; D108-R112 IonicContact OD2-NE 3.89Å; D108-R112 IonicContact OD2-NH2 3.85Å; D108-R112 PolarHBondContact OD2-NH2 2.76Å
109	D	41.8	Very low	40.8	Very low	79 Å²	79	118.7 Å²	118.7	42%	0.422	60%	0.6	S	S	.	*	H	α-helix	trans	-71.7	-29	-172.2	-73.4	-25.6	0	0	0	113.3	A106 R112 N113	A106-D109 HydrophobicContact CB-CB 4.44Å; A106-D109 PolarHBondContact O-N 2.76Å; D109-R112 PolarHBondContact O-N 3.4Å; D109-N113 VanDerWaalsContact O-CB 3.31Å; D109-N113 WeakPolarHBondContact O-CB 3.34Å; D109-N113 PolarHBondContact O-N 3.44Å; D109-N113 PolarHBondContact O-ND2 3.17Å
110	V	41	Very low	41.1	Very low	89 Å²	89	120.2 Å²	120.2	54%	0.539	59%	0.589	S	S	.	*	H	α-helix	trans	-72.6	-40.1	177.1	-175.1	0	0	0	0	111.1	D108 N113 V114	D108-V110 PolarHBondContact O-N 3.14Å; V110-N113 PolarHBondContact O-N 2.95Å; V110-V114 WeakPolarHBondContact O-CG2 3.45Å; V110-V114 PolarHBondContact O-N 3.11Å; V110-V114 VanDerWaalsContact O-N 3.14Å
111	L	40.8	Very low	41	Very low	124 Å²	124	113.4 Å²	113.4	65%	0.649	56%	0.56	S	S	*	*	H	α-helix	trans	-69.5	-37.1	172.7	-93.7	145.2	0	0	0	111.7	D108 N113 V114 A115	D108-L111 PolarHBondContact O-N 2.64Å; L111-N113 VanDerWaalsContact C-N 3.33Å; L111-V114 PolarHBondContact O-N 2.93Å; L111-A115 WeakPolarHBondContact O-CB 3.2Å; L111-A115 PolarHBondContact O-N 3.16Å
112	R	40.9	Very low	41	Very low	141 Å²	141	111.4 Å²	111.4	53%	0.532	54%	0.541	S	S	.	.	H	α-helix	trans	-63.3	-37.8	171.3	-74.8	173.7	-162.7	-146.6	7.1	111.5	D108 D109 A115 L116	D108-R112 WeakPolarHBondContact O-CB 3.38Å; D108-R112 VanDerWaalsContact O-CG 3.24Å; D108-R112 WeakPolarHBondContact O-CG 3.04Å; D108-R112 PolarHBondContact O-N 2.94Å; D108-R112 IonicContact OD2-CZ 2.88Å; D108-R112 IonicContact OD2-NE 3.89Å; D108-R112 IonicContact OD2-NH2 3.85Å; D108-R112 PolarHBondContact OD2-NH2 2.76Å; D109-R112 PolarHBondContact O-N 3.4Å; R112-A115 CarbonylContact O-C 3.4Å; R112-A115 PolarHBondContact O-N 3.14Å; R112-L116 HydrophobicContact CB-CD1 4.46Å; R112-L116 WeakPolarHBondContact O-CA 3.17Å; R112-L116 WeakPolarHBondContact O-CB 3.48Å; R112-L116 WeakPolarHBondContact O-CD1 3.4Å; R112-L116 WeakPolarHBondContact O-CG 3.31Å; R112-L116 PolarHBondContact O-N 3.23Å
113	N	44.8	Very low	41.8	Very low	102 Å²	102	106.3 Å²	106.3	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-68.5	-37.4	178	-79.9	-40.8	0	0	0	112.6	D109 V110 L111 F117	D109-N113 VanDerWaalsContact O-CB 3.31Å; D109-N113 WeakPolarHBondContact O-CB 3.34Å; D109-N113 PolarHBondContact O-N 3.44Å; D109-N113 PolarHBondContact O-ND2 3.17Å; V110-N113 PolarHBondContact O-N 2.95Å; L111-N113 VanDerWaalsContact C-N 3.33Å; N113-F117 WeakPolarHBondContact O-CB 2.97Å; N113-F117 PolarHBondContact O-N 3.42Å
114	V	42.9	Very low	42.5	Very low	78 Å²	78	102 Å²	102	47%	0.473	52%	0.52	S	S	.	.	H	α-helix	trans	-66.9	-45	172.1	178	0	0	0	0	110.4	V110 L111 L116 F117 F118	V110-V114 WeakPolarHBondContact O-CG2 3.45Å; V110-V114 PolarHBondContact O-N 3.11Å; V110-V114 VanDerWaalsContact O-N 3.14Å; L111-V114 PolarHBondContact O-N 2.93Å; V114-L116 PolarHBondContact O-N 3.42Å; V114-F117 WeakPolarHBondContact O-CB 3.49Å; V114-F117 PolarHBondContact O-N 3.38Å; V114-F118 HydrophobicContact CG1-CD2 3.96Å; V114-F118 HydrophobicContact CG1-CE2 3.58Å; V114-F118 WeakPolarHBondContact O-CD2 2.91Å; V114-F118 PolarHBondContact O-N 2.55Å
115	A	46.7	Very low	42.8	Very low	50 Å²	50	99.2 Å²	99.2	41%	0.413	51%	0.508	S	S	.	.	H	α-helix	trans	-65.1	-36.6	176.1	0	0	0	0	0	113.2	L111 R112 F118 K119	L111-A115 WeakPolarHBondContact O-CB 3.2Å; L111-A115 PolarHBondContact O-N 3.16Å; R112-A115 CarbonylContact O-C 3.4Å; R112-A115 PolarHBondContact O-N 3.14Å; A115-F118 PolarHBondContact O-N 2.94Å; A115-K119 WeakPolarHBondContact O-CB 3.38Å; A115-K119 PolarHBondContact O-N 3.47Å
116	L	48.5	Very low	42.8	Very low	97 Å²	97	94.9 Å²	94.9	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-68.8	-35.9	175.9	-80	163.9	0	0	0	111.3	R112 V114 K119 K120	R112-L116 HydrophobicContact CB-CD1 4.46Å; R112-L116 WeakPolarHBondContact O-CA 3.17Å; R112-L116 WeakPolarHBondContact O-CB 3.48Å; R112-L116 WeakPolarHBondContact O-CD1 3.4Å; R112-L116 WeakPolarHBondContact O-CG 3.31Å; R112-L116 PolarHBondContact O-N 3.23Å; V114-L116 PolarHBondContact O-N 3.42Å; L116-K119 PolarHBondContact O-N 2.67Å; L116-K120 WeakPolarHBondContact O-CB 3.36Å; L116-K120 PolarHBondContact O-N 3.28Å
117	F	42.8	Very low	42.5	Very low	134 Å²	134	95.6 Å²	95.6	59%	0.588	50%	0.497	S	S	*	.	H	α-helix	trans	-61	-49.6	172.6	-177.2	-99.3	0	0	0	110.7	N113 V114 K119 K120 V121	N113-F117 WeakPolarHBondContact O-CB 2.97Å; N113-F117 PolarHBondContact O-N 3.42Å; V114-F117 WeakPolarHBondContact O-CB 3.49Å; V114-F117 PolarHBondContact O-N 3.38Å; F117-K119 VanDerWaalsContact C-N 3.3Å; F117-K119 PolarHBondContact O-N 3.15Å; F117-K120 PolarHBondContact O-N 2.83Å; F117-V121 HydrophobicContact CE1-CG2 4.3Å; F117-V121 WeakPolarHBondContact O-CG2 3.44Å; F117-V121 PolarHBondContact O-N 3.09Å; F117-V121 VanDerWaalsContact O-N 3.08Å
118	F	45	Very low	42.7	Very low	58 Å²	58	92.1 Å²	92.1	25%	0.254	48%	0.484	S	S	.	.	H	α-helix	trans	-67.2	-29	176.6	-68.3	-66.8	0	0	0	113.2	I14 V114 A115 K122 F130	I14-F118 HydrophobicContact CD1-CE1 3.99Å; I14-F118 HydrophobicContact CD1-CE2 4.32Å; I14-F118 HydrophobicContact CD1-CZ 3.47Å; I14-F118 VanDerWaalsContact CD1-CZ 3.47Å; V114-F118 HydrophobicContact CG1-CD2 3.96Å; V114-F118 HydrophobicContact CG1-CE2 3.58Å; V114-F118 WeakPolarHBondContact O-CD2 2.91Å; V114-F118 PolarHBondContact O-N 2.55Å; A115-F118 PolarHBondContact O-N 2.94Å; F118-K122 PolarHBondContact O-N 3.21Å; F118-K122 VanDerWaalsContact O-N 3.17Å; F118-F130 HydrophobicContact CB-CE2 3.79Å; F118-F130 HydrophobicContact CB-CZ 4.06Å
119	K	48.1	Very low	42.8	Very low	122 Å²	122	90.5 Å²	90.5	53%	0.53	47%	0.472	S	S	.	.	H	α-helix	trans	-69.9	-38.8	172.2	-164.9	-178.8	179.1	-175.7	0	112.4	A115 L116 F117 V121 K122 D123	A115-K119 WeakPolarHBondContact O-CB 3.38Å; A115-K119 PolarHBondContact O-N 3.47Å; L116-K119 PolarHBondContact O-N 2.67Å; F117-K119 VanDerWaalsContact C-N 3.3Å; F117-K119 PolarHBondContact O-N 3.15Å; K119-V121 VanDerWaalsContact C-N 3.32Å; K119-V121 PolarHBondContact O-N 2.73Å; K119-K122 WeakPolarHBondContact O-CB 3.01Å; K119-K122 PolarHBondContact O-N 2.75Å; K119-D123 PolarHBondContact O-N 3.1Å; K119-D123 VanDerWaalsContact O-N 3.14Å
120	K	47.7	Very low	42.7	Very low	128 Å²	128	91.5 Å²	91.5	56%	0.557	47%	0.473	S	S	*	.	H	α-helix	trans	-66.3	-36.2	175.5	-165.2	175.3	-179.5	-177.1	0	111.7	L116 F117 K122 D123 E124	L116-K120 WeakPolarHBondContact O-CB 3.36Å; L116-K120 PolarHBondContact O-N 3.28Å; F117-K120 PolarHBondContact O-N 2.83Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-K122 PolarHBondContact O-N 2.91Å; K120-D123 PolarHBondContact O-N 2.84Å; K120-E124 WeakPolarHBondContact CE-OE1 3.38Å; K120-E124 WeakPolarHBondContact O-CG 3.42Å; K120-E124 PolarHBondContact O-N 3.06Å
121	V	39.8	Very low	42.9	Very low	37 Å²	37	90.5 Å²	90.5	22%	0.224	47%	0.474	C	S	.	.	H	α-helix	trans	-63.4	-39	172.6	177.4	0	0	0	0	111.2	F117 K119 E124 T125 F129	F117-V121 HydrophobicContact CE1-CG2 4.3Å; F117-V121 WeakPolarHBondContact O-CG2 3.44Å; F117-V121 PolarHBondContact O-N 3.09Å; F117-V121 VanDerWaalsContact O-N 3.08Å; K119-V121 VanDerWaalsContact C-N 3.32Å; K119-V121 PolarHBondContact O-N 2.73Å; V121-E124 PolarHBondContact O-N 3.39Å; V121-T125 HydrophobicContact CG1-CG2 4.21Å; V121-T125 WeakPolarHBondContact O-CB 3.49Å; V121-T125 PolarHBondContact O-N 3.26Å; V121-T125 PolarHBondContact O-OG1 3.05Å; V121-F129 HydrophobicContact CG1-CD2 4.12Å; V121-F129 HydrophobicContact CG1-CE2 3.54Å; V121-F129 HydrophobicContact CG1-CZ 4.43Å
122	K	39.3	Very low	42.6	Very low	79 Å²	79	92 Å²	92	34%	0.343	48%	0.482	S	S	.	.	H	α-helix	trans	-58	-47.8	172.8	175.6	-175.4	176.4	145	0	111.9	F118 K119 K120 E124 G126 D128	F118-K122 PolarHBondContact O-N 3.21Å; F118-K122 VanDerWaalsContact O-N 3.17Å; K119-K122 WeakPolarHBondContact O-CB 3.01Å; K119-K122 PolarHBondContact O-N 2.75Å; K120-K122 VanDerWaalsContact C-N 3.33Å; K120-K122 PolarHBondContact O-N 2.91Å; K122-E124 VanDerWaalsContact C-N 3.33Å; K122-E124 PolarHBondContact O-N 3.1Å; K122-G126 WeakPolarHBondContact O-CA 3.48Å; K122-G126 PolarHBondContact O-N 3.06Å; K122-D128 WeakPolarHBondContact CD-OD1 3.49Å; K122-D128 WeakPolarHBondContact CE-OD1 2.84Å; K122-D128 IonicContact NZ-OD1 2.71Å; K122-D128 PolarHBondContact NZ-OD1 3.25Å; K122-D128 IonicContact NZ-OD2 2.68Å; K122-D128 PolarHBondContact NZ-OD2 2.82Å
123	D	48	Very low	42.3	Very low	122 Å²	122	95.5 Å²	95.5	65%	0.652	50%	0.496	S	S	*	.	H	α-helix	trans	-68.6	-31	-176.7	-64.1	-23.5	0	0	0	112.4	K119 K120	K119-D123 PolarHBondContact O-N 3.1Å; K119-D123 VanDerWaalsContact O-N 3.14Å; K120-D123 PolarHBondContact O-N 2.84Å
124	E	44.2	Very low	41.7	Very low	131 Å²	131	94.9 Å²	94.9	61%	0.612	50%	0.5	S	S	*	.	H	α-helix	trans	-90.1	-27.9	-178.4	-69.5	179.9	-176.1	0	0	114.1	K120 V121 K122	K120-E124 WeakPolarHBondContact CE-OE1 3.38Å; K120-E124 WeakPolarHBondContact O-CG 3.42Å; K120-E124 PolarHBondContact O-N 3.06Å; V121-E124 PolarHBondContact O-N 3.39Å; K122-E124 VanDerWaalsContact C-N 3.33Å; K122-E124 PolarHBondContact O-N 3.1Å
125	T	39.9	Very low	41.3	Very low	75 Å²	75	101.9 Å²	101.9	46%	0.46	52%	0.519	S	S	.	.	H	α-helix	trans	-111.9	-13.2	-174.4	65	0	0	0	0	114.4	V121 I127	V121-T125 HydrophobicContact CG1-CG2 4.21Å; V121-T125 WeakPolarHBondContact O-CB 3.49Å; V121-T125 PolarHBondContact O-N 3.26Å; V121-T125 PolarHBondContact O-OG1 3.05Å; T125-I127 PolarHBondContact O-N 2.62Å; T125-I127 VanDerWaalsContact O-N 3.14Å; T125-I127 PolarHBondContact OG1-N 3.48Å
126	G	36.7	Very low	40.5	Very low	65 Å²	65	104.9 Å²	104.9	67%	0.67	54%	0.537	S	S	*	.			trans	66.9	3.4	-171.9	0	0	0	0	0	114	K122	K122-G126 WeakPolarHBondContact O-CA 3.48Å; K122-G126 PolarHBondContact O-N 3.06Å
127	I	38.4	Very low	39.7	Very low	60 Å²	60	104 Å²	104	31%	0.308	54%	0.544	S	S	.	.			trans	-89.1	115.5	-179.3	-56.1	167.6	0	0	0	108.3	A10 T125 F129	A10-I127 HydrophobicContact CB-CD1 3.84Å; T125-I127 PolarHBondContact O-N 2.62Å; T125-I127 VanDerWaalsContact O-N 3.14Å; T125-I127 PolarHBondContact OG1-N 3.48Å; I127-F129 HydrophobicContact CB-CD2 4.24Å; I127-F129 HydrophobicContact CB-CE2 3.61Å; I127-F129 HydrophobicContact CB-CZ 3.96Å; I127-F129 HydrophobicContact CD1-CZ 4.41Å; I127-F129 HydrophobicContact CG2-CD1 4.32Å; I127-F129 HydrophobicContact CG2-CD2 3.97Å; I127-F129 HydrophobicContact CG2-CE1 3.9Å; I127-F129 HydrophobicContact CG2-CE2 3.49Å; I127-F129 VanDerWaalsContact CG2-CE2 3.49Å; I127-F129 HydrophobicContact CG2-CG 4.35Å; I127-F129 HydrophobicContact CG2-CZ 3.46Å; I127-F129 VanDerWaalsContact CG2-CZ 3.46Å; I127-F129 VanDerWaalsContact O-CD2 3.22Å; I127-F129 WeakPolarHBondContact O-CD2 3.03Å; I127-F129 PolarHBondContact O-N 3.49Å
128	D	41.2	Very low	39.5	Very low	72 Å²	72	103.8 Å²	103.8	39%	0.385	56%	0.556	S	S	.	*			trans	-91.9	77.4	-171.3	-137.9	-15	0	0	0	110.4	K122 F130 A131	K122-D128 WeakPolarHBondContact CD-OD1 3.49Å; K122-D128 WeakPolarHBondContact CE-OD1 2.84Å; K122-D128 IonicContact NZ-OD1 2.71Å; K122-D128 PolarHBondContact NZ-OD1 3.25Å; K122-D128 IonicContact NZ-OD2 2.68Å; K122-D128 PolarHBondContact NZ-OD2 2.82Å; D128-F130 PolarHBondContact O-N 3.05Å; D128-A131 HydrophobicContact CB-CB 3.89Å; D128-A131 WeakPolarHBondContact O-CB 3.43Å; D128-A131 PolarHBondContact O-N 3.46Å
129	F	41.2	Very low	39.1	Very low	57 Å²	57	107 Å²	107	25%	0.25	58%	0.58	C	S	.	*	T	Hydrogen-bonded Turn	trans	-62.3	-2.9	-177	-66.3	-83.6	0	0	0	115.1	V121 I127	V121-F129 HydrophobicContact CG1-CD2 4.12Å; V121-F129 HydrophobicContact CG1-CE2 3.54Å; V121-F129 HydrophobicContact CG1-CZ 4.43Å; I127-F129 HydrophobicContact CB-CD2 4.24Å; I127-F129 HydrophobicContact CB-CE2 3.61Å; I127-F129 HydrophobicContact CB-CZ 3.96Å; I127-F129 HydrophobicContact CD1-CZ 4.41Å; I127-F129 HydrophobicContact CG2-CD1 4.32Å; I127-F129 HydrophobicContact CG2-CD2 3.97Å; I127-F129 HydrophobicContact CG2-CE1 3.9Å; I127-F129 HydrophobicContact CG2-CE2 3.49Å; I127-F129 VanDerWaalsContact CG2-CE2 3.49Å; I127-F129 HydrophobicContact CG2-CG 4.35Å; I127-F129 HydrophobicContact CG2-CZ 3.46Å; I127-F129 VanDerWaalsContact CG2-CZ 3.46Å; I127-F129 VanDerWaalsContact O-CD2 3.22Å; I127-F129 WeakPolarHBondContact O-CD2 3.03Å; I127-F129 PolarHBondContact O-N 3.49Å
130	F	40	Very low	38.6	Very low	101 Å²	101	107.4 Å²	107.4	44%	0.443	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.8	-1.9	175.7	-69.5	-80.7	0	0	0	113.7	F118 D128 N132	F118-F130 HydrophobicContact CB-CE2 3.79Å; F118-F130 HydrophobicContact CB-CZ 4.06Å; D128-F130 PolarHBondContact O-N 3.05Å; F130-N132 VanDerWaalsContact C-N 3.33Å; F130-N132 PolarHBondContact O-N 2.85Å
131	A	45.2	Very low	38.3	Very low	67 Å²	67	110.7 Å²	110.7	55%	0.554	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-17.8	-165.6	0	0	0	0	0	114.9	D128 R133	D128-A131 HydrophobicContact CB-CB 3.89Å; D128-A131 WeakPolarHBondContact O-CB 3.43Å; D128-A131 PolarHBondContact O-N 3.46Å; A131-R133 PolarHBondContact O-N 3.14Å
132	N	33.6	Very low	38.1	Very low	155 Å²	155	112.2 Å²	112.2	83%	0.829	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	29.7	177.3	-135.2	15.5	0	0	0	114	F130 S134	F130-N132 VanDerWaalsContact C-N 3.33Å; F130-N132 PolarHBondContact O-N 2.85Å; N132-S134 PolarHBondContact O-N 3.39Å; N132-S134 VanDerWaalsContact O-N 3.1Å
133	R	35.1	Very low	38	Very low	216 Å²	216	114.9 Å²	114.9	82%	0.815	65%	0.647	S	S	*	*			trans	-69.9	7.1	174.4	-109.3	-176.2	-175.2	-168.1	2.8	114.3	A131 Y135	A131-R133 PolarHBondContact O-N 3.14Å; R133-Y135 VanDerWaalsContact C-N 3.27Å; R133-Y135 PolarHBondContact O-N 3.39Å; R133-Y135 VanDerWaalsContact O-N 3.09Å
134	S	31.9	Very low	38	Very low	89 Å²	89	114.4 Å²	114.4	62%	0.622	65%	0.648	S	S	*	*			trans	-85.1	67.4	173.6	57.3	0	0	0	0	111.3	N132	N132-S134 PolarHBondContact O-N 3.39Å; N132-S134 VanDerWaalsContact O-N 3.1Å
135	Y	33.3	Very low	38.1	Very low	224 Å²	224	117.1 Å²	117.1	88%	0.878	66%	0.661	S	S	*	*	S	Bend	trans	-120.3	119.1	144.7	-99.6	-85.9	0	0	0	108.3	R133	R133-Y135 VanDerWaalsContact C-N 3.27Å; R133-Y135 PolarHBondContact O-N 3.39Å; R133-Y135 VanDerWaalsContact O-N 3.09Å
136	S	31.3	Very low	38.2	Very low	114 Å²	114	122.7 Å²	122.7	80%	0.797	68%	0.682	S	S	*	*			trans	-28.3	133.9	174.3	-177.8	0	0	0	0	114
137	A	32.2	Very low	38.4	Very low	78 Å²	78	128.2 Å²	128.2	65%	0.645	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-49.5	142.3	178.4	0	0	0	0	0	112.4	V139	A137-V139 PolarHBondContact O-N 2.87Å
138	P	37.1	Very low	39.2	Very low	130 Å²	130	131.3 Å²	131.3	84%	0.844	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-69.5	117	173	-3.1	17.9	0	0	0	109.3
139	V	37.2	Very low	39.8	Very low	126 Å²	126	132.9 Å²	132.9	76%	0.764	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-63.8	140.2	166.4	-86.2	0	0	0	0	110.4	A137 Y141	A137-V139 PolarHBondContact O-N 2.87Å; V139-Y141 PolarHBondContact O-N 2.86Å
140	P	38.3	Very low	40	Very low	129 Å²	129	135.4 Å²	135.4	84%	0.838	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-72.4	116.3	-179.8	-8.5	24.4	0	0	0	110.6	A142	P140-A142 PolarHBondContact O-N 2.9Å
141	Y	39.9	Very low	40.2	Very low	197 Å²	197	139.8 Å²	139.8	77%	0.773	77%	0.772	S	S	*	*			trans	-71.9	113.3	174.7	-130.8	-96	0	0	0	110.3	V139 V144	V139-Y141 PolarHBondContact O-N 2.86Å; Y141-V144 HydrophobicContact CD1-CG2 4.43Å; Y141-V144 HydrophobicContact CE1-CG2 3.7Å
142	A	37.3	Very low	40.1	Very low	70 Å²	70	141 Å²	141	58%	0.579	78%	0.776	S	S	*	*			trans	-74.2	149.2	159.8	0	0	0	0	0	109.2	P140 V144	P140-A142 PolarHBondContact O-N 2.9Å; A142-V144 PolarHBondContact O-N 3.36Å; A142-V144 VanDerWaalsContact O-N 3.15Å
143	P	36.4	Very low	40.8	Very low	135 Å²	135	138.7 Å²	138.7	88%	0.877	76%	0.764	S	S	*	*			trans	-72.5	111.4	-174.1	29.2	-30.3	0	0	0	109.7
144	V	47.3	Very low	41.5	Very low	111 Å²	111	132 Å²	132	67%	0.673	76%	0.763	S	S	*	*			trans	-112.3	134.8	167.3	-82.2	0	0	0	0	108.5	Y141 A142	Y141-V144 HydrophobicContact CD1-CG2 4.43Å; Y141-V144 HydrophobicContact CE1-CG2 3.7Å; A142-V144 PolarHBondContact O-N 3.36Å; A142-V144 VanDerWaalsContact O-N 3.15Å
145	E	47.2	Very low	42.8	Very low	188 Å²	188	132.8 Å²	132.8	88%	0.879	75%	0.753	S	S	*	*			trans	-54.2	145.4	-177.3	-66.7	165.8	141.8	0	0	111.2	E147	E145-E147 VanDerWaalsContact C-N 3.27Å; E145-E147 PolarHBondContact O-N 2.71Å
146	E	41.3	Very low	44.3	Very low	193 Å²	193	128.3 Å²	128.3	90%	0.902	74%	0.74	S	S	*	*			trans	-71	75.1	-170.6	-168.4	172.3	177.5	0	0	111.3
147	E	42.3	Very low	46.3	Very low	181 Å²	181	124.6 Å²	124.6	85%	0.846	71%	0.712	S	S	*	*			trans	-85	111.2	157.7	-71.4	-166.1	158.5	0	0	108.4	E145 P149	E145-E147 VanDerWaalsContact C-N 3.27Å; E145-E147 PolarHBondContact O-N 2.71Å; E147-P149 WeakPolarHBondContact O-CD 3.42Å
148	V	54.4	Low	48.5	Very low	124 Å²	124	125.9 Å²	125.9	75%	0.752	70%	0.702	S	S	*	*			trans	-50.4	117.4	174.9	178.3	0	0	0	0	109.3
149	P	53.5	Low	50.4	Low	106 Å²	106	123.6 Å²	123.6	69%	0.688	70%	0.701	S	S	*	*			trans	-64.7	134.2	175.5	25.4	-31.2	0	0	0	108.6	E147 M151	E147-P149 WeakPolarHBondContact O-CD 3.42Å; P149-M151 PolarHBondContact O-N 2.99Å
150	P	45.9	Very low	52.5	Low	110 Å²	110	119.6 Å²	119.6	71%	0.714	68%	0.675	S	S	*	*			trans	-65.1	111.3	173.8	27.4	-31.2	0	0	0	107.2	S152	P150-S152 PolarHBondContact O-N 3.25Å; P150-S152 PolarHBondContact O-OG 2.98Å
151	M	43.7	Very low	54.5	Low	192 Å²	192	116.4 Å²	116.4	95%	0.946	66%	0.656	S	S	*	*			trans	-57.4	88.1	163.2	-91.5	179.3	163.7	0	0	107.7	P149	P149-M151 PolarHBondContact O-N 2.99Å
152	S	43.7	Very low	56.3	Low	92 Å²	92	111.3 Å²	111.3	64%	0.643	65%	0.647	S	S	*	*			trans	-116.5	63.5	168.3	52.6	0	0	0	0	106.4	P150 G154	P150-S152 PolarHBondContact O-N 3.25Å; P150-S152 PolarHBondContact O-OG 2.98Å; S152-G154 PolarHBondContact O-N 3.05Å
153	D	47.1	Very low	58.3	Low	107 Å²	107	113.4 Å²	113.4	57%	0.572	65%	0.648	S	S	*	*			trans	-61.5	104.4	149.9	-71.8	-28.2	0	0	0	105	Y155	D153-Y155 HydrophobicContact CB-CD2 3.88Å; D153-Y155 HydrophobicContact CB-CE1 4.07Å; D153-Y155 HydrophobicContact CB-CE2 3.14Å; D153-Y155 VanDerWaalsContact CB-OH 3.25Å; D153-Y155 WeakPolarHBondContact CB-OH 3.46Å; D153-Y155 VanDerWaalsContact CG-OH 3.3Å; D153-Y155 WeakPolarHBondContact O-CD2 2.81Å; D153-Y155 PolarHBondContact O-N 3.11Å; D153-Y155 PolarHBondContact OD2-OH 3.4Å
154	G	49.8	Very low	60.7	Low	77 Å²	77	110.7 Å²	110.7	79%	0.794	62%	0.623	S	S	*	*			trans	-70.9	61.2	-172.2	0	0	0	0	0	112.4	S152 E156	S152-G154 PolarHBondContact O-N 3.05Å; G154-E156 PolarHBondContact O-N 3.11Å
155	Y	60.4	Low	62.4	Low	104 Å²	104	105.6 Å²	105.6	41%	0.408	59%	0.592	S	S	.	*			trans	-70.6	125.1	167	-43.3	-70.7	0	0	0	107.7	D153 T157 P172 P173	D153-Y155 HydrophobicContact CB-CD2 3.88Å; D153-Y155 HydrophobicContact CB-CE1 4.07Å; D153-Y155 HydrophobicContact CB-CE2 3.14Å; D153-Y155 VanDerWaalsContact CB-OH 3.25Å; D153-Y155 WeakPolarHBondContact CB-OH 3.46Å; D153-Y155 VanDerWaalsContact CG-OH 3.3Å; D153-Y155 WeakPolarHBondContact O-CD2 2.81Å; D153-Y155 PolarHBondContact O-N 3.11Å; D153-Y155 PolarHBondContact OD2-OH 3.4Å; Y155-T157 PolarHBondContact O-N 2.82Å; Y155-P172 HydrophobicContact CD2-CB 3.53Å; Y155-P172 HydrophobicContact CD2-CG 3.69Å; Y155-P172 HydrophobicContact CE2-CB 4.17Å; Y155-P172 HydrophobicContact CE2-CG 3.99Å; Y155-P172 HydrophobicContact CG-CB 3.76Å; Y155-P172 HydrophobicContact CG-CG 4.42Å; Y155-P173 HydrophobicContact CD1-CB 4.21Å
156	E	65.2	Low	64.2	Low	131 Å²	131	100.8 Å²	100.8	61%	0.612	58%	0.579	S	S	*	*			trans	-61.6	99.2	172.4	-63.8	-178	165.4	0	0	108.6	G154 Y158	G154-E156 PolarHBondContact O-N 3.11Å; E156-Y158 HydrophobicContact CB-CD2 4.49Å; E156-Y158 HydrophobicContact CB-CE1 4.12Å; E156-Y158 HydrophobicContact CB-CE2 4.1Å; E156-Y158 WeakPolarHBondContact O-CD2 3.47Å; E156-Y158 VanDerWaalsContact O-CE2 3.28Å; E156-Y158 WeakPolarHBondContact O-CE2 3.21Å; E156-Y158 PolarHBondContact O-N 3.14Å; E156-Y158 WeakPolarHBondContact OE2-CE1 3.2Å; E156-Y158 PolarHBondContact OE2-OH 2.82Å
157	T	72.6	Confident	66.3	Low	35 Å²	35	101.1 Å²	101.1	22%	0.215	57%	0.572	C	S	.	*			trans	-78.3	8.4	172	60.9	0	0	0	0	111.8	Y155 G159 L160 L165	Y155-T157 PolarHBondContact O-N 2.82Å; T157-G159 PolarHBondContact O-N 2.83Å; T157-G159 VanDerWaalsContact O-N 3.14Å; T157-L160 VanDerWaalsContact CB-O 3.31Å; T157-L160 WeakPolarHBondContact CB-O 3.22Å; T157-L160 WeakPolarHBondContact O-CB 3.21Å; T157-L160 WeakPolarHBondContact O-CG 3.39Å; T157-L160 PolarHBondContact O-N 3.31Å; T157-L160 PolarHBondContact OG1-O 3.02Å; T157-L165 HydrophobicContact CG2-CD1 3.78Å
158	Y	77.9	Confident	68.3	Low	106 Å²	106	94.4 Å²	94.4	42%	0.416	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	42.3	-179.4	-59.3	-76.7	0	0	0	113.1	E156 L160 L174 H225 P226 V227	E156-Y158 HydrophobicContact CB-CD2 4.49Å; E156-Y158 HydrophobicContact CB-CE1 4.12Å; E156-Y158 HydrophobicContact CB-CE2 4.1Å; E156-Y158 WeakPolarHBondContact O-CD2 3.47Å; E156-Y158 VanDerWaalsContact O-CE2 3.28Å; E156-Y158 WeakPolarHBondContact O-CE2 3.21Å; E156-Y158 PolarHBondContact O-N 3.14Å; E156-Y158 WeakPolarHBondContact OE2-CE1 3.2Å; E156-Y158 PolarHBondContact OE2-OH 2.82Å; Y158-L160 VanDerWaalsContact C-N 3.28Å; Y158-L160 PolarHBondContact O-N 3.1Å; Y158-L174 HydrophobicContact CD2-CD1 4.05Å; Y158-H225 AromaticContact CD1-CE1 3.99Å; Y158-P226 HydrophobicContact CD2-CB 4.48Å; Y158-P226 HydrophobicContact CD2-CG 3.62Å; Y158-P226 HydrophobicContact CE2-CB 4.2Å; Y158-P226 HydrophobicContact CE2-CG 3.23Å; Y158-V227 HydrophobicContact CD2-CG2 4.35Å; Y158-V227 HydrophobicContact CG-CG2 4.07Å
159	G	77.3	Confident	69.6	Low	81 Å²	81	91.7 Å²	91.7	84%	0.835	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	2.9	-179.3	0	0	0	0	0	115.3	T157	T157-G159 PolarHBondContact O-N 2.83Å; T157-G159 VanDerWaalsContact O-N 3.14Å
160	L	80.6	Confident	71.1	Confident	42 Å²	42	86.9 Å²	86.9	22%	0.22	51%	0.507	C	S	.	.			trans	-81.5	136.5	174.6	-58.3	175.8	0	0	0	110.7	T157 Y158 L165 V230	T157-L160 VanDerWaalsContact CB-O 3.31Å; T157-L160 WeakPolarHBondContact CB-O 3.22Å; T157-L160 WeakPolarHBondContact O-CB 3.21Å; T157-L160 WeakPolarHBondContact O-CG 3.39Å; T157-L160 PolarHBondContact O-N 3.31Å; T157-L160 PolarHBondContact OG1-O 3.02Å; Y158-L160 VanDerWaalsContact C-N 3.28Å; Y158-L160 PolarHBondContact O-N 3.1Å; L160-L165 HydrophobicContact CD1-CD2 4.24Å; L160-V230 HydrophobicContact CD1-CB 4.19Å; L160-V230 HydrophobicContact CD1-CG1 3.94Å; L160-V230 HydrophobicContact CD1-CG2 4.21Å
161	S	80.5	Confident	72.6	Confident	63 Å²	63	89.6 Å²	89.6	44%	0.441	51%	0.51	S	S	.	.			trans	-65.9	134	177	70.7	0	0	0	0	110.5	L163 F164 L165	S161-L163 PolarHBondContact O-N 2.91Å; S161-L163 VanDerWaalsContact O-N 3.16Å; S161-F164 WeakPolarHBondContact O-CB 3.25Å; S161-F164 PolarHBondContact O-N 3.32Å; S161-F164 WeakPolarHBondContact OG-CB 3.31Å; S161-F164 PolarHBondContact OG-N 3.42Å; S161-L165 PolarHBondContact O-N 2.86Å
162	P	77.5	Confident	74.2	Confident	90 Å²	90	83.2 Å²	83.2	58%	0.584	48%	0.482	S	S	*	.	H	α-helix	trans	-55.9	-32.7	175	-26.9	34.5	0	0	0	112.6	F164 L165 S166	P162-F164 VanDerWaalsContact C-N 3.33Å; P162-F164 PolarHBondContact O-N 2.9Å; P162-L165 PolarHBondContact O-N 3.23Å; P162-S166 PolarHBondContact O-N 3.44Å; P162-S166 PolarHBondContact O-OG 3.34Å; P162-S166 VanDerWaalsContact O-OG 3.08Å
163	L	81	Confident	76	Confident	114 Å²	114	82.8 Å²	82.8	60%	0.597	48%	0.478	S	S	*	.	H	α-helix	trans	-64	-36.8	176.1	-169.8	67.5	0	0	0	112.7	S161 R167	S161-L163 PolarHBondContact O-N 2.91Å; S161-L163 VanDerWaalsContact O-N 3.16Å; L163-R167 WeakPolarHBondContact O-CG 3.13Å; L163-R167 PolarHBondContact O-N 2.89Å; L163-R167 VanDerWaalsContact O-N 3.13Å
164	F	84.8	Confident	77.7	Confident	78 Å²	78	78.8 Å²	78.8	34%	0.342	46%	0.456	S	S	.	.	H	α-helix	trans	-67	-43.6	176	177.9	-105.3	0	0	0	111.3	S161 P162 S166 R167 L168 V230	S161-F164 WeakPolarHBondContact O-CB 3.25Å; S161-F164 PolarHBondContact O-N 3.32Å; S161-F164 WeakPolarHBondContact OG-CB 3.31Å; S161-F164 PolarHBondContact OG-N 3.42Å; P162-F164 VanDerWaalsContact C-N 3.33Å; P162-F164 PolarHBondContact O-N 2.9Å; F164-S166 VanDerWaalsContact C-N 3.35Å; F164-S166 PolarHBondContact O-N 2.83Å; F164-R167 PolarHBondContact O-N 3.48Å; F164-L168 HydrophobicContact CD1-CD1 4.14Å; F164-L168 HydrophobicContact CE1-CD1 3.53Å; F164-L168 HydrophobicContact CE2-CD1 4.34Å; F164-L168 HydrophobicContact CZ-CD1 3.65Å; F164-L168 HydrophobicContact CZ-CG 4.4Å; F164-L168 PolarHBondContact O-N 2.87Å; F164-V230 HydrophobicContact CE1-CG1 4.05Å
165	L	84.9	Confident	79.5	Confident	4 Å²	4	77.3 Å²	77.3	2%	0.021	43%	0.432	C	S	.	.	H	α-helix	trans	-60.9	-43.8	176	-64.1	173.2	0	0	0	111.6	T157 L160 S161 P162 R167 L168 G169 I170 L174 V230	T157-L165 HydrophobicContact CG2-CD1 3.78Å; L160-L165 HydrophobicContact CD1-CD2 4.24Å; S161-L165 PolarHBondContact O-N 2.86Å; P162-L165 PolarHBondContact O-N 3.23Å; L165-R167 VanDerWaalsContact C-N 3.32Å; L165-R167 PolarHBondContact O-N 3.48Å; L165-L168 CarbonylContact O-C 3.57Å; L165-L168 PolarHBondContact O-N 3.18Å; L165-L168 VanDerWaalsContact O-N 3.12Å; L165-G169 PolarHBondContact O-N 3.46Å; L165-G169 VanDerWaalsContact O-N 3.14Å; L165-I170 HydrophobicContact CB-CB 4.46Å; L165-I170 HydrophobicContact CD2-CB 4.41Å; L165-I170 HydrophobicContact CD2-CD1 4.42Å; L165-I170 HydrophobicContact CD2-CG2 4.35Å; L165-I170 PolarHBondContact O-N 2.97Å; L165-L174 HydrophobicContact CD1-CD2 4.22Å; L165-L174 HydrophobicContact CD2-CD2 3.85Å; L165-V230 HydrophobicContact CD2-CG1 3.99Å; L165-V230 HydrophobicContact CD2-CG2 4.1Å
166	S	83.6	Confident	80.9	Confident	86 Å²	86	75.2 Å²	75.2	60%	0.601	43%	0.428	S	S	*	.	H	α-helix	trans	-61.2	-37.1	176.3	-62.9	0	0	0	0	113	P162 F164 L168 G169	P162-S166 PolarHBondContact O-N 3.44Å; P162-S166 PolarHBondContact O-OG 3.34Å; P162-S166 VanDerWaalsContact O-OG 3.08Å; F164-S166 VanDerWaalsContact C-N 3.35Å; F164-S166 PolarHBondContact O-N 2.83Å; S166-L168 VanDerWaalsContact C-N 3.31Å; S166-L168 PolarHBondContact O-N 3.04Å; S166-G169 PolarHBondContact O-N 3.02Å; S166-G169 VanDerWaalsContact O-N 3.12Å
167	R	85.6	Confident	82.1	Confident	201 Å²	201	70.6 Å²	70.6	76%	0.758	40%	0.404	S	S	*	.	H	α-helix	trans	-66.6	-33.5	175.7	-75.2	178.9	-175	-178.1	2.6	112.7	L163 F164 L165 G169	L163-R167 WeakPolarHBondContact O-CG 3.13Å; L163-R167 PolarHBondContact O-N 2.89Å; L163-R167 VanDerWaalsContact O-N 3.13Å; F164-R167 PolarHBondContact O-N 3.48Å; L165-R167 VanDerWaalsContact C-N 3.32Å; L165-R167 PolarHBondContact O-N 3.48Å; R167-G169 PolarHBondContact O-N 3.04Å
168	L	84.1	Confident	83.1	Confident	40 Å²	40	68.9 Å²	68.9	21%	0.209	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-4.2	174.5	-64.4	178.7	0	0	0	112.9	F164 L165 S166 I170 V230 V233	F164-L168 HydrophobicContact CD1-CD1 4.14Å; F164-L168 HydrophobicContact CE1-CD1 3.53Å; F164-L168 HydrophobicContact CE2-CD1 4.34Å; F164-L168 HydrophobicContact CZ-CD1 3.65Å; F164-L168 HydrophobicContact CZ-CG 4.4Å; F164-L168 PolarHBondContact O-N 2.87Å; L165-L168 CarbonylContact O-C 3.57Å; L165-L168 PolarHBondContact O-N 3.18Å; L165-L168 VanDerWaalsContact O-N 3.12Å; S166-L168 VanDerWaalsContact C-N 3.31Å; S166-L168 PolarHBondContact O-N 3.04Å; L168-I170 VanDerWaalsContact C-N 3.27Å; L168-I170 HydrophobicContact CB-CD1 3.85Å; L168-I170 HydrophobicContact CB-CG1 3.9Å; L168-I170 HydrophobicContact CD1-CD1 4.06Å; L168-I170 PolarHBondContact O-N 3.35Å; L168-V230 HydrophobicContact CD1-CG1 3.91Å; L168-V233 HydrophobicContact CB-CG1 4.47Å
169	G	82.8	Confident	83.8	Confident	66 Å²	66	67 Å²	67	68%	0.68	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	23.9	-175.9	0	0	0	0	0	113.3	L165 S166 R167	L165-G169 PolarHBondContact O-N 3.46Å; L165-G169 VanDerWaalsContact O-N 3.14Å; S166-G169 PolarHBondContact O-N 3.02Å; S166-G169 VanDerWaalsContact O-N 3.12Å; R167-G169 PolarHBondContact O-N 3.04Å
170	I	84.3	Confident	84.6	Confident	6 Å²	6	63.1 Å²	63.1	3%	0.031	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-94.1	120.9	179.3	-58.1	174.4	0	0	0	108.1	L165 L168 L174 V230 V233 M250	L165-I170 HydrophobicContact CB-CB 4.46Å; L165-I170 HydrophobicContact CD2-CB 4.41Å; L165-I170 HydrophobicContact CD2-CD1 4.42Å; L165-I170 HydrophobicContact CD2-CG2 4.35Å; L165-I170 PolarHBondContact O-N 2.97Å; L168-I170 VanDerWaalsContact C-N 3.27Å; L168-I170 HydrophobicContact CB-CD1 3.85Å; L168-I170 HydrophobicContact CB-CG1 3.9Å; L168-I170 HydrophobicContact CD1-CD1 4.06Å; L168-I170 PolarHBondContact O-N 3.35Å; I170-L174 HydrophobicContact CG2-CD2 3.77Å; I170-V230 HydrophobicContact CD1-CB 4.34Å; I170-V230 HydrophobicContact CD1-CG1 3.93Å; I170-V230 HydrophobicContact CD1-CG2 4.08Å; I170-V233 HydrophobicContact CD1-CB 4.14Å; I170-V233 HydrophobicContact CD1-CG1 3.96Å; I170-V233 HydrophobicContact CD1-CG2 4.39Å; I170-V233 HydrophobicContact CG1-CG1 4.29Å; I170-M250 HydrophobicContact CG1-CB 4.49Å; I170-M250 HydrophobicContact CG2-CB 4.1Å; I170-M250 HydrophobicContact CG2-CG 4.1Å; I170-M250 HydrophobicContact CG2-SD 4.42Å
171	Q	78.5	Confident	85.1	Confident	167 Å²	167	62.1 Å²	62.1	78%	0.78	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-94.3	135	170.7	-64.5	-175.5	48	0	0	108.9
172	P	76.5	Confident	85.6	Confident	57 Å²	57	62.6 Å²	62.6	37%	0.37	34%	0.343	S	S	.	.	S	Bend	trans	-63.9	151.5	170.8	28.3	-33.5	0	0	0	110.3	Y155	Y155-P172 HydrophobicContact CD2-CB 3.53Å; Y155-P172 HydrophobicContact CD2-CG 3.69Å; Y155-P172 HydrophobicContact CE2-CB 4.17Å; Y155-P172 HydrophobicContact CE2-CG 3.99Å; Y155-P172 HydrophobicContact CG-CB 3.76Å; Y155-P172 HydrophobicContact CG-CG 4.42Å
173	P	80.6	Confident	86.3	Confident	84 Å²	84	58.5 Å²	58.5	55%	0.545	32%	0.316	S	S	.	.	S	Bend	cis	-78.3	149.1	8.5	31.4	-36	0	0	0	114.4	Y155	Y155-P173 HydrophobicContact CD1-CB 4.21Å
174	L	83.5	Confident	86.7	Confident	23 Å²	23	53.6 Å²	53.6	12%	0.12	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-74.9	126.1	174.1	-59.3	177.3	0	0	0	110.2	Y158 L165 I170 P226 V230 M250	Y158-L174 HydrophobicContact CD2-CD1 4.05Å; L165-L174 HydrophobicContact CD1-CD2 4.22Å; L165-L174 HydrophobicContact CD2-CD2 3.85Å; I170-L174 HydrophobicContact CG2-CD2 3.77Å; L174-P226 HydrophobicContact CB-CB 3.92Å; L174-V230 HydrophobicContact CD1-CG2 4.36Å; L174-V230 HydrophobicContact CD2-CG2 3.73Å; L174-M250 HydrophobicContact CB-CE 4.23Å; L174-M250 HydrophobicContact CD2-CE 4.33Å
175	T	86.4	Confident	86.9	Confident	45 Å²	45	56.6 Å²	56.6	28%	0.276	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-103	166.2	175.6	61.9	0	0	0	0	111.9	R177 P226 M250 D251	T175-R177 PolarHBondContact OG1-O 3.45Å; T175-P226 WeakPolarHBondContact O-CA 3.46Å; T175-P226 WeakPolarHBondContact O-CB 3.22Å; T175-M250 WeakPolarHBondContact O-CE 3.37Å; T175-D251 PolarHBondContact OG1-O 2.79Å
176	N	90.1	Very high	87	Confident	61 Å²	61	60.2 Å²	60.2	33%	0.326	33%	0.33	S	S	.	.	S	Bend	trans	-85	-0.7	173.2	-64.9	-16.6	0	0	0	112.5	E222 Y223 P226	N176-E222 HydrophobicContact CB-CG 4.42Å; N176-E222 WeakPolarHBondContact O-CA 3.45Å; N176-Y223 PolarHBondContact O-N 2.81Å; N176-P226 WeakPolarHBondContact OD1-CA 3.05Å; N176-P226 WeakPolarHBondContact OD1-CB 3.48Å; N176-P226 WeakPolarHBondContact OD1-CD 3.39Å
177	R	91.2	Very high	87	Confident	33 Å²	33	56.2 Å²	56.2	13%	0.125	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.7	-169.3	-69	-176.9	175	-161.9	0.4	110.5	T175 V220 V221 E222 D251	T175-R177 PolarHBondContact OG1-O 3.45Å; R177-V220 HydrophobicContact CB-CG1 4.4Å; R177-V221 CarbonylContact C-O 3.59Å; R177-V221 WeakPolarHBondContact CA-O 3.18Å; R177-E222 HydrophobicContact CG-CB 4.17Å; R177-E222 HydrophobicContact CG-CG 3.9Å; R177-E222 IonicContact CZ-OE2 3.05Å; R177-E222 IonicContact NE-OE2 2.94Å; R177-E222 PolarHBondContact NE-OE2 2.99Å; R177-E222 IonicContact NH2-OE2 2.55Å; R177-E222 PolarHBondContact NH2-OE2 3.24Å; R177-D251 HydrophobicContact CB-CB 3.76Å; R177-D251 VanDerWaalsContact O-CB 3.3Å; R177-D251 WeakPolarHBondContact O-CB 3.35Å; R177-D251 PolarHBondContact O-N 3.07Å
178	V	93	Very high	87.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	128.4	179.5	179.3	0	0	0	0	108.4	V180 V220 V221 Y223 A229 V233 V248 R249	V178-V180 HydrophobicContact CG1-CG2 4.4Å; V178-V220 WeakPolarHBondContact O-CA 3.23Å; V178-V221 PolarHBondContact N-O 3.29Å; V178-V221 PolarHBondContact O-N 2.84Å; V178-Y223 HydrophobicContact CB-CE2 4.34Å; V178-Y223 HydrophobicContact CG2-CD2 3.91Å; V178-Y223 HydrophobicContact CG2-CE2 3.83Å; V178-A229 HydrophobicContact CG2-CB 3.4Å; V178-A229 VanDerWaalsContact CG2-CB 3.4Å; V178-V233 HydrophobicContact CG1-CG2 4.14Å; V178-V248 HydrophobicContact CG1-CG1 3.19Å; V178-R249 WeakPolarHBondContact CG1-O 3.46Å
179	F	93.2	Very high	87.3	Confident	65 Å²	65	49 Å²	49	29%	0.285	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.1	172.6	-177.5	-102.1	0	0	0	110	V218 V220 R249 D251	F179-V218 HydrophobicContact CE2-CB 4Å; F179-V218 HydrophobicContact CE2-CG1 4.33Å; F179-V218 HydrophobicContact CZ-CB 3.88Å; F179-V218 HydrophobicContact CZ-CG1 3.7Å; F179-V220 HydrophobicContact CD2-CG2 4.09Å; F179-R249 PolarHBondContact N-O 2.9Å; F179-R249 PolarHBondContact O-N 3.36Å; F179-D251 HydrophobicContact CB-CB 4.34Å
180	V	93.4	Very high	87.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.8	179.4	-170.8	0	0	0	0	108.1	V178 V183 F196 V218 A219 V221 V248	V178-V180 HydrophobicContact CG1-CG2 4.4Å; V180-V183 HydrophobicContact CB-CG2 4.19Å; V180-V183 HydrophobicContact CG1-CG2 3.49Å; V180-V183 VanDerWaalsContact CG1-CG2 3.49Å; V180-F196 HydrophobicContact CB-CZ 4.01Å; V180-F196 HydrophobicContact CG1-CE2 4.06Å; V180-F196 HydrophobicContact CG1-CZ 3.59Å; V180-F196 HydrophobicContact CG2-CD1 4.36Å; V180-F196 HydrophobicContact CG2-CE1 3.44Å; V180-F196 VanDerWaalsContact CG2-CE1 3.44Å; V180-F196 HydrophobicContact CG2-CE2 3.92Å; V180-F196 HydrophobicContact CG2-CZ 3.18Å; V180-V218 CarbonylContact O-C 3.56Å; V180-V218 VanDerWaalsContact O-CA 3.27Å; V180-V218 WeakPolarHBondContact O-CA 3.44Å; V180-A219 HydrophobicContact CB-CB 4.28Å; V180-A219 PolarHBondContact N-O 3.26Å; V180-A219 PolarHBondContact O-N 3.5Å; V180-V221 HydrophobicContact CG2-CG2 4.12Å; V180-V248 HydrophobicContact CG1-CG2 4.28Å
181	S	91.4	Very high	88.1	Confident	22 Å²	22	54.2 Å²	54.2	15%	0.154	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	161.8	176	60.5	0	0	0	0	111.2	V183 N247	S181-V183 VanDerWaalsContact C-N 3.29Å; S181-V183 PolarHBondContact O-N 3.46Å; S181-N247 PolarHBondContact N-O 3.33Å; S181-N247 PolarHBondContact O-N 3.47Å; S181-N247 VanDerWaalsContact OG-CB 3.24Å; S181-N247 WeakPolarHBondContact OG-CB 3.43Å; S181-N247 PolarHBondContact OG-ND2 2.79Å; S181-N247 PolarHBondContact OG-O 2.81Å
182	N	92.1	Very high	88.8	Confident	73 Å²	73	46.4 Å²	46.4	39%	0.39	26%	0.264	S	S	.	.	S	Bend	trans	66.8	23.4	-179.8	-157.5	35	0	0	0	115.3	G217 K244 A245	N182-G217 PolarHBondContact N-O 2.8Å; N182-K244 PolarHBondContact O-NZ 3.16Å; N182-K244 WeakPolarHBondContact OD1-CE 3.31Å; N182-K244 PolarHBondContact OD1-NZ 3.4Å; N182-A245 WeakPolarHBondContact CB-O 3.41Å; N182-A245 PolarHBondContact ND2-O 3.06Å
183	V	91.4	Very high	89.6	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.018	27%	0.27	C	S	.	.			trans	-63.4	138.3	175.4	-175.8	0	0	0	0	110	V180 S181 A187 I192 G217 A219 K244 L246	V180-V183 HydrophobicContact CB-CG2 4.19Å; V180-V183 HydrophobicContact CG1-CG2 3.49Å; V180-V183 VanDerWaalsContact CG1-CG2 3.49Å; S181-V183 VanDerWaalsContact C-N 3.29Å; S181-V183 PolarHBondContact O-N 3.46Å; V183-A187 HydrophobicContact CG1-CB 3.77Å; V183-I192 HydrophobicContact CG1-CD1 3.9Å; V183-I192 HydrophobicContact CG1-CG1 4.18Å; V183-G217 PolarHBondContact N-O 3.27Å; V183-G217 WeakPolarHBondContact O-CA 3.43Å; V183-A219 HydrophobicContact CG2-CB 4.41Å; V183-K244 PolarHBondContact O-NZ 3.17Å; V183-L246 HydrophobicContact CG2-CD2 4.21Å
184	P	90.4	Very high	90.2	Very high	12 Å²	12	50.5 Å²	50.5	8%	0.078	27%	0.269	C	S	.	.			trans	-69.8	143.7	176	24.6	-29.4	0	0	0	111.5	S186 A187 Y241 F242 K244	P184-S186 PolarHBondContact O-N 2.97Å; P184-S186 VanDerWaalsContact O-N 3.07Å; P184-A187 HydrophobicContact CG-CB 4.03Å; P184-A187 WeakPolarHBondContact O-CB 3.46Å; P184-A187 PolarHBondContact O-N 3.22Å; P184-Y241 HydrophobicContact CG-CD1 3.66Å; P184-Y241 HydrophobicContact CG-CE1 4Å; P184-F242 HydrophobicContact CG-CD2 3.75Å; P184-F242 HydrophobicContact CG-CE2 4.43Å; P184-K244 HydrophobicContact CB-CD 4.01Å
185	F	88.1	Confident	90.6	Very high	140 Å²	140	50.6 Å²	50.6	61%	0.614	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.5	-177.1	-57.9	-67.3	0	0	0	114.1	A187 S215	F185-A187 VanDerWaalsContact C-N 3.28Å; F185-S215 WeakPolarHBondContact CA-OG 3.45Å; F185-S215 WeakPolarHBondContact CD1-O 3.28Å; F185-S215 WeakPolarHBondContact CE1-O 3.2Å; F185-S215 PolarHBondContact O-OG 3.4Å
186	S	86.3	Confident	90.9	Very high	81 Å²	81	48.6 Å²	48.6	57%	0.566	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-12.2	175.1	-175.5	0	0	0	0	113.5	P184 G188 K191	P184-S186 PolarHBondContact O-N 2.97Å; P184-S186 VanDerWaalsContact O-N 3.07Å; S186-G188 PolarHBondContact O-N 2.94Å; S186-K191 PolarHBondContact O-NZ 3.25Å; S186-K191 PolarHBondContact OG-NZ 3.23Å
187	A	84.7	Confident	91.1	Very high	1 Å²	1	49 Å²	49	1%	0.008	27%	0.265	C	S	.	.			trans	-89.2	101.4	178.3	0	0	0	0	0	110.8	V183 P184 F185 K191 I192 Y241	V183-A187 HydrophobicContact CG1-CB 3.77Å; P184-A187 HydrophobicContact CG-CB 4.03Å; P184-A187 WeakPolarHBondContact O-CB 3.46Å; P184-A187 PolarHBondContact O-N 3.22Å; F185-A187 VanDerWaalsContact C-N 3.28Å; A187-K191 HydrophobicContact CB-CB 4.49Å; A187-I192 HydrophobicContact CB-CG1 4.22Å; A187-Y241 HydrophobicContact CB-CE1 3.84Å
188	G	86.3	Confident	91.2	Very high	33 Å²	33	53.3 Å²	53.3	34%	0.34	29%	0.289	S	S	.	.			trans	-80.1	177.9	169	0	0	0	0	0	112.4	S186 T190 K191 I192	S186-G188 PolarHBondContact O-N 2.94Å; G188-T190 VanDerWaalsContact C-N 3.26Å; G188-T190 PolarHBondContact O-N 3.48Å; G188-K191 PolarHBondContact O-N 3.32Å; G188-K191 VanDerWaalsContact O-N 3.17Å; G188-I192 WeakPolarHBondContact O-CG1 3.36Å; G188-I192 PolarHBondContact O-N 3.47Å; G188-I192 VanDerWaalsContact O-N 3.14Å
189	T	89.2	Confident	91.1	Very high	57 Å²	57	53.5 Å²	53.5	35%	0.35	29%	0.291	S	S	.	.	H	α-helix	trans	-52.2	-40.6	-178.3	-47.9	0	0	0	0	113.3	I192 R193 V205	T189-I192 PolarHBondContact O-N 3.33Å; T189-R193 WeakPolarHBondContact O-CB 3.3Å; T189-R193 PolarHBondContact O-N 3.06Å; T189-V205 HydrophobicContact CG2-CB 3.78Å; T189-V205 HydrophobicContact CG2-CG1 3.81Å
190	T	91.7	Very high	91.1	Very high	101 Å²	101	51.1 Å²	51.1	62%	0.62	29%	0.285	S	S	*	.	H	α-helix	trans	-62.1	-50.9	179.3	-43.9	0	0	0	0	111.8	G188 I192 R193 D194	G188-T190 VanDerWaalsContact C-N 3.26Å; G188-T190 PolarHBondContact O-N 3.48Å; T190-I192 VanDerWaalsContact C-N 3.3Å; T190-I192 PolarHBondContact O-N 3.28Å; T190-R193 WeakPolarHBondContact O-CB 3.38Å; T190-R193 PolarHBondContact O-N 3.32Å; T190-R193 VanDerWaalsContact O-N 3.16Å; T190-D194 PolarHBondContact O-N 3.34Å
191	K	92.1	Very high	91.2	Very high	80 Å²	80	58.2 Å²	58.2	35%	0.348	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-38.2	-179.2	-69.9	177.7	-179.2	173.2	0	112	S186 A187 G188 D194 V195	S186-K191 PolarHBondContact O-NZ 3.25Å; S186-K191 PolarHBondContact OG-NZ 3.23Å; A187-K191 HydrophobicContact CB-CB 4.49Å; G188-K191 PolarHBondContact O-N 3.32Å; G188-K191 VanDerWaalsContact O-N 3.17Å; K191-D194 PolarHBondContact O-N 3.4Å; K191-V195 VanDerWaalsContact O-CG2 3.29Å; K191-V195 WeakPolarHBondContact O-CG2 3.49Å; K191-V195 PolarHBondContact O-N 3.08Å; K191-V195 VanDerWaalsContact O-N 3.1Å
192	I	92.6	Very high	91.3	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.015	32%	0.316	C	S	.	.	H	α-helix	trans	-66.9	-44.8	176.9	-64.6	166.1	0	0	0	109.6	V183 A187 G188 T189 T190 D194 V195 F196 V205 L207 A219 V221	V183-I192 HydrophobicContact CG1-CD1 3.9Å; V183-I192 HydrophobicContact CG1-CG1 4.18Å; A187-I192 HydrophobicContact CB-CG1 4.22Å; G188-I192 WeakPolarHBondContact O-CG1 3.36Å; G188-I192 PolarHBondContact O-N 3.47Å; G188-I192 VanDerWaalsContact O-N 3.14Å; T189-I192 PolarHBondContact O-N 3.33Å; T190-I192 VanDerWaalsContact C-N 3.3Å; T190-I192 PolarHBondContact O-N 3.28Å; I192-D194 VanDerWaalsContact C-N 3.29Å; I192-D194 PolarHBondContact O-N 3.44Å; I192-V195 PolarHBondContact O-N 3.08Å; I192-F196 HydrophobicContact CG2-CD2 3.73Å; I192-F196 HydrophobicContact CG2-CE2 4.08Å; I192-F196 WeakPolarHBondContact O-CB 3.5Å; I192-F196 VanDerWaalsContact O-CD2 3.26Å; I192-F196 WeakPolarHBondContact O-CD2 3.16Å; I192-F196 PolarHBondContact O-N 2.97Å; I192-V205 HydrophobicContact CB-CG1 4.4Å; I192-V205 HydrophobicContact CG2-CG1 3.96Å; I192-L207 HydrophobicContact CD1-CD1 3.33Å; I192-L207 HydrophobicContact CD1-CD2 4.3Å; I192-L207 HydrophobicContact CD1-CG 4.4Å; I192-A219 HydrophobicContact CD1-CB 4Å; I192-A219 HydrophobicContact CG2-CB 4.36Å; I192-V221 HydrophobicContact CG2-CG2 4.03Å
193	R	93.1	Very high	91.4	Very high	131 Å²	131	58.4 Å²	58.4	49%	0.494	32%	0.319	S	S	.	.	H	α-helix	trans	-55.4	-46.4	174.4	-175.8	-174	-66.6	-172.5	-3.2	111.3	T189 T190 V195 F196 S197 V205	T189-R193 WeakPolarHBondContact O-CB 3.3Å; T189-R193 PolarHBondContact O-N 3.06Å; T190-R193 WeakPolarHBondContact O-CB 3.38Å; T190-R193 PolarHBondContact O-N 3.32Å; T190-R193 VanDerWaalsContact O-N 3.16Å; R193-V195 PolarHBondContact O-N 2.93Å; R193-F196 PolarHBondContact O-N 3.27Å; R193-S197 VanDerWaalsContact O-CB 3.22Å; R193-S197 WeakPolarHBondContact O-CB 3.3Å; R193-S197 PolarHBondContact O-N 3.16Å; R193-V205 HydrophobicContact CB-CG2 4.19Å
194	D	93.1	Very high	91.3	Very high	97 Å²	97	63.3 Å²	63.3	52%	0.519	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-42.9	-178.2	-60.8	-22.1	0	0	0	112	T190 K191 I192	T190-D194 PolarHBondContact O-N 3.34Å; K191-D194 PolarHBondContact O-N 3.4Å; I192-D194 VanDerWaalsContact C-N 3.29Å; I192-D194 PolarHBondContact O-N 3.44Å
195	V	92.3	Very high	91.3	Very high	24 Å²	24	63.3 Å²	63.3	15%	0.145	34%	0.34	C	S	.	.	H	α-helix	trans	-66.8	-45.3	177.9	174	0	0	0	0	111.5	K191 I192 R193 S197 I198 L236 Y241	K191-V195 VanDerWaalsContact O-CG2 3.29Å; K191-V195 WeakPolarHBondContact O-CG2 3.49Å; K191-V195 PolarHBondContact O-N 3.08Å; K191-V195 VanDerWaalsContact O-N 3.1Å; I192-V195 PolarHBondContact O-N 3.08Å; R193-V195 PolarHBondContact O-N 2.93Å; V195-S197 VanDerWaalsContact C-N 3.31Å; V195-S197 PolarHBondContact O-N 3.16Å; V195-I198 PolarHBondContact O-N 3.22Å; V195-L236 HydrophobicContact CG1-CD2 4.32Å; V195-Y241 HydrophobicContact CG2-CD2 4.1Å; V195-Y241 HydrophobicContact CG2-CE2 3.39Å
196	F	94	Very high	91.4	Very high	3 Å²	3	60.5 Å²	60.5	1%	0.013	33%	0.329	C	S	.	.	H	α-helix	trans	-78.3	-17.3	-176.4	-80	-95.1	0	0	0	112.9	V180 I192 R193 I198 A199 V202 V221 Y223 L236 L246 V248	V180-F196 HydrophobicContact CB-CZ 4.01Å; V180-F196 HydrophobicContact CG1-CE2 4.06Å; V180-F196 HydrophobicContact CG1-CZ 3.59Å; V180-F196 HydrophobicContact CG2-CD1 4.36Å; V180-F196 HydrophobicContact CG2-CE1 3.44Å; V180-F196 VanDerWaalsContact CG2-CE1 3.44Å; V180-F196 HydrophobicContact CG2-CE2 3.92Å; V180-F196 HydrophobicContact CG2-CZ 3.18Å; I192-F196 HydrophobicContact CG2-CD2 3.73Å; I192-F196 HydrophobicContact CG2-CE2 4.08Å; I192-F196 WeakPolarHBondContact O-CB 3.5Å; I192-F196 VanDerWaalsContact O-CD2 3.26Å; I192-F196 WeakPolarHBondContact O-CD2 3.16Å; I192-F196 PolarHBondContact O-N 2.97Å; R193-F196 PolarHBondContact O-N 3.27Å; F196-I198 PolarHBondContact O-N 3.04Å; F196-A199 PolarHBondContact O-N 2.99Å; F196-V202 HydrophobicContact CB-CG2 4.12Å; F196-V221 HydrophobicContact CB-CG1 4.11Å; F196-V221 HydrophobicContact CB-CG2 4.47Å; F196-V221 HydrophobicContact CD1-CB 4.44Å; F196-V221 HydrophobicContact CD1-CG1 4.4Å; F196-V221 HydrophobicContact CD1-CG2 4.12Å; F196-V221 HydrophobicContact CD2-CG2 4.34Å; F196-V221 HydrophobicContact CG-CG1 4.39Å; F196-V221 HydrophobicContact CG-CG2 4.03Å; F196-Y223 WeakPolarHBondContact CB-OH 3.37Å; F196-Y223 VanDerWaalsContact CD1-OH 3.29Å; F196-Y223 WeakPolarHBondContact CD1-OH 3.37Å; F196-Y223 PolarHBondContact O-OH 3.35Å; F196-L236 HydrophobicContact CD1-CD1 3.61Å; F196-L236 HydrophobicContact CD2-CD1 4.44Å; F196-L236 HydrophobicContact CE1-CD1 3.62Å; F196-L236 HydrophobicContact CE2-CD1 4.48Å; F196-L236 HydrophobicContact CG-CD1 4.02Å; F196-L236 HydrophobicContact CZ-CD1 4.06Å; F196-L246 HydrophobicContact CE2-CD1 4.49Å; F196-V248 HydrophobicContact CE1-CG1 4.07Å; F196-V248 HydrophobicContact CE1-CG2 4.19Å; F196-V248 HydrophobicContact CZ-CG2 4Å
197	S	94.1	Very high	91.5	Very high	70 Å²	70	57.8 Å²	57.8	49%	0.49	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.6	172.5	-171.2	0	0	0	0	113.3	R193 V195 A199 G200	R193-S197 VanDerWaalsContact O-CB 3.22Å; R193-S197 WeakPolarHBondContact O-CB 3.3Å; R193-S197 PolarHBondContact O-N 3.16Å; V195-S197 VanDerWaalsContact C-N 3.31Å; V195-S197 PolarHBondContact O-N 3.16Å; S197-A199 VanDerWaalsContact C-N 3.29Å; S197-G200 WeakPolarHBondContact CA-O 3.2Å
198	I	93.2	Very high	91.6	Very high	123 Å²	123	59.7 Å²	59.7	63%	0.631	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-31	177.2	-60.1	171.2	0	0	0	111	V195 F196	V195-I198 PolarHBondContact O-N 3.22Å; F196-I198 PolarHBondContact O-N 3.04Å
199	A	91.1	Very high	91.6	Very high	4 Å²	4	63 Å²	63	3%	0.033	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-21.2	-178.7	0	0	0	0	0	113.7	F196 S197 A232 L236	F196-A199 PolarHBondContact O-N 2.99Å; S197-A199 VanDerWaalsContact C-N 3.29Å; A199-A232 HydrophobicContact CB-CB 3.63Å; A199-L236 HydrophobicContact CB-CD1 4.43Å
200	G	93.3	Very high	91.5	Very high	15 Å²	15	63.1 Å²	63.1	16%	0.155	33%	0.327	C	S	.	.	S	Bend	trans	169.8	-177.9	-178.9	0	0	0	0	0	113.9	S197 V202 E228	S197-G200 WeakPolarHBondContact CA-O 3.2Å; G200-V202 PolarHBondContact O-N 2.92Å; G200-E228 WeakPolarHBondContact CA-OE1 3.35Å
201	K	95.2	Very high	91.1	Very high	149 Å²	149	67.8 Å²	67.8	65%	0.648	34%	0.339	S	S	*	.			trans	-78.9	108.9	-179.1	-173.7	-179.7	179.6	-177.4	0	111.5	Y223 S224 E228	K201-Y223 WeakPolarHBondContact O-CA 3.38Å; K201-S224 PolarHBondContact O-N 3.46Å; K201-E228 PolarHBondContact N-OE1 3.19Å
202	V	93.9	Very high	90.7	Very high	25 Å²	25	68.2 Å²	68.2	15%	0.152	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119.8	178.4	-178.7	0	0	0	0	110.8	F196 G200 V205 V221 E222 Y223	F196-V202 HydrophobicContact CB-CG2 4.12Å; G200-V202 PolarHBondContact O-N 2.92Å; V202-V205 HydrophobicContact CG1-CG2 3.4Å; V202-V221 HydrophobicContact CB-CG1 4.46Å; V202-V221 HydrophobicContact CG1-CG1 3.71Å; V202-V221 HydrophobicContact CG2-CG1 3.95Å; V202-E222 CarbonylContact C-O 3.58Å; V202-E222 WeakPolarHBondContact CA-O 3.39Å; V202-Y223 HydrophobicContact CG2-CD1 4.29Å; V202-Y223 HydrophobicContact CG2-CE1 3.77Å
203	T	92.9	Very high	90.1	Very high	74 Å²	74	70.6 Å²	70.6	45%	0.454	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-43.2	176.9	53.4	0	0	0	0	111.5	E222	T203-E222 PolarHBondContact N-O 2.95Å; T203-E222 WeakPolarHBondContact OG1-CB 3.45Å; T203-E222 VanDerWaalsContact OG1-CG 3.31Å; T203-E222 WeakPolarHBondContact OG1-CG 3.4Å; T203-E222 PolarHBondContact OG1-O 3.34Å; T203-E222 VanDerWaalsContact OG1-O 3.1Å
204	F	89.7	Confident	89.5	Confident	107 Å²	107	71.5 Å²	71.5	47%	0.469	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	145.6	-176.6	-172.3	-107.7	0	0	0	111.3	E206 E222	F204-E206 HydrophobicContact CD1-CB 4.38Å; F204-E206 HydrophobicContact CE1-CB 3.77Å; F204-E206 HydrophobicContact CE1-CG 4.21Å; F204-E222 HydrophobicContact CB-CB 4.02Å; F204-E222 PolarHBondContact N-O 3.16Å; F204-E222 PolarHBondContact O-N 2.92Å
205	V	91.4	Very high	89.2	Confident	11 Å²	11	67.4 Å²	67.4	7%	0.067	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	118.8	174.3	-178.3	0	0	0	0	108	T189 I192 R193 V202 V221	T189-V205 HydrophobicContact CG2-CB 3.78Å; T189-V205 HydrophobicContact CG2-CG1 3.81Å; I192-V205 HydrophobicContact CB-CG1 4.4Å; I192-V205 HydrophobicContact CG2-CG1 3.96Å; R193-V205 HydrophobicContact CB-CG2 4.19Å; V202-V205 HydrophobicContact CG1-CG2 3.4Å; V205-V221 HydrophobicContact CG1-CG2 4.46Å; V205-V221 HydrophobicContact CG2-CG1 4.47Å
206	E	89.5	Confident	88.9	Confident	82 Å²	82	71.8 Å²	71.8	38%	0.383	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.3	174.3	-159.5	176.8	157	0	0	109.6	F204 A219 V220	F204-E206 HydrophobicContact CD1-CB 4.38Å; F204-E206 HydrophobicContact CE1-CB 3.77Å; F204-E206 HydrophobicContact CE1-CG 4.21Å; E206-A219 CarbonylContact O-C 3.59Å; E206-A219 WeakPolarHBondContact O-CA 2.96Å; E206-V220 HydrophobicContact CB-CB 4.2Å; E206-V220 PolarHBondContact N-O 3.02Å; E206-V220 PolarHBondContact O-N 2.87Å
207	L	89.1	Confident	88.7	Confident	24 Å²	24	72 Å²	72	13%	0.126	38%	0.38	C	S	.	.			trans	-120	94.4	174.6	-162.7	74.5	0	0	0	109.2	I192 L209 V218 A219	I192-L207 HydrophobicContact CD1-CD1 3.33Å; I192-L207 HydrophobicContact CD1-CD2 4.3Å; I192-L207 HydrophobicContact CD1-CG 4.4Å; L207-L209 HydrophobicContact CD2-CD2 4.3Å; L207-L209 PolarHBondContact O-N 2.94Å; L207-V218 WeakPolarHBondContact CD1-O 3.4Å; L207-A219 HydrophobicContact CD1-CB 3.55Å
208	P	85.9	Confident	88.6	Confident	40 Å²	40	70.4 Å²	70.4	26%	0.26	37%	0.367	S	S	.	.			trans	-59.3	114.2	176.8	-24.7	34.5	0	0	0	110.8	K216 V218	P208-K216 HydrophobicContact CB-CD 4.34Å; P208-K216 PolarHBondContact O-N 2.71Å; P208-K216 VanDerWaalsContact O-N 3.16Å; P208-V218 HydrophobicContact CG-CG2 4.42Å
209	L	87.4	Confident	88.5	Confident	102 Å²	102	64.5 Å²	64.5	53%	0.534	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-87	143.8	172.9	-56.3	178.9	0	0	0	109.3	L207	L207-L209 HydrophobicContact CD2-CD2 4.3Å; L207-L209 PolarHBondContact O-N 2.94Å
210	D	85.4	Confident	88.6	Confident	60 Å²	60	65.2 Å²	65.2	32%	0.321	34%	0.341	S	S	.	.			trans	-73.9	163.9	168.6	-171.9	36.2	0	0	0	110.6	T212 G213 K214 K216	D210-T212 PolarHBondContact O-N 3.3Å; D210-T212 PolarHBondContact OD2-OG1 3.47Å; D210-T212 VanDerWaalsContact OD2-OG1 3.13Å; D210-G213 PolarHBondContact O-N 3.1Å; D210-K214 WeakPolarHBondContact CB-O 3.49Å; D210-K214 PolarHBondContact N-O 3.42Å; D210-K216 HydrophobicContact CB-CG 3.99Å
211	K	85	Confident	88.6	Confident	200 Å²	200	64.5 Å²	64.5	87%	0.87	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-20.7	176.8	58.3	-177	167	-177.7	0	113.9	G213	K211-G213 VanDerWaalsContact C-N 3.28Å
212	T	82.8	Confident	88.5	Confident	89 Å²	89	59.4 Å²	59.4	55%	0.546	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	2	176.3	57.5	0	0	0	0	113.7	D210 K214	D210-T212 PolarHBondContact O-N 3.3Å; D210-T212 PolarHBondContact OD2-OG1 3.47Å; D210-T212 VanDerWaalsContact OD2-OG1 3.13Å; T212-K214 PolarHBondContact O-N 3.36Å
213	G	79.7	Confident	88.5	Confident	53 Å²	53	58.3 Å²	58.3	55%	0.546	31%	0.305	S	S	.	.	S	Bend	trans	74.9	-1.2	-175.2	0	0	0	0	0	114.2	D210 K211	D210-G213 PolarHBondContact O-N 3.1Å; K211-G213 VanDerWaalsContact C-N 3.28Å
214	K	81.5	Confident	88.5	Confident	149 Å²	149	57.4 Å²	57.4	65%	0.648	30%	0.302	S	S	*	.			trans	-82.2	142.1	175.6	-63.8	-176.9	-179.7	-177.4	0	109.8	D210 T212	D210-K214 WeakPolarHBondContact CB-O 3.49Å; D210-K214 PolarHBondContact N-O 3.42Å; T212-K214 PolarHBondContact O-N 3.36Å
215	S	85.7	Confident	88.6	Confident	11 Å²	11	56.4 Å²	56.4	8%	0.077	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-64.4	143.1	174.5	51.8	0	0	0	0	110.5	F185 G217	F185-S215 WeakPolarHBondContact CA-OG 3.45Å; F185-S215 WeakPolarHBondContact CD1-O 3.28Å; F185-S215 WeakPolarHBondContact CE1-O 3.2Å; F185-S215 PolarHBondContact O-OG 3.4Å; S215-G217 PolarHBondContact O-N 2.84Å
216	K	86.3	Confident	88.5	Confident	117 Å²	117	56.2 Å²	56.2	51%	0.509	30%	0.298	S	S	.	.			trans	-75.7	3.4	178.6	-70.6	-179.3	-178.5	-180	0	113.6	P208 D210 V218	P208-K216 HydrophobicContact CB-CD 4.34Å; P208-K216 PolarHBondContact O-N 2.71Å; P208-K216 VanDerWaalsContact O-N 3.16Å; D210-K216 HydrophobicContact CB-CG 3.99Å; K216-V218 HydrophobicContact CB-CG2 3.82Å; K216-V218 PolarHBondContact O-N 3.44Å
217	G	89.2	Confident	88.6	Confident	6 Å²	6	54.4 Å²	54.4	6%	0.062	29%	0.292	C	S	.	.	S	Bend	trans	68.5	17.8	-173	0	0	0	0	0	113.7	N182 V183 S215	N182-G217 PolarHBondContact N-O 2.8Å; V183-G217 PolarHBondContact N-O 3.27Å; V183-G217 WeakPolarHBondContact O-CA 3.43Å; S215-G217 PolarHBondContact O-N 2.84Å
218	V	91.9	Very high	88.8	Confident	37 Å²	37	55 Å²	55	22%	0.224	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.2	174.7	-63.6	0	0	0	0	109.2	F179 V180 L207 P208 K216	F179-V218 HydrophobicContact CE2-CB 4Å; F179-V218 HydrophobicContact CE2-CG1 4.33Å; F179-V218 HydrophobicContact CZ-CB 3.88Å; F179-V218 HydrophobicContact CZ-CG1 3.7Å; V180-V218 CarbonylContact O-C 3.56Å; V180-V218 VanDerWaalsContact O-CA 3.27Å; V180-V218 WeakPolarHBondContact O-CA 3.44Å; L207-V218 WeakPolarHBondContact CD1-O 3.4Å; P208-V218 HydrophobicContact CG-CG2 4.42Å; K216-V218 HydrophobicContact CB-CG2 3.82Å; K216-V218 PolarHBondContact O-N 3.44Å
219	A	92.1	Very high	89.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	149.1	177	0	0	0	0	0	109.8	V180 V183 I192 E206 L207	V180-A219 HydrophobicContact CB-CB 4.28Å; V180-A219 PolarHBondContact N-O 3.26Å; V180-A219 PolarHBondContact O-N 3.5Å; V183-A219 HydrophobicContact CG2-CB 4.41Å; I192-A219 HydrophobicContact CD1-CB 4Å; I192-A219 HydrophobicContact CG2-CB 4.36Å; E206-A219 CarbonylContact O-C 3.59Å; E206-A219 WeakPolarHBondContact O-CA 2.96Å; L207-A219 HydrophobicContact CD1-CB 3.55Å
220	V	92.7	Very high	89.4	Confident	19 Å²	19	48.4 Å²	48.4	12%	0.115	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127	170.2	-177.1	0	0	0	0	107.5	R177 V178 F179 E206	R177-V220 HydrophobicContact CB-CG1 4.4Å; V178-V220 WeakPolarHBondContact O-CA 3.23Å; F179-V220 HydrophobicContact CD2-CG2 4.09Å; E206-V220 HydrophobicContact CB-CB 4.2Å; E206-V220 PolarHBondContact N-O 3.02Å; E206-V220 PolarHBondContact O-N 2.87Å
221	V	93.5	Very high	89.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125.8	-179.7	-177.9	0	0	0	0	108.3	R177 V178 V180 I192 F196 V202 V205 Y223	R177-V221 CarbonylContact C-O 3.59Å; R177-V221 WeakPolarHBondContact CA-O 3.18Å; V178-V221 PolarHBondContact N-O 3.29Å; V178-V221 PolarHBondContact O-N 2.84Å; V180-V221 HydrophobicContact CG2-CG2 4.12Å; I192-V221 HydrophobicContact CG2-CG2 4.03Å; F196-V221 HydrophobicContact CB-CG1 4.11Å; F196-V221 HydrophobicContact CB-CG2 4.47Å; F196-V221 HydrophobicContact CD1-CB 4.44Å; F196-V221 HydrophobicContact CD1-CG1 4.4Å; F196-V221 HydrophobicContact CD1-CG2 4.12Å; F196-V221 HydrophobicContact CD2-CG2 4.34Å; F196-V221 HydrophobicContact CG-CG1 4.39Å; F196-V221 HydrophobicContact CG-CG2 4.03Å; V202-V221 HydrophobicContact CB-CG1 4.46Å; V202-V221 HydrophobicContact CG1-CG1 3.71Å; V202-V221 HydrophobicContact CG2-CG1 3.95Å; V205-V221 HydrophobicContact CG1-CG2 4.46Å; V205-V221 HydrophobicContact CG2-CG1 4.47Å; V221-Y223 HydrophobicContact CB-CE2 4.47Å; V221-Y223 HydrophobicContact CG1-CD2 4.34Å; V221-Y223 HydrophobicContact CG1-CE2 3.87Å
222	E	92.8	Very high	90.2	Very high	42 Å²	42	40.2 Å²	40.2	20%	0.196	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.6	174.1	-165.8	176.9	135.2	0	0	109.9	N176 R177 V202 T203 F204	N176-E222 HydrophobicContact CB-CG 4.42Å; N176-E222 WeakPolarHBondContact O-CA 3.45Å; R177-E222 HydrophobicContact CG-CB 4.17Å; R177-E222 HydrophobicContact CG-CG 3.9Å; R177-E222 IonicContact CZ-OE2 3.05Å; R177-E222 IonicContact NE-OE2 2.94Å; R177-E222 PolarHBondContact NE-OE2 2.99Å; R177-E222 IonicContact NH2-OE2 2.55Å; R177-E222 PolarHBondContact NH2-OE2 3.24Å; V202-E222 CarbonylContact C-O 3.58Å; V202-E222 WeakPolarHBondContact CA-O 3.39Å; T203-E222 PolarHBondContact N-O 2.95Å; T203-E222 WeakPolarHBondContact OG1-CB 3.45Å; T203-E222 VanDerWaalsContact OG1-CG 3.31Å; T203-E222 WeakPolarHBondContact OG1-CG 3.4Å; T203-E222 PolarHBondContact OG1-O 3.34Å; T203-E222 VanDerWaalsContact OG1-O 3.1Å; F204-E222 HydrophobicContact CB-CB 4.02Å; F204-E222 PolarHBondContact N-O 3.16Å; F204-E222 PolarHBondContact O-N 2.92Å
223	Y	94.8	Very high	90.7	Very high	1 Å²	1	36 Å²	36	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	165.9	177.1	-76.4	-77.3	0	0	0	111.4	N176 V178 F196 K201 V202 V221 E228 A229 A232	N176-Y223 PolarHBondContact O-N 2.81Å; V178-Y223 HydrophobicContact CB-CE2 4.34Å; V178-Y223 HydrophobicContact CG2-CD2 3.91Å; V178-Y223 HydrophobicContact CG2-CE2 3.83Å; F196-Y223 WeakPolarHBondContact CB-OH 3.37Å; F196-Y223 VanDerWaalsContact CD1-OH 3.29Å; F196-Y223 WeakPolarHBondContact CD1-OH 3.37Å; F196-Y223 PolarHBondContact O-OH 3.35Å; K201-Y223 WeakPolarHBondContact O-CA 3.38Å; V202-Y223 HydrophobicContact CG2-CD1 4.29Å; V202-Y223 HydrophobicContact CG2-CE1 3.77Å; V221-Y223 HydrophobicContact CB-CE2 4.47Å; V221-Y223 HydrophobicContact CG1-CD2 4.34Å; V221-Y223 HydrophobicContact CG1-CE2 3.87Å; Y223-E228 HydrophobicContact CD1-CB 3.84Å; Y223-E228 HydrophobicContact CG-CB 4Å; Y223-A229 HydrophobicContact CD2-CB 4Å; Y223-A232 HydrophobicContact CE2-CB 3.71Å; Y223-A232 VanDerWaalsContact OH-CB 3.31Å; Y223-A232 WeakPolarHBondContact OH-CB 3.31Å
224	S	93.2	Very high	91.3	Very high	56 Å²	56	36.2 Å²	36.2	39%	0.392	19%	0.188	S	C	.	.	S	Bend	trans	-74.8	-29.1	175.5	72.6	0	0	0	0	112.8	K201 E228	K201-S224 PolarHBondContact O-N 3.46Å; S224-E228 WeakPolarHBondContact CB-OE2 3.38Å; S224-E228 PolarHBondContact N-OE2 2.91Å; S224-E228 PolarHBondContact OG-OE1 3.06Å; S224-E228 PolarHBondContact OG-OE2 3.45Å
225	H	91.1	Very high	91.8	Very high	85 Å²	85	33 Å²	33	39%	0.394	18%	0.176	S	C	.	.	S	Bend	trans	-135.7	145.8	-177.6	-154.2	-88.1	0	0	0	111.6	Y158 V227 E228 A229	Y158-H225 AromaticContact CD1-CE1 3.99Å; H225-V227 WeakPolarHBondContact ND1-CG2 3.41Å; H225-V227 PolarHBondContact ND1-N 2.96Å; H225-V227 PolarHBondContact O-N 3.43Å; H225-E228 HydrophobicContact CB-CG 4.06Å; H225-E228 PolarHBondContact N-OE2 2.89Å; H225-E228 WeakPolarHBondContact O-CB 3.26Å; H225-E228 PolarHBondContact O-N 3.49Å; H225-E228 VanDerWaalsContact O-N 3.1Å; H225-A229 PolarHBondContact O-N 3.25Å
226	P	90	Very high	92.1	Very high	7 Å²	7	33.5 Å²	33.5	5%	0.045	18%	0.178	C	C	.	.	H	α-helix	trans	-68	-24.4	-179.1	25.3	-33	0	0	0	112.9	Y158 L174 T175 N176 E228 A229 V230	Y158-P226 HydrophobicContact CD2-CB 4.48Å; Y158-P226 HydrophobicContact CD2-CG 3.62Å; Y158-P226 HydrophobicContact CE2-CB 4.2Å; Y158-P226 HydrophobicContact CE2-CG 3.23Å; L174-P226 HydrophobicContact CB-CB 3.92Å; T175-P226 WeakPolarHBondContact O-CA 3.46Å; T175-P226 WeakPolarHBondContact O-CB 3.22Å; N176-P226 WeakPolarHBondContact OD1-CA 3.05Å; N176-P226 WeakPolarHBondContact OD1-CB 3.48Å; N176-P226 WeakPolarHBondContact OD1-CD 3.39Å; P226-E228 VanDerWaalsContact C-N 3.35Å; P226-A229 WeakPolarHBondContact O-CB 3.38Å; P226-A229 PolarHBondContact O-N 3.28Å; P226-V230 WeakPolarHBondContact O-CG2 3.47Å; P226-V230 PolarHBondContact O-N 3.44Å
227	V	90.9	Very high	92.4	Very high	45 Å²	45	30.2 Å²	30.2	27%	0.273	17%	0.166	S	C	.	.	H	α-helix	trans	-66	-37.2	173.6	179.1	0	0	0	0	111.3	Y158 H225 A229 V230 Q231	Y158-V227 HydrophobicContact CD2-CG2 4.35Å; Y158-V227 HydrophobicContact CG-CG2 4.07Å; H225-V227 WeakPolarHBondContact ND1-CG2 3.41Å; H225-V227 PolarHBondContact ND1-N 2.96Å; H225-V227 PolarHBondContact O-N 3.43Å; V227-A229 VanDerWaalsContact C-N 3.3Å; V227-A229 PolarHBondContact O-N 2.93Å; V227-V230 PolarHBondContact O-N 2.72Å; V227-Q231 WeakPolarHBondContact O-CB 3.29Å; V227-Q231 PolarHBondContact O-N 3.49Å
228	E	93.4	Very high	92.5	Very high	37 Å²	37	35.3 Å²	35.3	17%	0.173	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-37.9	174.2	-63.3	178.3	130.7	0	0	110.8	G200 K201 Y223 S224 H225 P226 Q231 A232	G200-E228 WeakPolarHBondContact CA-OE1 3.35Å; K201-E228 PolarHBondContact N-OE1 3.19Å; Y223-E228 HydrophobicContact CD1-CB 3.84Å; Y223-E228 HydrophobicContact CG-CB 4Å; S224-E228 WeakPolarHBondContact CB-OE2 3.38Å; S224-E228 PolarHBondContact N-OE2 2.91Å; S224-E228 PolarHBondContact OG-OE1 3.06Å; S224-E228 PolarHBondContact OG-OE2 3.45Å; H225-E228 HydrophobicContact CB-CG 4.06Å; H225-E228 PolarHBondContact N-OE2 2.89Å; H225-E228 WeakPolarHBondContact O-CB 3.26Å; H225-E228 PolarHBondContact O-N 3.49Å; H225-E228 VanDerWaalsContact O-N 3.1Å; P226-E228 VanDerWaalsContact C-N 3.35Å; E228-Q231 WeakPolarHBondContact O-CB 3.39Å; E228-Q231 PolarHBondContact O-N 3.17Å; E228-A232 WeakPolarHBondContact O-CB 3.19Å; E228-A232 PolarHBondContact O-N 3.29Å
229	A	92.9	Very high	92.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-45.5	174.7	0	0	0	0	0	112	V178 Y223 H225 P226 V227 Q231 A232 V233 M250	V178-A229 HydrophobicContact CG2-CB 3.4Å; V178-A229 VanDerWaalsContact CG2-CB 3.4Å; Y223-A229 HydrophobicContact CD2-CB 4Å; H225-A229 PolarHBondContact O-N 3.25Å; P226-A229 WeakPolarHBondContact O-CB 3.38Å; P226-A229 PolarHBondContact O-N 3.28Å; V227-A229 VanDerWaalsContact C-N 3.3Å; V227-A229 PolarHBondContact O-N 2.93Å; A229-Q231 VanDerWaalsContact C-N 3.33Å; A229-Q231 PolarHBondContact O-N 2.97Å; A229-A232 WeakPolarHBondContact O-CB 3.49Å; A229-A232 PolarHBondContact O-N 3.37Å; A229-V233 WeakPolarHBondContact O-CG2 3.4Å; A229-V233 PolarHBondContact O-N 2.98Å; A229-M250 HydrophobicContact CB-CE 3.99Å; A229-M250 HydrophobicContact CB-SD 4.27Å
230	V	92.8	Very high	92.5	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-40.8	175.2	176.3	0	0	0	0	111.4	L160 F164 L165 L168 I170 L174 P226 V227 V233 S234 M250	L160-V230 HydrophobicContact CD1-CB 4.19Å; L160-V230 HydrophobicContact CD1-CG1 3.94Å; L160-V230 HydrophobicContact CD1-CG2 4.21Å; F164-V230 HydrophobicContact CE1-CG1 4.05Å; L165-V230 HydrophobicContact CD2-CG1 3.99Å; L165-V230 HydrophobicContact CD2-CG2 4.1Å; L168-V230 HydrophobicContact CD1-CG1 3.91Å; I170-V230 HydrophobicContact CD1-CB 4.34Å; I170-V230 HydrophobicContact CD1-CG1 3.93Å; I170-V230 HydrophobicContact CD1-CG2 4.08Å; L174-V230 HydrophobicContact CD1-CG2 4.36Å; L174-V230 HydrophobicContact CD2-CG2 3.73Å; P226-V230 WeakPolarHBondContact O-CG2 3.47Å; P226-V230 PolarHBondContact O-N 3.44Å; V227-V230 PolarHBondContact O-N 2.72Å; V230-V233 PolarHBondContact O-N 3.46Å; V230-S234 PolarHBondContact O-N 3.45Å; V230-M250 HydrophobicContact CG2-CE 4.45Å
231	Q	93.1	Very high	92.3	Very high	88 Å²	88	47.5 Å²	47.5	41%	0.411	24%	0.241	S	C	.	.	H	α-helix	trans	-61.5	-43.6	176	-179.4	174.5	-11.6	0	0	111.5	V227 E228 A229 V233 S234 M235	V227-Q231 WeakPolarHBondContact O-CB 3.29Å; V227-Q231 PolarHBondContact O-N 3.49Å; E228-Q231 WeakPolarHBondContact O-CB 3.39Å; E228-Q231 PolarHBondContact O-N 3.17Å; A229-Q231 VanDerWaalsContact C-N 3.33Å; A229-Q231 PolarHBondContact O-N 2.97Å; Q231-V233 VanDerWaalsContact C-N 3.34Å; Q231-V233 PolarHBondContact O-N 3.33Å; Q231-S234 PolarHBondContact O-N 3.19Å; Q231-M235 HydrophobicContact CG-CG 4.34Å; Q231-M235 HydrophobicContact CG-SD 3.63Å; Q231-M235 WeakPolarHBondContact O-CB 3.3Å; Q231-M235 WeakPolarHBondContact O-CG 3.38Å; Q231-M235 PolarHBondContact O-N 3.42Å
232	A	94	Very high	91.9	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-42.6	175.6	0	0	0	0	0	112	A199 Y223 E228 A229 S234 M235 L236	A199-A232 HydrophobicContact CB-CB 3.63Å; Y223-A232 HydrophobicContact CE2-CB 3.71Å; Y223-A232 VanDerWaalsContact OH-CB 3.31Å; Y223-A232 WeakPolarHBondContact OH-CB 3.31Å; E228-A232 WeakPolarHBondContact O-CB 3.19Å; E228-A232 PolarHBondContact O-N 3.29Å; A229-A232 WeakPolarHBondContact O-CB 3.49Å; A229-A232 PolarHBondContact O-N 3.37Å; A232-S234 PolarHBondContact O-N 3.13Å; A232-M235 PolarHBondContact O-N 3.22Å; A232-L236 VanDerWaalsContact O-CB 3.3Å; A232-L236 WeakPolarHBondContact O-CB 3.47Å; A232-L236 PolarHBondContact O-N 3.08Å
233	V	93.5	Very high	91.7	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-43.8	174.3	174.5	0	0	0	0	110.9	L168 I170 V178 A229 V230 Q231 N237 V248	L168-V233 HydrophobicContact CB-CG1 4.47Å; I170-V233 HydrophobicContact CD1-CB 4.14Å; I170-V233 HydrophobicContact CD1-CG1 3.96Å; I170-V233 HydrophobicContact CD1-CG2 4.39Å; I170-V233 HydrophobicContact CG1-CG1 4.29Å; V178-V233 HydrophobicContact CG1-CG2 4.14Å; A229-V233 WeakPolarHBondContact O-CG2 3.4Å; A229-V233 PolarHBondContact O-N 2.98Å; V230-V233 PolarHBondContact O-N 3.46Å; Q231-V233 VanDerWaalsContact C-N 3.34Å; Q231-V233 PolarHBondContact O-N 3.33Å; V233-N237 WeakPolarHBondContact O-CB 3.4Å; V233-N237 PolarHBondContact O-N 2.93Å; V233-V248 HydrophobicContact CG2-CG1 4.04Å
234	S	91.8	Very high	91.4	Very high	57 Å²	57	62.3 Å²	62.3	40%	0.399	31%	0.307	S	S	.	.	H	α-helix	trans	-68.4	-36.2	-179.7	-169.5	0	0	0	0	113.5	V230 Q231 A232	V230-S234 PolarHBondContact O-N 3.45Å; Q231-S234 PolarHBondContact O-N 3.19Å; A232-S234 PolarHBondContact O-N 3.13Å
235	M	91.8	Very high	91.4	Very high	83 Å²	83	61.7 Å²	61.7	41%	0.409	31%	0.306	S	S	.	.	H	α-helix	trans	-89	-41.6	-173.5	-68.3	178.6	67	0	0	113.1	Q231 A232 Q239	Q231-M235 HydrophobicContact CG-CG 4.34Å; Q231-M235 HydrophobicContact CG-SD 3.63Å; Q231-M235 WeakPolarHBondContact O-CB 3.3Å; Q231-M235 WeakPolarHBondContact O-CG 3.38Å; Q231-M235 PolarHBondContact O-N 3.42Å; A232-M235 PolarHBondContact O-N 3.22Å; M235-Q239 WeakPolarHBondContact O-CG 3.42Å; M235-Q239 PolarHBondContact O-NE2 3.38Å; M235-Q239 VanDerWaalsContact O-NE2 3.1Å
236	L	92.6	Very high	91.5	Very high	20 Å²	20	57.8 Å²	57.8	11%	0.105	29%	0.288	C	S	.	.	H	α-helix	trans	-99.3	-9.6	-168.7	-61.2	174.1	0	0	0	113.7	V195 F196 A199 A232 N238 Q239 V248	V195-L236 HydrophobicContact CG1-CD2 4.32Å; F196-L236 HydrophobicContact CD1-CD1 3.61Å; F196-L236 HydrophobicContact CD2-CD1 4.44Å; F196-L236 HydrophobicContact CE1-CD1 3.62Å; F196-L236 HydrophobicContact CE2-CD1 4.48Å; F196-L236 HydrophobicContact CG-CD1 4.02Å; F196-L236 HydrophobicContact CZ-CD1 4.06Å; A199-L236 HydrophobicContact CB-CD1 4.43Å; A232-L236 VanDerWaalsContact O-CB 3.3Å; A232-L236 WeakPolarHBondContact O-CB 3.47Å; A232-L236 PolarHBondContact O-N 3.08Å; L236-N238 PolarHBondContact O-N 2.75Å; L236-Q239 WeakPolarHBondContact O-CB 3.46Å; L236-Q239 PolarHBondContact O-N 3.08Å; L236-V248 HydrophobicContact CB-CG2 3.92Å
237	N	92.3	Very high	91.7	Very high	48 Å²	48	59.4 Å²	59.4	26%	0.257	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	131.8	175.9	-172.4	19.9	0	0	0	111.2	V233 Q239 V248	V233-N237 WeakPolarHBondContact O-CB 3.4Å; V233-N237 PolarHBondContact O-N 2.93Å; N237-Q239 PolarHBondContact O-N 2.75Å; N237-V248 HydrophobicContact CB-CB 4.28Å
238	N	91.7	Very high	91.8	Very high	114 Å²	114	57.2 Å²	57.2	61%	0.61	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	17.8	-173	-60.6	-50.8	0	0	0	115.5	L236 L246	L236-N238 PolarHBondContact O-N 2.75Å; N238-L246 WeakPolarHBondContact CA-O 3.41Å; N238-L246 PolarHBondContact N-O 3.42Å
239	Q	91.5	Very high	91.7	Very high	103 Å²	103	62.9 Å²	62.9	48%	0.481	30%	0.302	S	S	.	.			trans	-75.1	135.7	175.4	-67.6	-58.6	-21.5	0	0	111.7	M235 L236 N237 Y241 A245 L246	M235-Q239 WeakPolarHBondContact O-CG 3.42Å; M235-Q239 PolarHBondContact O-NE2 3.38Å; M235-Q239 VanDerWaalsContact O-NE2 3.1Å; L236-Q239 WeakPolarHBondContact O-CB 3.46Å; L236-Q239 PolarHBondContact O-N 3.08Å; N237-Q239 PolarHBondContact O-N 2.75Å; Q239-Y241 PolarHBondContact O-N 2.84Å; Q239-A245 CarbonylContact O-C 3.56Å; Q239-A245 WeakPolarHBondContact O-CA 3.21Å; Q239-L246 PolarHBondContact O-N 3.14Å
240	K	91	Very high	91.6	Very high	164 Å²	164	63.9 Å²	63.9	71%	0.713	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	111.7	177.4	-172	176.8	-180	-179.4	0	109.4	F242	K240-F242 WeakPolarHBondContact CE-O 3.47Å; K240-F242 WeakPolarHBondContact CG-O 3.14Å
241	Y	88.6	Confident	91.3	Very high	45 Å²	45	64.3 Å²	64.3	18%	0.176	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	112.6	173.2	-171.2	-118.5	0	0	0	109.1	P184 A187 V195 Q239 E243 K244 L246	P184-Y241 HydrophobicContact CG-CD1 3.66Å; P184-Y241 HydrophobicContact CG-CE1 4Å; A187-Y241 HydrophobicContact CB-CE1 3.84Å; V195-Y241 HydrophobicContact CG2-CD2 4.1Å; V195-Y241 HydrophobicContact CG2-CE2 3.39Å; Q239-Y241 PolarHBondContact O-N 2.84Å; Y241-E243 PolarHBondContact O-N 2.97Å; Y241-K244 PolarHBondContact N-O 3.27Å; Y241-K244 PolarHBondContact O-N 2.79Å; Y241-K244 VanDerWaalsContact O-N 3.17Å; Y241-L246 HydrophobicContact CD1-CD1 4.48Å; Y241-L246 HydrophobicContact CD1-CD2 4.3Å; Y241-L246 HydrophobicContact CG-CD1 4.18Å; Y241-L246 HydrophobicContact CG-CG 4.5Å
242	F	85.8	Confident	90.4	Very high	112 Å²	112	66.5 Å²	66.5	49%	0.491	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	-113.4	-163.5	-59.6	-86	0	0	0	111.5	P184 K240	P184-F242 HydrophobicContact CG-CD2 3.75Å; P184-F242 HydrophobicContact CG-CE2 4.43Å; K240-F242 WeakPolarHBondContact CE-O 3.47Å; K240-F242 WeakPolarHBondContact CG-O 3.14Å
243	E	88.4	Confident	89.3	Confident	183 Å²	183	72 Å²	72	86%	0.855	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-0.2	-179.3	-65.1	-179.3	170.8	0	0	113	Y241	Y241-E243 PolarHBondContact O-N 2.97Å
244	K	89.6	Confident	87.9	Confident	58 Å²	58	76.7 Å²	76.7	25%	0.252	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	139.8	-173.9	-56.5	-175.9	78.5	-156	0	110.7	N182 V183 P184 Y241	N182-K244 PolarHBondContact O-NZ 3.16Å; N182-K244 WeakPolarHBondContact OD1-CE 3.31Å; N182-K244 PolarHBondContact OD1-NZ 3.4Å; V183-K244 PolarHBondContact O-NZ 3.17Å; P184-K244 HydrophobicContact CB-CD 4.01Å; Y241-K244 PolarHBondContact N-O 3.27Å; Y241-K244 PolarHBondContact O-N 2.79Å; Y241-K244 VanDerWaalsContact O-N 3.17Å
245	A	92.5	Very high	86.4	Confident	43 Å²	43	78 Å²	78	36%	0.355	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	123.7	171.9	0	0	0	0	0	110	N182 Q239	N182-A245 WeakPolarHBondContact CB-O 3.41Å; N182-A245 PolarHBondContact ND2-O 3.06Å; Q239-A245 CarbonylContact O-C 3.56Å; Q239-A245 WeakPolarHBondContact O-CA 3.21Å
246	L	93.6	Very high	85	Confident	4 Å²	4	78.8 Å²	78.8	2%	0.021	40%	0.396	C	S	.	.			trans	-70.5	137.4	176.1	-60.4	179.8	0	0	0	109.7	V183 F196 N238 Q239 Y241 V248	V183-L246 HydrophobicContact CG2-CD2 4.21Å; F196-L246 HydrophobicContact CE2-CD1 4.49Å; N238-L246 WeakPolarHBondContact CA-O 3.41Å; N238-L246 PolarHBondContact N-O 3.42Å; Q239-L246 PolarHBondContact O-N 3.14Å; Y241-L246 HydrophobicContact CD1-CD1 4.48Å; Y241-L246 HydrophobicContact CD1-CD2 4.3Å; Y241-L246 HydrophobicContact CG-CD1 4.18Å; Y241-L246 HydrophobicContact CG-CG 4.5Å; L246-V248 HydrophobicContact CB-CG2 4.28Å
247	N	93.4	Very high	83.3	Confident	40 Å²	40	81.7 Å²	81.7	21%	0.214	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	110.6	172.9	169.6	20.1	0	0	0	108.2	S181 R249	S181-N247 PolarHBondContact N-O 3.33Å; S181-N247 PolarHBondContact O-N 3.47Å; S181-N247 VanDerWaalsContact OG-CB 3.24Å; S181-N247 WeakPolarHBondContact OG-CB 3.43Å; S181-N247 PolarHBondContact OG-ND2 2.79Å; S181-N247 PolarHBondContact OG-O 2.81Å; N247-R249 PolarHBondContact OD1-NE 2.86Å
248	V	93.9	Very high	81.4	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.2	-168.7	-173.8	0	0	0	0	107.8	V178 V180 F196 V233 L236 N237 L246	V178-V248 HydrophobicContact CG1-CG1 3.19Å; V180-V248 HydrophobicContact CG1-CG2 4.28Å; F196-V248 HydrophobicContact CE1-CG1 4.07Å; F196-V248 HydrophobicContact CE1-CG2 4.19Å; F196-V248 HydrophobicContact CZ-CG2 4Å; V233-V248 HydrophobicContact CG2-CG1 4.04Å; L236-V248 HydrophobicContact CB-CG2 3.92Å; N237-V248 HydrophobicContact CB-CB 4.28Å; L246-V248 HydrophobicContact CB-CG2 4.28Å
249	R	91.4	Very high	79.6	Confident	155 Å²	155	83.7 Å²	83.7	59%	0.585	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	160.1	-177.5	-63.7	-172.6	180	-164.7	-4.9	110.8	V178 F179 N247 D251	V178-R249 WeakPolarHBondContact CG1-O 3.46Å; F179-R249 PolarHBondContact N-O 2.9Å; F179-R249 PolarHBondContact O-N 3.36Å; N247-R249 PolarHBondContact OD1-NE 2.86Å; R249-D251 PolarHBondContact O-N 2.92Å
250	M	90.1	Very high	77.8	Confident	21 Å²	21	84.7 Å²	84.7	10%	0.103	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	133.5	172.7	-147.9	66.6	173.4	0	0	110.4	I170 L174 T175 A229 V230 T252	I170-M250 HydrophobicContact CG1-CB 4.49Å; I170-M250 HydrophobicContact CG2-CB 4.1Å; I170-M250 HydrophobicContact CG2-CG 4.1Å; I170-M250 HydrophobicContact CG2-SD 4.42Å; L174-M250 HydrophobicContact CB-CE 4.23Å; L174-M250 HydrophobicContact CD2-CE 4.33Å; T175-M250 WeakPolarHBondContact O-CE 3.37Å; A229-M250 HydrophobicContact CB-CE 3.99Å; A229-M250 HydrophobicContact CB-SD 4.27Å; V230-M250 HydrophobicContact CG2-CE 4.45Å; M250-T252 PolarHBondContact O-N 3.21Å
251	D	87.3	Confident	75.9	Confident	11 Å²	11	82.1 Å²	82.1	6%	0.059	44%	0.437	C	S	.	.			trans	-73.3	123	175.6	-165.5	6.4	0	0	0	109.5	T175 R177 F179 R249 I253	T175-D251 PolarHBondContact OG1-O 2.79Å; R177-D251 HydrophobicContact CB-CB 3.76Å; R177-D251 VanDerWaalsContact O-CB 3.3Å; R177-D251 WeakPolarHBondContact O-CB 3.35Å; R177-D251 PolarHBondContact O-N 3.07Å; F179-D251 HydrophobicContact CB-CB 4.34Å; R249-D251 PolarHBondContact O-N 2.92Å; D251-I253 WeakPolarHBondContact OD1-CB 3.29Å; D251-I253 WeakPolarHBondContact OD1-CG1 3.36Å; D251-I253 PolarHBondContact OD1-N 3Å
252	T	74.4	Confident	74.1	Confident	135 Å²	135	89.2 Å²	89.2	83%	0.828	46%	0.463	S	S	*	.			trans	-93.8	-9.2	176.3	-44.8	0	0	0	0	111	M250	M250-T252 PolarHBondContact O-N 3.21Å
253	I	70.7	Confident	72.5	Confident	114 Å²	114	88 Å²	88	59%	0.585	46%	0.462	S	S	*	.	S	Bend	trans	-78.8	121.6	178.5	-55.2	173.5	0	0	0	107.2	D251	D251-I253 WeakPolarHBondContact OD1-CB 3.29Å; D251-I253 WeakPolarHBondContact OD1-CG1 3.36Å; D251-I253 PolarHBondContact OD1-N 3Å
254	P	63.1	Low	71	Confident	101 Å²	101	85.7 Å²	85.7	66%	0.656	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-58.5	145.7	175.2	25.3	-33.3	0	0	0	109	K256	P254-K256 PolarHBondContact O-N 3.24Å
255	P	61.5	Low	69.5	Low	83 Å²	83	88.6 Å²	88.6	54%	0.539	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-53.2	133.1	178.3	24.3	-33.8	0	0	0	109
256	K	61.3	Low	68	Low	101 Å²	101	90.8 Å²	90.8	44%	0.439	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-48.9	132	175	-162	165.5	-148.9	-178.7	0	108.1	P254 E260	P254-K256 PolarHBondContact O-N 3.24Å; K256-E260 HydrophobicContact CD-CB 3.78Å; K256-E260 HydrophobicContact CD-CG 4.11Å; K256-E260 WeakPolarHBondContact CD-OE2 3.24Å; K256-E260 WeakPolarHBondContact CE-OE1 3.27Å; K256-E260 WeakPolarHBondContact CE-OE2 3.48Å; K256-E260 HydrophobicContact CG-CB 4.14Å; K256-E260 HydrophobicContact CG-CG 4.5Å; K256-E260 IonicContact NZ-OE1 3.66Å; K256-E260 PolarHBondContact NZ-OE1 3.49Å; K256-E260 IonicContact NZ-OE2 2.74Å; K256-E260 PolarHBondContact NZ-OE2 3.12Å
257	P	56.2	Low	66.5	Low	80 Å²	80	93.9 Å²	93.9	52%	0.519	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-52	144	-178.3	20.1	-32.4	0	0	0	109.4	S259 E260	P257-S259 PolarHBondContact O-N 3.44Å; P257-S259 PolarHBondContact O-OG 3.22Å; P257-E260 PolarHBondContact O-N 3.4Å; P257-E260 VanDerWaalsContact O-N 3.15Å
258	P	53.9	Low	64.9	Low	102 Å²	102	95.4 Å²	95.4	66%	0.662	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-8.6	-173.7	16.7	-29.2	0	0	0	114.6	E260 M261	P258-E260 PolarHBondContact O-N 3.1Å; P258-E260 VanDerWaalsContact O-N 3.15Å; P258-M261 PolarHBondContact O-N 3.14Å
259	S	53.9	Low	63.3	Low	102 Å²	102	105.5 Å²	105.5	71%	0.713	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-17.4	170.6	55.4	0	0	0	0	115.3	P257	P257-S259 PolarHBondContact O-N 3.44Å; P257-S259 PolarHBondContact O-OG 3.22Å
260	E	54	Low	61.9	Low	125 Å²	125	102 Å²	102	58%	0.584	58%	0.579	S	S	*	*	S	Bend	trans	-112.6	-9.3	176.4	-73.7	-159.5	-143.2	0	0	115	K256 P257 P258 R262	K256-E260 HydrophobicContact CD-CB 3.78Å; K256-E260 HydrophobicContact CD-CG 4.11Å; K256-E260 WeakPolarHBondContact CD-OE2 3.24Å; K256-E260 WeakPolarHBondContact CE-OE1 3.27Å; K256-E260 WeakPolarHBondContact CE-OE2 3.48Å; K256-E260 HydrophobicContact CG-CB 4.14Å; K256-E260 HydrophobicContact CG-CG 4.5Å; K256-E260 IonicContact NZ-OE1 3.66Å; K256-E260 PolarHBondContact NZ-OE1 3.49Å; K256-E260 IonicContact NZ-OE2 2.74Å; K256-E260 PolarHBondContact NZ-OE2 3.12Å; P257-E260 PolarHBondContact O-N 3.4Å; P257-E260 VanDerWaalsContact O-N 3.15Å; P258-E260 PolarHBondContact O-N 3.1Å; P258-E260 VanDerWaalsContact O-N 3.15Å; E260-R262 VanDerWaalsContact C-N 3.31Å; E260-R262 PolarHBondContact O-N 3.48Å
261	M	50.5	Low	60.6	Low	110 Å²	110	105.6 Å²	105.6	54%	0.542	60%	0.598	S	S	.	*	S	Bend	trans	-75.2	94.4	164.8	-81	163.6	72.4	0	0	106.5	P258 N263	P258-M261 PolarHBondContact O-N 3.14Å; M261-N263 PolarHBondContact O-N 3.12Å
262	R	49.6	Very low	59.6	Low	193 Å²	193	115.9 Å²	115.9	73%	0.728	64%	0.643	S	S	*	*			trans	-45	102.2	172.7	179.6	178.7	176	-167.9	-3.2	108.5	E260	E260-R262 VanDerWaalsContact C-N 3.31Å; E260-R262 PolarHBondContact O-N 3.48Å
263	N	52.5	Low	59.3	Low	86 Å²	86	111.7 Å²	111.7	46%	0.46	63%	0.626	S	S	.	*			trans	-59.2	138.3	167.1	-62.2	-57.4	0	0	0	105.7	M261 T265 D266	M261-N263 PolarHBondContact O-N 3.12Å; N263-T265 PolarHBondContact O-N 3.2Å; N263-D266 WeakPolarHBondContact CB-OD2 2.98Å; N263-D266 PolarHBondContact ND2-OD2 2.96Å; N263-D266 PolarHBondContact O-N 3.45Å
264	P	57.4	Low	59.2	Low	135 Å²	135	111.6 Å²	111.6	88%	0.877	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-15.1	175.9	20.7	-30.7	0	0	0	112.6
265	T	59.2	Low	59.5	Low	119 Å²	119	110.1 Å²	110.1	73%	0.73	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-13.1	177.3	-15.5	0	0	0	0	115.1	N263	N263-T265 PolarHBondContact O-N 3.2Å
266	D	59.7	Low	60.1	Low	89 Å²	89	113.7 Å²	113.7	48%	0.476	65%	0.647	S	S	.	*	S	Bend	trans	-85.8	124.7	-177.4	-72	-37.2	0	0	0	111.4	N263	N263-D266 WeakPolarHBondContact CB-OD2 2.98Å; N263-D266 PolarHBondContact ND2-OD2 2.96Å; N263-D266 PolarHBondContact O-N 3.45Å
267	L	62.3	Low	60.4	Low	70 Å²	70	109.8 Å²	109.8	37%	0.366	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-57.7	143.2	179.1	-79.8	71.7	0	0	0	110.7	L271 G273 V274	L267-L271 HydrophobicContact CB-CB 4.34Å; L267-L271 HydrophobicContact CD2-CB 3.87Å; L267-G273 VanDerWaalsContact CD2-CA 3.49Å; L267-V274 HydrophobicContact CD1-CG2 3.89Å; L267-V274 HydrophobicContact CD2-CB 4.46Å; L267-V274 HydrophobicContact CD2-CG2 3.59Å; L267-V274 HydrophobicContact CG-CG2 3.8Å
268	P	61	Low	61.4	Low	72 Å²	72	113.8 Å²	113.8	47%	0.468	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-59.9	145.2	176.2	26.5	-33.8	0	0	0	110.9	G270 L271	P268-G270 PolarHBondContact O-N 2.79Å; P268-L271 HydrophobicContact CG-CD1 3.89Å; P268-L271 PolarHBondContact O-N 3.13Å
269	H	60	Low	62.2	Low	211 Å²	211	110 Å²	110	98%	0.977	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.2	124.1	177.1	-103.5	74.7	0	0	0	110.6
270	G	61.2	Low	63	Low	83 Å²	83	109.1 Å²	109.1	86%	0.856	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	114.3	-20.2	-178.2	0	0	0	0	0	114.8	P268	P268-G270 PolarHBondContact O-N 2.79Å
271	L	62.4	Low	63.6	Low	96 Å²	96	110.6 Å²	110.6	50%	0.503	64%	0.643	S	S	.	*			trans	-96.7	114.5	173.9	-74.1	171.2	0	0	0	110.9	L267 P268 G273	L267-L271 HydrophobicContact CB-CB 4.34Å; L267-L271 HydrophobicContact CD2-CB 3.87Å; P268-L271 HydrophobicContact CG-CD1 3.89Å; P268-L271 PolarHBondContact O-N 3.13Å; L271-G273 PolarHBondContact O-N 3.18Å
272	K	66.7	Low	64.6	Low	227 Å²	227	106.1 Å²	106.1	99%	0.987	63%	0.625	S	S	*	*	S	Bend	trans	-71.8	-13.8	170.5	-85.3	-173.5	176.1	-178	0	113.4
273	G	68.3	Low	65.7	Low	46 Å²	46	102.9 Å²	102.9	47%	0.474	62%	0.619	S	S	.	*			trans	-178.8	157	-179.1	0	0	0	0	0	110.8	L267 L271	L267-G273 VanDerWaalsContact CD2-CA 3.49Å; L271-G273 PolarHBondContact O-N 3.18Å
274	V	68.2	Low	66.6	Low	112 Å²	112	103.4 Å²	103.4	68%	0.679	63%	0.627	S	S	*	*			trans	-104.2	138.7	164	-115.9	0	0	0	0	107	L267	L267-V274 HydrophobicContact CD1-CG2 3.89Å; L267-V274 HydrophobicContact CD2-CB 4.46Å; L267-V274 HydrophobicContact CD2-CG2 3.59Å; L267-V274 HydrophobicContact CG-CG2 3.8Å
275	G	69.4	Low	67.1	Low	70 Å²	70	99.8 Å²	99.8	72%	0.722	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-66.8	169.1	174	0	0	0	0	0	112.3	G277	G275-G277 PolarHBondContact O-N 2.91Å
276	L	74.3	Confident	67.6	Low	158 Å²	158	100 Å²	100	83%	0.827	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-59.4	118.1	175.9	-154	79.1	0	0	0	109.5	G282	L276-G282 VanDerWaalsContact CD1-CA 3.48Å
277	G	68.8	Low	67.7	Low	20 Å²	20	99.2 Å²	99.2	21%	0.206	60%	0.597	C	S	.	*	P	Polyproline II helix	trans	-68.6	166	174.2	0	0	0	0	0	112.5	G275 G279 G282 M283	G275-G277 PolarHBondContact O-N 2.91Å; G277-G279 PolarHBondContact O-N 3.07Å; G277-G282 WeakPolarHBondContact CA-O 3.06Å; G277-G282 PolarHBondContact N-O 3.3Å; G277-G282 WeakPolarHBondContact O-CA 3.35Å; G277-M283 CarbonylContact C-O 3.55Å; G277-M283 WeakPolarHBondContact CA-O 3.12Å
278	L	75.9	Confident	67.8	Low	163 Å²	163	100.5 Å²	100.5	85%	0.853	60%	0.604	S	S	*	*	S	Bend	trans	-76	-1.6	-177.9	-69.7	167.7	0	0	0	114.2	L285	L278-L285 HydrophobicContact CB-CD1 3.57Å; L278-L285 HydrophobicContact CB-CG 4.32Å
279	G	70.4	Confident	68.1	Low	23 Å²	23	101.2 Å²	101.2	24%	0.237	61%	0.61	C	S	.	*	S	Bend	trans	-85.7	168.3	176.1	0	0	0	0	0	113.1	G277 N281 G282 M283	G277-G279 PolarHBondContact O-N 3.07Å; G279-N281 PolarHBondContact O-N 2.87Å; G279-G282 PolarHBondContact O-N 3.22Å; G279-G282 VanDerWaalsContact O-N 3.08Å; G279-M283 VanDerWaalsContact CA-O 3.27Å; G279-M283 WeakPolarHBondContact CA-O 3.42Å; G279-M283 PolarHBondContact N-O 3.5Å
280	A	71.3	Confident	68.4	Low	83 Å²	83	98.5 Å²	98.5	69%	0.686	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-55.3	139.1	170.9	0	0	0	0	0	110.3	G282	A280-G282 PolarHBondContact O-N 2.92Å
281	N	66.4	Low	68.3	Low	157 Å²	157	98.8 Å²	98.8	84%	0.84	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	64.5	14.8	-175.5	-47.4	-40.8	0	0	0	115.4	G279 M283	G279-N281 PolarHBondContact O-N 2.87Å; N281-M283 VanDerWaalsContact C-N 3.32Å
282	G	72.6	Confident	68.3	Low	16 Å²	16	99.6 Å²	99.6	17%	0.165	59%	0.587	C	S	.	*	G	3₁₀ helix	trans	75.8	19.7	178.7	0	0	0	0	0	115.4	L276 G277 G279 A280	L276-G282 VanDerWaalsContact CD1-CA 3.48Å; G277-G282 WeakPolarHBondContact CA-O 3.06Å; G277-G282 PolarHBondContact N-O 3.3Å; G277-G282 WeakPolarHBondContact O-CA 3.35Å; G279-G282 PolarHBondContact O-N 3.22Å; G279-G282 VanDerWaalsContact O-N 3.08Å; A280-G282 PolarHBondContact O-N 2.92Å
283	M	71.4	Confident	67.6	Low	125 Å²	125	91.8 Å²	91.8	62%	0.616	57%	0.571	S	S	*	*			trans	-73	141.3	170.2	-64	-176.4	71.8	0	0	109.7	G277 G279 N281	G277-M283 CarbonylContact C-O 3.55Å; G277-M283 WeakPolarHBondContact CA-O 3.12Å; G279-M283 VanDerWaalsContact CA-O 3.27Å; G279-M283 WeakPolarHBondContact CA-O 3.42Å; G279-M283 PolarHBondContact N-O 3.5Å; N281-M283 VanDerWaalsContact C-N 3.32Å
284	P	71.8	Confident	66.9	Low	96 Å²	96	95.6 Å²	95.6	62%	0.623	58%	0.579	S	S	*	*			trans	-62.9	139.3	170.8	27.6	-33.2	0	0	0	109.5	T286	P284-T286 PolarHBondContact O-N 3.42Å
285	L	68.6	Low	65.6	Low	60 Å²	60	99.4 Å²	99.4	31%	0.314	59%	0.589	S	S	.	*			trans	-65.1	101.6	170.9	-83.5	159	0	0	0	108.8	L278 I288 V291	L278-L285 HydrophobicContact CB-CD1 3.57Å; L278-L285 HydrophobicContact CB-CG 4.32Å; L285-I288 HydrophobicContact CB-CG1 4.24Å; L285-V291 HydrophobicContact CD2-CB 4.02Å; L285-V291 HydrophobicContact CD2-CG1 3.83Å; L285-V291 HydrophobicContact CD2-CG2 3.67Å
286	T	68.5	Low	64.6	Low	123 Å²	123	100.5 Å²	100.5	76%	0.755	59%	0.592	S	S	*	*	S	Bend	trans	-79.5	121.5	163.7	55.2	0	0	0	0	106.8	P284	P284-T286 PolarHBondContact O-N 3.42Å
287	D	62.6	Low	63.1	Low	73 Å²	73	96.2 Å²	96.2	39%	0.39	59%	0.586	S	S	.	*			trans	80.9	59.4	-178.2	-144.9	-12	0	0	0	116	S289 Q290 V291	D287-S289 PolarHBondContact O-N 3Å; D287-S289 VanDerWaalsContact O-N 3.15Å; D287-S289 PolarHBondContact OD1-OG 2.83Å; D287-Q290 PolarHBondContact O-N 2.83Å; D287-Q290 WeakPolarHBondContact OD2-CG 3.16Å; D287-Q290 PolarHBondContact OD2-NE2 3.24Å; D287-Q290 VanDerWaalsContact OD2-NE2 3.09Å; D287-V291 PolarHBondContact O-N 3.25Å
288	I	64.5	Low	61.9	Low	97 Å²	97	102.3 Å²	102.3	50%	0.497	61%	0.614	S	S	.	*	H	α-helix	trans	-55.8	-29.4	175	-56.1	159.4	0	0	0	111.4	L285 Q290 V291 L292	L285-I288 HydrophobicContact CB-CG1 4.24Å; I288-Q290 VanDerWaalsContact C-N 3.31Å; I288-Q290 PolarHBondContact O-N 2.73Å; I288-V291 PolarHBondContact O-N 2.79Å; I288-L292 HydrophobicContact CG2-CD1 3.42Å; I288-L292 VanDerWaalsContact CG2-CD1 3.42Å; I288-L292 HydrophobicContact CG2-CG 3.89Å; I288-L292 WeakPolarHBondContact O-CB 3.36Å; I288-L292 PolarHBondContact O-N 3.21Å
289	S	67	Low	60.2	Low	87 Å²	87	98.5 Å²	98.5	61%	0.608	61%	0.606	S	S	*	*	H	α-helix	trans	-57.9	-40.2	175.6	10.9	0	0	0	0	112.8	D287	D287-S289 PolarHBondContact O-N 3Å; D287-S289 VanDerWaalsContact O-N 3.15Å; D287-S289 PolarHBondContact OD1-OG 2.83Å
290	Q	65.5	Low	58.9	Low	153 Å²	153	108.9 Å²	108.9	72%	0.715	64%	0.639	S	S	*	*	H	α-helix	trans	-79.4	-30.4	178.7	-67.3	-175.5	-0.1	0	0	112.4	D287 I288	D287-Q290 PolarHBondContact O-N 2.83Å; D287-Q290 WeakPolarHBondContact OD2-CG 3.16Å; D287-Q290 PolarHBondContact OD2-NE2 3.24Å; D287-Q290 VanDerWaalsContact OD2-NE2 3.09Å; I288-Q290 VanDerWaalsContact C-N 3.31Å; I288-Q290 PolarHBondContact O-N 2.73Å
291	V	60.1	Low	57.5	Low	90 Å²	90	108.2 Å²	108.2	55%	0.545	64%	0.641	S	S	.	*	H	α-helix	trans	-85.2	-28	-176.2	178.7	0	0	0	0	113.1	L285 D287 I288	L285-V291 HydrophobicContact CD2-CB 4.02Å; L285-V291 HydrophobicContact CD2-CG1 3.83Å; L285-V291 HydrophobicContact CD2-CG2 3.67Å; D287-V291 PolarHBondContact O-N 3.25Å; I288-V291 PolarHBondContact O-N 2.79Å
292	L	61.1	Low	56.6	Low	113 Å²	113	107.1 Å²	107.1	59%	0.592	64%	0.642	S	S	*	*	S	Bend	trans	-91.6	-5.3	178.1	-72.6	-179.6	0	0	0	114.6	I288 I294	I288-L292 HydrophobicContact CG2-CD1 3.42Å; I288-L292 VanDerWaalsContact CG2-CD1 3.42Å; I288-L292 HydrophobicContact CG2-CG 3.89Å; I288-L292 WeakPolarHBondContact O-CB 3.36Å; I288-L292 PolarHBondContact O-N 3.21Å; L292-I294 HydrophobicContact CB-CD1 4.28Å; L292-I294 HydrophobicContact CB-CG1 4.14Å; L292-I294 WeakPolarHBondContact O-CG1 3.15Å; L292-I294 PolarHBondContact O-N 3.46Å
293	G	53.3	Low	54.9	Low	62 Å²	62	111 Å²	111	64%	0.639	67%	0.672	S	S	*	*			trans	55.8	19.6	175.9	0	0	0	0	0	114.2	E295	G293-E295 PolarHBondContact O-N 2.68Å; G293-E295 VanDerWaalsContact O-N 3.14Å
294	I	52.8	Low	53.6	Low	126 Å²	126	111.8 Å²	111.8	65%	0.646	69%	0.685	S	S	*	*			trans	-87	89.8	177.9	-55.9	179.2	0	0	0	106.2	L292 A296	L292-I294 HydrophobicContact CB-CD1 4.28Å; L292-I294 HydrophobicContact CB-CG1 4.14Å; L292-I294 WeakPolarHBondContact O-CG1 3.15Å; L292-I294 PolarHBondContact O-N 3.46Å; I294-A296 PolarHBondContact O-N 3.06Å
295	E	42.4	Very low	52.5	Low	192 Å²	192	113 Å²	113	90%	0.897	69%	0.69	S	S	*	*			trans	-59.4	87.7	162.8	-64.5	-173.4	123.1	0	0	108.5	G293 G297	G293-E295 PolarHBondContact O-N 2.68Å; G293-E295 VanDerWaalsContact O-N 3.14Å; E295-G297 PolarHBondContact O-N 2.78Å
296	A	47.3	Very low	51.4	Low	94 Å²	94	116.9 Å²	116.9	78%	0.777	71%	0.711	S	S	*	*			trans	-73.3	76.1	164.6	0	0	0	0	0	108.2	I294 N298	I294-A296 PolarHBondContact O-N 3.06Å; A296-N298 PolarHBondContact O-N 3.04Å
297	G	42.1	Very low	50.2	Low	68 Å²	68	116.2 Å²	116.2	70%	0.701	71%	0.711	S	S	*	*			trans	-65.8	109.7	165.5	0	0	0	0	0	110.1	E295	E295-G297 PolarHBondContact O-N 2.78Å
298	N	44.1	Very low	49.9	Very low	147 Å²	147	120.9 Å²	120.9	79%	0.786	73%	0.733	S	S	*	*			trans	-163.1	84	153.2	-120.4	14.4	0	0	0	107.3	A296	A296-N298 PolarHBondContact O-N 3.04Å
299	A	41	Very low	49.4	Very low	83 Å²	83	121.3 Å²	121.3	69%	0.686	74%	0.742	S	S	*	*				60.9	75.4	84.6	0	0	0	0	0	113.7
300	Y	42.8	Very low	48.3	Very low	242 Å²	242	126.9 Å²	126.9	95%	0.949	76%	0.755	S	S	*	*			trans	-148.7	95.2	149.9	-87.8	-77.1	0	0	0	109.7
301	G	42.5	Very low	47.3	Very low	69 Å²	69	123.1 Å²	123.1	71%	0.711	76%	0.758	S	S	*	*			trans	-158.7	119.8	167.5	0	0	0	0	0	109.1
302	P	47.5	Very low	46.9	Very low	134 Å²	134	124.7 Å²	124.7	87%	0.87	77%	0.773	S	S	*	*			trans	-84.2	124	179.9	31.4	-29.2	0	0	0	111.3
303	A	37.1	Very low	46	Very low	97 Å²	97	123.2 Å²	123.2	80%	0.802	79%	0.785	S	S	*	*			trans	27.9	115.4	145.8	0	0	0	0	0	119.9
304	T	44.1	Very low	45.5	Very low	142 Å²	142	124 Å²	124	87%	0.871	79%	0.793	S	S	*	*				-146.2	152	126.5	-168.6	0	0	0	0	110.2
305	V	48.1	Very low	45.4	Very low	120 Å²	120	124.9 Å²	124.9	73%	0.727	81%	0.807	S	S	*	*			trans	-94.7	152.7	-144.8	-76.3	0	0	0	0	114.9
306	N	44.6	Very low	45.5	Very low	142 Å²	142	119.4 Å²	119.4	76%	0.759	80%	0.802	S	S	*	*			trans	49.4	124.4	147.1	-75.2	-1.5	0	0	0	118.7
307	S	44	Very low	45.8	Very low	110 Å²	110	119.4 Å²	119.4	77%	0.769	80%	0.797	S	S	*	*				-178.6	122.4	60.6	29.1	0	0	0	0	111.4
308	M	57.1	Low	45.9	Very low	171 Å²	171	125.4 Å²	125.4	84%	0.842	81%	0.806	S	S	*	*			trans	27.5	170.3	132.4	-55.2	-166.7	-176.2	0	0	122.6
309	P	53.6	Low	45.8	Very low	105 Å²	105	121.7 Å²	121.7	68%	0.682	80%	0.802	S	S	*	*				-146.3	171.1	-56	42.9	-25.9	0	0	0	113.5
310	F	44.3	Very low	46	Very low	204 Å²	204	125.2 Å²	125.2	90%	0.895	82%	0.815	S	S	*	*			trans	155.1	114.7	147.1	-113	-103.9	0	0	0	107.6
311	G	43.6	Very low	46	Very low	74 Å²	74	117.1 Å²	117.1	76%	0.763	81%	0.805	S	S	*	*				97.1	136.1	64.4	0	0	0	0	0	108.1
312	S	51.1	Low	46.4	Very low	123 Å²	123	123 Å²	123	86%	0.86	82%	0.816	S	S	*	*			cis	-176.1	139.9	11.1	151.5	0	0	0	0	108.5
313	G	43.3	Very low	46.4	Very low	83 Å²	83	123.7 Å²	123.7	86%	0.856	81%	0.813	S	S	*	*			trans	71.1	140.3	152.4	0	0	0	0	0	119.2
314	G	42.6	Very low	47.1	Very low	78 Å²	78	127.3 Å²	127.3	80%	0.804	82%	0.815	S	S	*	*			cis	150	136.1	10.2	0	0	0	0	0	109.6
315	P	51.3	Low	47.1	Very low	144 Å²	144	124 Å²	124	94%	0.935	81%	0.809	S	S	*	*			trans	-119	172.5	-170.6	40.9	-29.7	0	0	0	117
316	G	42.8	Very low	46.9	Very low	77 Å²	77	122.2 Å²	122.2	79%	0.794	82%	0.816	S	S	*	*			trans	175.1	156.6	166.9	0	0	0	0	0	110.4
317	S	54.1	Low	47.1	Very low	95 Å²	95	120 Å²	120	66%	0.664	82%	0.816	S	S	*	*			cis	-178.9	136.5	4.7	163.4	0	0	0	0	109.1
318	Q	43.8	Very low	47.3	Very low	194 Å²	194	122.8 Å²	122.8	91%	0.907	82%	0.82	S	S	*	*			trans	65.9	136.6	139.7	-65.7	172.4	28.2	0	0	126.1
319	G	42.6	Very low	46.5	Very low	68 Å²	68	117.9 Å²	117.9	70%	0.701	81%	0.812	S	S	*	*			trans	146.5	105.1	145.2	0	0	0	0	0	113.2
320	V	45.2	Very low	46	Very low	157 Å²	157	121.8 Å²	121.8	95%	0.952	82%	0.815	S	S	*	*				75.6	125.1	63.4	-50.9	0	0	0	0	118
321	G	42.4	Very low	46	Very low	72 Å²	72	116.5 Å²	116.5	74%	0.742	81%	0.809	S	S	*	*			trans	135.7	100	164	0	0	0	0	0	113.7
322	M	51.6	Low	45.8	Very low	193 Å²	193	124.9 Å²	124.9	95%	0.951	82%	0.817	S	S	*	*				63.5	115.9	76.4	-63.2	-134.4	-170.6	0	0	116.2
323	D	46.3	Very low	45.1	Very low	149 Å²	149	122.5 Å²	122.5	80%	0.797	81%	0.812	S	S	*	*				163.1	154.5	105.4	-162.6	-136.6	0	0	0	116
324	M	52	Low	45.2	Very low	172 Å²	172	128.7 Å²	128.7	85%	0.847	82%	0.816	S	S	*	*			trans	-38.8	169.8	172.3	-66.9	-102.1	-162.5	0	0	117.8
325	G	44.6	Very low	44.8	Very low	72 Å²	72	134.3 Å²	134.3	74%	0.742	82%	0.821	S	S	*	*			cis	150.3	150.2	11.6	0	0	0	0	0	109.8
326	G	44.5	Very low	44.4	Very low	84 Å²	84	130.4 Å²	130.4	87%	0.866	81%	0.806	S	S	*	*			trans	80.1	156.5	165	0	0	0	0	0	117.3
327	A	47.7	Very low	44.6	Very low	94 Å²	94	135 Å²	135	78%	0.777	81%	0.812	S	S	*	*			cis	-169.8	149.2	-3.2	0	0	0	0	0	109.1
328	M	48	Very low	44.1	Very low	170 Å²	170	138.9 Å²	138.9	84%	0.837	82%	0.819	S	S	*	*			trans	50.9	130.1	134.3	-125.8	155.3	-170.6	0	0	121.8	Y330	M328-Y330 VanDerWaalsContact CE-OH 3.32Å; M328-Y330 WeakPolarHBondContact CE-OH 3.47Å; M328-Y330 VanDerWaalsContact CG-OH 3.25Å; M328-Y330 WeakPolarHBondContact CG-OH 2.92Å
329	G	42	Very low	44.1	Very low	67 Å²	67	134.1 Å²	134.1	69%	0.691	81%	0.808	S	S	*	*			trans	154.4	140.8	150.7	0	0	0	0	0	116.3
330	Y	41.4	Very low	44.1	Very low	188 Å²	188	135.5 Å²	135.5	74%	0.737	81%	0.812	S	S	*	*			trans	-117.8	165.6	-158.9	-28.7	-93	0	0	0	112.5	M328	M328-Y330 VanDerWaalsContact CE-OH 3.32Å; M328-Y330 WeakPolarHBondContact CE-OH 3.47Å; M328-Y330 VanDerWaalsContact CG-OH 3.25Å; M328-Y330 WeakPolarHBondContact CG-OH 2.92Å
331	A	44.3	Very low	44.1	Very low	92 Å²	92	134.1 Å²	134.1	76%	0.76	80%	0.804	S	S	*	*			trans	90.1	118.2	148.1	0	0	0	0	0	121.2
332	R	39.8	Very low	44.4	Very low	251 Å²	251	135 Å²	135	95%	0.947	81%	0.805	S	S	*	*			trans	62.3	103.1	135.7	-70.4	-171.1	175.3	178.8	-0.4	120.6
333	G	37.1	Very low	44.3	Very low	72 Å²	72	131.8 Å²	131.8	74%	0.742	80%	0.798	S	S	*	*				62.4	110.9	113.3	0	0	0	0	0	119.6
334	F	44.3	Very low	44.4	Very low	214 Å²	214	129.7 Å²	129.7	94%	0.939	80%	0.801	S	S	*	*			trans	-154.4	141.3	149.7	-133	-95.2	0	0	0	112
335	H	34.3	Very low	43.8	Very low	196 Å²	196	125.5 Å²	125.5	91%	0.907	80%	0.802	S	S	*	*			trans	-79.2	156.8	178.1	-105.8	-103.4	0	0	0	112.3
336	G	43	Very low	43.7	Very low	61 Å²	61	125.6 Å²	125.6	63%	0.629	80%	0.803	S	S	*	*			trans	149.8	100	161.5	0	0	0	0	0	112
337	L	48.4	Very low	43.5	Very low	174 Å²	174	127.2 Å²	127.2	91%	0.911	80%	0.801	S	S	*	*				69.2	119.7	95	-76.6	167.5	0	0	0	113.9
338	Q	43.5	Very low	43.6	Very low	176 Å²	176	130.2 Å²	130.2	82%	0.822	80%	0.803	S	S	*	*				169	111.2	112.3	-155.1	125	43.5	0	0	110.9
339	S	42.9	Very low	43.7	Very low	95 Å²	95	131 Å²	131	66%	0.664	81%	0.806	S	S	*	*				74.9	118.6	107.3	-75.1	0	0	0	0	119.4
340	A	43.4	Very low	43.7	Very low	96 Å²	96	131 Å²	131	79%	0.793	81%	0.807	S	S	*	*				-169.8	110.1	117.2	0	0	0	0	0	105.7
341	V	45.4	Very low	44.2	Very low	128 Å²	128	128.4 Å²	128.4	78%	0.776	81%	0.813	S	S	*	*				42.8	125.9	53.9	-33	0	0	0	0	112.1
342	A	48.9	Very low	44.4	Very low	92 Å²	92	132.3 Å²	132.3	76%	0.76	82%	0.817	S	S	*	*			cis	-164.4	175.6	26.9	0	0	0	0	0	111.5
343	P	49.6	Very low	44.7	Very low	125 Å²	125	127.4 Å²	127.4	81%	0.812	81%	0.81	S	S	*	*			trans	-111.9	-171.3	-167	41.2	-29.4	0	0	0	114.7
344	A	47	Very low	45	Very low	104 Å²	104	128.1 Å²	128.1	86%	0.86	80%	0.804	S	S	*	*			trans	111.6	136.5	145.7	0	0	0	0	0	119.8
345	G	40.4	Very low	45	Very low	85 Å²	85	121.9 Å²	121.9	88%	0.876	79%	0.792	S	S	*	*			trans	91.4	136.2	158.8	0	0	0	0	0	115.1
346	G	41.5	Very low	45.6	Very low	73 Å²	73	122.3 Å²	122.3	75%	0.753	79%	0.791	S	S	*	*			cis	176	143.9	4.4	0	0	0	0	0	109.1
347	S	41.2	Very low	45.9	Very low	118 Å²	118	124.9 Å²	124.9	83%	0.825	80%	0.797	S	S	*	*			trans	2.9	135.3	157.6	-41.6	0	0	0	0	120.1
348	I	50.1	Low	45.8	Very low	158 Å²	158	123.7 Å²	123.7	81%	0.81	79%	0.791	S	S	*	*				-163.5	128.7	126.9	-17.3	164.9	0	0	0	112.7
349	M	49	Very low	46	Very low	185 Å²	185	119.9 Å²	119.9	91%	0.911	78%	0.782	S	S	*	*			trans	40.4	134.9	149.4	-71.2	176.2	-170.3	0	0	120.7
350	G	43.6	Very low	46.1	Very low	68 Å²	68	123 Å²	123	70%	0.701	79%	0.791	S	S	*	*			cis	132.3	133.4	28.9	0	0	0	0	0	107.4
351	P	51.7	Low	46.1	Very low	133 Å²	133	123.6 Å²	123.6	86%	0.864	79%	0.788	S	S	*	*			trans	-94	130.1	-176.7	35	-28.3	0	0	0	110.8
352	M	48.7	Very low	46.4	Very low	174 Å²	174	126.5 Å²	126.5	86%	0.857	80%	0.796	S	S	*	*			trans	-147.5	129.7	174.7	-90.2	-172.4	152.9	0	0	111.6
353	N	44.6	Very low	46.2	Very low	148 Å²	148	127.8 Å²	127.8	79%	0.791	80%	0.796	S	S	*	*			trans	56	146.2	136.8	-83	0.4	0	0	0	119
354	S	44.1	Very low	45.9	Very low	88 Å²	88	125.4 Å²	125.4	62%	0.615	80%	0.795	S	S	*	*			cis	-173	144.7	19.9	24	0	0	0	0	109
355	A	43.1	Very low	45.9	Very low	83 Å²	83	125 Å²	125	69%	0.686	79%	0.785	S	S	*	*			trans	13	118.1	135.6	0	0	0	0	0	118.4
356	F	47.5	Very low	46.3	Very low	205 Å²	205	129.3 Å²	129.3	90%	0.899	79%	0.785	S	S	*	*			trans	-138.7	107.2	139.4	-75.4	-76.9	0	0	0	109.2
357	P	49	Very low	46.4	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-92.5	119.8	155.9	30.3	-19.8	0	0	0	108.1	P359	P357-P359 WeakPolarHBondContact O-CD 3.47Å
358	N	47.4	Very low	46.3	Very low	148 Å²	148	130.6 Å²	130.6	79%	0.791	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-84.9	119.5	170.3	-164.1	26.8	0	0	0	109.3
359	P	46.5	Very low	46.2	Very low	96 Å²	96	129.3 Å²	129.3	62%	0.623	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-92.6	126	175.9	33.7	-24.3	0	0	0	109.1	P357	P357-P359 WeakPolarHBondContact O-CD 3.47Å
360	N	46.5	Very low	45.6	Very low	160 Å²	160	124.4 Å²	124.4	86%	0.856	78%	0.781	S	S	*	*			trans	-139.1	88.1	152.9	-95.4	-20	0	0	0	108.9
361	C	43.2	Very low	45.4	Very low	110 Å²	110	125 Å²	125	74%	0.743	79%	0.787	S	S	*	*			trans	-73.4	119.1	165.2	-170.2	0	0	0	0	108
362	M	51.3	Low	44.8	Very low	188 Å²	188	125.2 Å²	125.2	93%	0.926	79%	0.792	S	S	*	*			trans	-141.9	110.2	153.2	-78.1	-126.6	152.8	0	0	108.2
363	P	43.9	Very low	44.4	Very low	119 Å²	119	119.5 Å²	119.5	77%	0.773	78%	0.777	S	S	*	*			trans	-104.6	141.3	165.8	34.7	-23.9	0	0	0	110.4
364	G	43.7	Very low	44.1	Very low	76 Å²	76	115 Å²	115	78%	0.784	77%	0.767	S	S	*	*			trans	144.4	142.6	168.7	0	0	0	0	0	110.2
365	S	46.7	Very low	44.2	Very low	94 Å²	94	121.2 Å²	121.2	66%	0.657	78%	0.778	S	S	*	*			cis	-177.6	147.2	-6.8	-164.5	0	0	0	0	103.6
366	M	48.7	Very low	44.2	Very low	176 Å²	176	128 Å²	128	87%	0.867	79%	0.786	S	S	*	*			trans	69.8	150.8	152.7	-66.9	157.9	166.1	0	0	117.3
367	N	43.9	Very low	43.9	Very low	159 Å²	159	124.8 Å²	124.8	85%	0.85	78%	0.778	S	S	*	*			cis	176.3	150.1	-12	175.7	27.5	0	0	0	104.8
368	G	39.7	Very low	43.6	Very low	59 Å²	59	126.4 Å²	126.4	61%	0.608	78%	0.78	S	S	*	*			trans	91.6	103.8	157.4	0	0	0	0	0	115
369	S	46.4	Very low	43.5	Very low	131 Å²	131	124.3 Å²	124.3	92%	0.916	77%	0.774	S	S	*	*				75.4	121.9	57.8	-171.3	0	0	0	0	114.5
370	G	38.4	Very low	43.3	Very low	82 Å²	82	124.7 Å²	124.7	85%	0.845	78%	0.779	S	S	*	*			trans	95.8	135.7	158.1	0	0	0	0	0	114
371	G	38	Very low	43	Very low	81 Å²	81	124.9 Å²	124.9	84%	0.835	78%	0.779	S	S	*	*			cis	179.5	161.5	10.2	0	0	0	0	0	110.1
372	S	40	Very low	43.1	Very low	138 Å²	138	127.8 Å²	127.8	97%	0.965	79%	0.786	S	S	*	*			trans	-75.1	162.9	-173.9	-152.5	0	0	0	0	114.7
373	G	40	Very low	42.7	Very low	53 Å²	53	124.3 Å²	124.3	55%	0.546	78%	0.781	S	S	.	*			trans	134.4	113.1	160.5	0	0	0	0	0	112
374	G	38.2	Very low	42.6	Very low	55 Å²	55	122.2 Å²	122.2	57%	0.567	78%	0.78	S	S	*	*				63.2	127.8	78.3	0	0	0	0	0	109.5
375	Y	46.5	Very low	42.9	Very low	217 Å²	217	124.8 Å²	124.8	85%	0.851	78%	0.783	S	S	*	*			cis	-170.5	137.7	43.3	-45.1	-81	0	0	0	109.4
376	R	42.1	Very low	42.7	Very low	226 Å²	226	124.6 Å²	124.6	85%	0.853	78%	0.78	S	S	*	*			trans	21.7	134.1	138.5	-61.3	179.9	-171.5	163.6	3.1	122.3
377	N	41.5	Very low	42.2	Very low	138 Å²	138	125.8 Å²	125.8	74%	0.738	78%	0.776	S	S	*	*			trans	70.2	142.5	131.9	-70.9	-17.3	0	0	0	118.4
378	L	43.1	Very low	41.9	Very low	149 Å²	149	125.3 Å²	125.3	78%	0.78	77%	0.773	S	S	*	*			cis	-165	-172.6	11.6	-135.8	89	0	0	0	107.3
379	P	45.5	Very low	42.2	Very low	104 Å²	104	127.6 Å²	127.6	68%	0.675	78%	0.778	S	S	*	*			trans	-126.4	-178.4	-131.5	34.5	-9.6	0	0	0	115.3
380	S	42	Very low	42.1	Very low	103 Å²	103	127.5 Å²	127.5	72%	0.72	77%	0.772	S	S	*	*			trans	-170.5	112.9	152.8	-85.8	0	0	0	0	110.3
381	L	40.6	Very low	42.2	Very low	164 Å²	164	128.9 Å²	128.9	86%	0.859	77%	0.766	S	S	*	*				67.9	94.4	101.1	-64.4	175.9	0	0	0	114.4
382	L	43.9	Very low	42.2	Very low	171 Å²	171	128.1 Å²	128.1	90%	0.895	75%	0.752	S	S	*	*				-176	114.8	126.2	-144.3	55.1	0	0	0	113.3
383	S	43.6	Very low	42.1	Very low	116 Å²	116	129.5 Å²	129.5	81%	0.811	75%	0.746	S	S	*	*			trans	67.4	93.8	137.1	-161.8	0	0	0	0	123.4
384	G	42	Very low	42	Very low	74 Å²	74	134.5 Å²	134.5	76%	0.763	76%	0.755	S	S	*	*			trans	88.8	158.7	130.6	0	0	0	0	0	119.5
385	P	50.3	Low	41.9	Very low	130 Å²	130	136.8 Å²	136.8	84%	0.844	76%	0.763	S	S	*	*			cis	-117.2	-172.5	-14.6	43.7	-27.6	0	0	0	111.2
386	P	42.7	Very low	41.6	Very low	91 Å²	91	136 Å²	136	59%	0.591	77%	0.767	S	S	*	*			trans	-100.1	155.6	-147.4	44.4	-40.9	0	0	0	114.2
387	Y	37.5	Very low	41.7	Very low	201 Å²	201	129.3 Å²	129.3	79%	0.788	76%	0.76	S	S	*	*			trans	35.1	113.3	163.7	64.3	-93.2	0	0	0	118.4
388	D	37	Very low	42.3	Very low	148 Å²	148	127.4 Å²	127.4	79%	0.791	76%	0.757	S	S	*	*			trans	-146.1	108.3	135.3	-133.9	-30.6	0	0	0	107.5	T390	D388-T390 VanDerWaalsContact C-N 3.28Å; D388-T390 PolarHBondContact O-N 2.97Å
389	P	47.2	Very low	43.1	Very low	108 Å²	108	121.9 Å²	121.9	70%	0.701	73%	0.734	S	S	*	*			trans	-71	97.3	171.4	29.4	-26.4	0	0	0	105.8	P391	P389-P391 WeakPolarHBondContact O-CD 3.2Å
390	T	43.2	Very low	44.2	Very low	128 Å²	128	118.1 Å²	118.1	79%	0.785	71%	0.709	S	S	*	*			trans	-42.4	115.6	162.6	31.7	0	0	0	0	107.4	D388 A392	D388-T390 VanDerWaalsContact C-N 3.28Å; D388-T390 PolarHBondContact O-N 2.97Å; T390-A392 PolarHBondContact O-N 3.39Å
391	P	42.3	Very low	46.2	Very low	112 Å²	112	118 Å²	118	73%	0.727	69%	0.693	S	S	*	*			trans	-64.7	115.7	171.2	26.5	-28.3	0	0	0	103.7	P389 I393	P389-P391 WeakPolarHBondContact O-CD 3.2Å; P391-I393 PolarHBondContact O-N 3.21Å; P391-I393 VanDerWaalsContact O-N 3.07Å
392	A	37.9	Very low	48.5	Very low	65 Å²	65	110.9 Å²	110.9	54%	0.537	66%	0.655	S	S	.	*			trans	-40.4	126.3	162.9	0	0	0	0	0	106.6	T390 H394	T390-A392 PolarHBondContact O-N 3.39Å; A392-H394 PolarHBondContact O-N 2.74Å; A392-H394 PolarHBondContact O-ND1 3.17Å
393	I	38	Very low	50.6	Low	166 Å²	166	102.8 Å²	102.8	85%	0.851	61%	0.612	S	S	*	*			trans	-62.2	83.3	174.5	-63.7	172.5	0	0	0	105.2	P391 S395	P391-I393 PolarHBondContact O-N 3.21Å; P391-I393 VanDerWaalsContact O-N 3.07Å; I393-S395 VanDerWaalsContact C-N 3.3Å; I393-S395 PolarHBondContact O-N 2.71Å
394	H	37.8	Very low	52.9	Low	158 Å²	158	99.2 Å²	99.2	73%	0.731	58%	0.584	S	S	*	*			trans	-73.4	97.8	170.2	-70.7	85.5	0	0	0	103.8	A392 Q396	A392-H394 PolarHBondContact O-N 2.74Å; A392-H394 PolarHBondContact O-ND1 3.17Å; H394-Q396 PolarHBondContact O-N 2.74Å
395	S	34.8	Very low	55.2	Low	104 Å²	104	95.8 Å²	95.8	73%	0.727	55%	0.548	S	S	*	.			trans	-30	116.9	156.3	-61.4	0	0	0	0	108.4	I393 A397	I393-S395 VanDerWaalsContact C-N 3.3Å; I393-S395 PolarHBondContact O-N 2.71Å; S395-A397 PolarHBondContact O-N 3.42Å
396	Q	40.2	Very low	57	Low	200 Å²	200	95.6 Å²	95.6	94%	0.935	53%	0.53	S	S	*	.			trans	-66.5	71.8	176.9	-75.6	-174.1	-6.1	0	0	109.2	H394 S398	H394-Q396 PolarHBondContact O-N 2.74Å; Q396-S398 PolarHBondContact O-N 3Å
397	A	44.4	Very low	59.2	Low	86 Å²	86	94.8 Å²	94.8	71%	0.711	52%	0.521	S	S	*	.			trans	-63.6	114.3	159.6	0	0	0	0	0	105.6	S395 A399	S395-A397 PolarHBondContact O-N 3.42Å; A397-A399 PolarHBondContact O-N 2.9Å
398	S	54	Low	61.6	Low	97 Å²	97	85.6 Å²	85.6	68%	0.678	49%	0.486	S	S	*	.			trans	-47	105.9	176.1	-175.9	0	0	0	0	109.2	Q396	Q396-S398 PolarHBondContact O-N 3Å
399	A	60.7	Low	63.7	Low	34 Å²	34	78.8 Å²	78.8	28%	0.281	45%	0.449	S	S	.	.			trans	-57.8	134.7	-175.6	0	0	0	0	0	109.8	A397 R401 P445	A397-A399 PolarHBondContact O-N 2.9Å; A399-R401 PolarHBondContact O-N 3.15Å; A399-R401 VanDerWaalsContact O-N 3.15Å; A399-P445 HydrophobicContact CB-CB 3.64Å; A399-P445 HydrophobicContact CB-CG 4.29Å
400	P	69.3	Low	65.4	Low	24 Å²	24	78 Å²	78	16%	0.156	45%	0.445	C	S	.	.			trans	-62.2	119	-172.8	22	-30.8	0	0	0	110.7	F402 L469 A470 I471	P400-F402 VanDerWaalsContact C-N 3.28Å; P400-L469 HydrophobicContact CB-CB 4.4Å; P400-L469 HydrophobicContact CG-CB 3.85Å; P400-L469 HydrophobicContact CG-CD2 4.12Å; P400-L469 HydrophobicContact CG-CG 4.38Å; P400-A470 WeakPolarHBondContact CB-O 3.4Å; P400-I471 HydrophobicContact CB-CG1 3.92Å; P400-I471 HydrophobicContact CG-CG1 4.28Å
401	R	83.4	Confident	67.3	Low	102 Å²	102	77.4 Å²	77.4	39%	0.385	44%	0.436	S	S	.	.			trans	-80.8	-10	172.8	-68.8	-172	177.9	100.8	1.3	113	A399 R441 F442 P445	A399-R401 PolarHBondContact O-N 3.15Å; A399-R401 VanDerWaalsContact O-N 3.15Å; R401-R441 HydrophobicContact CB-CG 4.43Å; R401-R441 WeakPolarHBondContact O-CA 3.47Å; R401-F442 PolarHBondContact O-N 3.49Å; R401-P445 HydrophobicContact CG-CB 4.15Å
402	F	88	Confident	69.4	Low	14 Å²	14	74.2 Å²	74.2	6%	0.061	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.9	-177.8	-66.1	-88.7	0	0	0	111.7	P400 K439 I440 R441 A470 N472	P400-F402 VanDerWaalsContact C-N 3.28Å; F402-K439 HydrophobicContact CD1-CD 4.44Å; F402-K439 HydrophobicContact CD1-CG 4.26Å; F402-I440 CarbonylContact C-O 3.53Å; F402-I440 VanDerWaalsContact CA-O 3.31Å; F402-I440 WeakPolarHBondContact CA-O 3.26Å; F402-R441 HydrophobicContact CD1-CB 3.71Å; F402-R441 HydrophobicContact CD1-CG 3.97Å; F402-R441 HydrophobicContact CE1-CB 3.63Å; F402-R441 HydrophobicContact CE1-CG 3.7Å; F402-R441 HydrophobicContact CE2-CG 4.37Å; F402-R441 HydrophobicContact CG-CG 4.45Å; F402-R441 HydrophobicContact CZ-CB 4.38Å; F402-R441 HydrophobicContact CZ-CG 3.94Å; F402-A470 HydrophobicContact CB-CB 4.2Å; F402-A470 WeakPolarHBondContact CB-O 3.48Å; F402-A470 PolarHBondContact O-N 3.05Å; F402-N472 WeakPolarHBondContact CD2-O 3.4Å
403	I	89.7	Confident	71.9	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	142.5	165.9	66.3	163	0	0	0	109.5	I405 L421 I440 F442 A448 A452 L455 V467 D468 L469	I403-I405 HydrophobicContact CD1-CD1 3.98Å; I403-I405 HydrophobicContact CD1-CG1 4.1Å; I403-L421 HydrophobicContact CD1-CD1 4.34Å; I403-L421 HydrophobicContact CD1-CD2 4.46Å; I403-I440 HydrophobicContact CD1-CB 4.33Å; I403-I440 HydrophobicContact CG1-CB 3.78Å; I403-I440 HydrophobicContact CG1-CG2 4.39Å; I403-I440 PolarHBondContact N-O 3.08Å; I403-I440 PolarHBondContact O-N 2.9Å; I403-F442 HydrophobicContact CD1-CE2 3.61Å; I403-F442 HydrophobicContact CD1-CZ 4.38Å; I403-F442 HydrophobicContact CG1-CD2 4.44Å; I403-F442 HydrophobicContact CG1-CE2 3.91Å; I403-F442 HydrophobicContact CG2-CE2 4.44Å; I403-A448 HydrophobicContact CG2-CB 4.03Å; I403-A452 HydrophobicContact CG2-CB 4.22Å; I403-L455 HydrophobicContact CD1-CD1 4.28Å; I403-V467 HydrophobicContact CB-CG1 3.98Å; I403-V467 HydrophobicContact CD1-CG1 4.15Å; I403-V467 HydrophobicContact CG2-CG1 4.47Å; I403-D468 CarbonylContact C-O 3.59Å; I403-D468 WeakPolarHBondContact CA-O 3.41Å; I403-L469 HydrophobicContact CG2-CD2 3.95Å
404	I	90.2	Very high	74.4	Confident	41 Å²	41	70.8 Å²	70.8	21%	0.21	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	119.7	171.9	-62.3	177.2	0	0	0	107.5	R406 V437 G438 V467 D468 A470	I404-R406 HydrophobicContact CG2-CG 4.22Å; I404-V437 HydrophobicContact CG2-CG1 3.74Å; I404-G438 WeakPolarHBondContact CA-O 2.98Å; I404-V467 WeakPolarHBondContact O-CA 3.45Å; I404-D468 PolarHBondContact N-O 2.91Å; I404-D468 PolarHBondContact O-N 2.73Å; I404-A470 HydrophobicContact CD1-CB 3.58Å; I404-A470 HydrophobicContact CG1-CB 3.8Å
405	I	90.2	Very high	76.9	Confident	3 Å²	3	68 Å²	68	2%	0.015	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.7	177.5	-55.5	177.2	0	0	0	107.5	I403 L408 L417 L421 V437 G438 I440 I465 A466 V467	I403-I405 HydrophobicContact CD1-CD1 3.98Å; I403-I405 HydrophobicContact CD1-CG1 4.1Å; I405-L408 HydrophobicContact CB-CD1 3.79Å; I405-L408 HydrophobicContact CG2-CD1 3.54Å; I405-L408 HydrophobicContact CG2-CD2 4.17Å; I405-L408 HydrophobicContact CG2-CG 3.75Å; I405-L408 WeakPolarHBondContact O-CD1 3.16Å; I405-L417 HydrophobicContact CD1-CD2 3.73Å; I405-L421 HydrophobicContact CD1-CD1 3.72Å; I405-V437 CarbonylContact O-C 3.57Å; I405-V437 VanDerWaalsContact O-CA 3.29Å; I405-V437 WeakPolarHBondContact O-CA 3.18Å; I405-G438 PolarHBondContact N-O 3.22Å; I405-G438 PolarHBondContact O-N 2.99Å; I405-I440 HydrophobicContact CD1-CD1 3.8Å; I405-I465 HydrophobicContact CG2-CB 4.08Å; I405-I465 HydrophobicContact CG2-CG2 3.67Å; I405-A466 CarbonylContact C-O 3.57Å; I405-A466 WeakPolarHBondContact CA-O 3.22Å; I405-V467 HydrophobicContact CB-CG2 4.46Å; I405-V467 HydrophobicContact CG1-CG1 4.11Å; I405-V467 HydrophobicContact CG1-CG2 3.92Å; I405-V467 HydrophobicContact CG2-CG2 4.24Å
406	R	89.7	Confident	79.5	Confident	125 Å²	125	65.8 Å²	65.8	47%	0.472	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	156.7	179.9	-52	-179.3	-169	-119	4.8	110.3	I404 L408 G436 I465 A466 D468	I404-R406 HydrophobicContact CG2-CG 4.22Å; R406-L408 VanDerWaalsContact C-N 3.34Å; R406-G436 CarbonylContact C-O 3.57Å; R406-I465 WeakPolarHBondContact O-CG2 3.08Å; R406-A466 HydrophobicContact CB-CB 4.43Å; R406-A466 PolarHBondContact N-O 2.88Å; R406-A466 PolarHBondContact O-N 2.79Å; R406-D468 IonicContact CZ-OD2 3.24Å; R406-D468 VanDerWaalsContact CZ-OD2 3.24Å; R406-D468 IonicContact NE-OD2 2.73Å; R406-D468 PolarHBondContact NE-OD2 3.03Å; R406-D468 IonicContact NH2-OD2 2.91Å; R406-D468 PolarHBondContact NH2-OD2 2.77Å
407	N	88.9	Confident	81.8	Confident	74 Å²	74	56.6 Å²	56.6	40%	0.396	31%	0.305	S	S	.	.	S	Bend	trans	67.7	32.1	-179.2	-161.8	35.1	0	0	0	113.5	G436 P464	N407-G436 PolarHBondContact N-O 3.08Å; N407-P464 PolarHBondContact ND2-O 3.24Å
408	L	86.1	Confident	83.9	Confident	9 Å²	9	56.8 Å²	56.8	5%	0.047	29%	0.287	C	S	.	.			trans	-70.2	151.3	169.2	-75.7	139.2	0	0	0	110.7	I405 R406 Y412 L417 G436 I465	I405-L408 HydrophobicContact CB-CD1 3.79Å; I405-L408 HydrophobicContact CG2-CD1 3.54Å; I405-L408 HydrophobicContact CG2-CD2 4.17Å; I405-L408 HydrophobicContact CG2-CG 3.75Å; I405-L408 WeakPolarHBondContact O-CD1 3.16Å; R406-L408 VanDerWaalsContact C-N 3.34Å; L408-Y412 HydrophobicContact CD2-CD1 3.66Å; L408-Y412 HydrophobicContact CD2-CE1 4.12Å; L408-Y412 HydrophobicContact CD2-CG 4.03Å; L408-L417 HydrophobicContact CD1-CD1 3.93Å; L408-L417 HydrophobicContact CD1-CD2 4.18Å; L408-L417 HydrophobicContact CD2-CD1 4.35Å; L408-L417 HydrophobicContact CD2-CD2 3.57Å; L408-L417 HydrophobicContact CD2-CG 4.08Å; L408-G436 PolarHBondContact N-O 3.38Å; L408-G436 WeakPolarHBondContact O-CA 3.49Å; L408-I465 HydrophobicContact CD2-CG2 4.24Å; L408-I465 HydrophobicContact CG-CG2 3.93Å
409	P	82.9	Confident	85.6	Confident	4 Å²	4	57.4 Å²	57.4	3%	0.026	28%	0.283	C	S	.	.			trans	-56.2	143.8	167.4	-22.9	33.9	0	0	0	111.4	D411 Y412 V460 E461	P409-D411 WeakPolarHBondContact CB-OD1 3.45Å; P409-D411 PolarHBondContact O-N 2.66Å; P409-Y412 HydrophobicContact CB-CD2 4.27Å; P409-Y412 HydrophobicContact CG-CD2 3.94Å; P409-Y412 VanDerWaalsContact O-CB 3.26Å; P409-Y412 WeakPolarHBondContact O-CB 3.33Å; P409-Y412 PolarHBondContact O-N 3.07Å; P409-Y412 VanDerWaalsContact O-N 3.1Å; P409-V460 HydrophobicContact CG-CG1 4.07Å; P409-E461 HydrophobicContact CG-CB 3.99Å; P409-E461 HydrophobicContact CG-CG 3.98Å
410	P	81.5	Confident	86.8	Confident	93 Å²	93	62.8 Å²	62.8	60%	0.604	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21	-178.8	28.2	-34.8	0	0	0	113.4
411	D	84.6	Confident	87.7	Confident	114 Å²	114	61.8 Å²	61.8	61%	0.61	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-11.7	175	55.8	-60.8	0	0	0	113.2	P409 T413	P409-D411 WeakPolarHBondContact CB-OD1 3.45Å; P409-D411 PolarHBondContact O-N 2.66Å; D411-T413 PolarHBondContact O-N 2.95Å
412	Y	86.1	Confident	87.9	Confident	45 Å²	45	65.3 Å²	65.3	18%	0.176	30%	0.303	C	S	.	.			trans	-70.9	125	-179.1	-131.1	-99.2	0	0	0	110.5	L408 P409 T416 L417 I432 V460	L408-Y412 HydrophobicContact CD2-CD1 3.66Å; L408-Y412 HydrophobicContact CD2-CE1 4.12Å; L408-Y412 HydrophobicContact CD2-CG 4.03Å; P409-Y412 HydrophobicContact CB-CD2 4.27Å; P409-Y412 HydrophobicContact CG-CD2 3.94Å; P409-Y412 VanDerWaalsContact O-CB 3.26Å; P409-Y412 WeakPolarHBondContact O-CB 3.33Å; P409-Y412 PolarHBondContact O-N 3.07Å; P409-Y412 VanDerWaalsContact O-N 3.1Å; Y412-T416 HydrophobicContact CD1-CG2 4.14Å; Y412-T416 HydrophobicContact CE1-CG2 3.52Å; Y412-T416 HydrophobicContact CE2-CG2 3.99Å; Y412-T416 VanDerWaalsContact CZ-CG2 3.45Å; Y412-L417 HydrophobicContact CD1-CD2 4.33Å; Y412-L417 HydrophobicContact CD1-CG 3.92Å; Y412-L417 HydrophobicContact CE1-CD2 4.27Å; Y412-L417 HydrophobicContact CE1-CG 4.18Å; Y412-I432 WeakPolarHBondContact O-CD1 3.35Å; Y412-V460 HydrophobicContact CD2-CG1 4.15Å; Y412-V460 HydrophobicContact CE2-CG1 3.46Å; Y412-V460 VanDerWaalsContact CE2-CG1 3.46Å
413	T	89.5	Confident	87.9	Confident	50 Å²	50	69.1 Å²	69.1	31%	0.307	33%	0.331	S	S	.	.			trans	-96.1	160.8	179.8	70	0	0	0	0	111.7	D411 Q415 T416 L417	D411-T413 PolarHBondContact O-N 2.95Å; T413-Q415 PolarHBondContact O-N 2.82Å; T413-T416 PolarHBondContact O-N 2.81Å; T413-T416 PolarHBondContact OG1-N 2.95Å; T413-T416 PolarHBondContact OG1-OG1 2.81Å; T413-L417 PolarHBondContact O-N 2.86Å; T413-L417 VanDerWaalsContact O-N 3.08Å
414	W	89.8	Confident	87.8	Confident	109 Å²	109	71.4 Å²	71.4	41%	0.413	34%	0.341	S	S	.	.	H	α-helix	trans	-61.1	-26.2	175.2	62.4	-94.7	0	0	0	111.9	R418 I432	W414-R418 WeakPolarHBondContact O-CB 3.36Å; W414-R418 PolarHBondContact O-N 3.27Å; W414-I432 HydrophobicContact CB-CD1 4.3Å; W414-I432 HydrophobicContact CB-CG1 4.14Å; W414-I432 VanDerWaalsContact N-CD1 3.26Å
415	Q	91	Very high	87.6	Confident	100 Å²	100	70 Å²	70	47%	0.467	34%	0.337	S	S	.	.	H	α-helix	trans	-67.3	-51	175.8	-65.1	158.9	-11.1	0	0	110.1	T413 L417 R418 D419	T413-Q415 PolarHBondContact O-N 2.82Å; Q415-L417 VanDerWaalsContact C-N 3.32Å; Q415-L417 PolarHBondContact O-N 2.91Å; Q415-R418 WeakPolarHBondContact O-CB 3.2Å; Q415-R418 PolarHBondContact O-N 2.92Å; Q415-R418 VanDerWaalsContact O-N 3.13Å; Q415-D419 PolarHBondContact O-N 3.01Å
416	T	88.9	Confident	87.6	Confident	57 Å²	57	74.5 Å²	74.5	35%	0.35	36%	0.361	S	S	.	.	H	α-helix	trans	-60.8	-41.2	177.9	-41.4	0	0	0	0	111.8	Y412 T413 D419 R420	Y412-T416 HydrophobicContact CD1-CG2 4.14Å; Y412-T416 HydrophobicContact CE1-CG2 3.52Å; Y412-T416 HydrophobicContact CE2-CG2 3.99Å; Y412-T416 VanDerWaalsContact CZ-CG2 3.45Å; T413-T416 PolarHBondContact O-N 2.81Å; T413-T416 PolarHBondContact OG1-N 2.95Å; T413-T416 PolarHBondContact OG1-OG1 2.81Å; T416-D419 PolarHBondContact O-N 2.84Å; T416-R420 WeakPolarHBondContact O-CB 3.29Å; T416-R420 PolarHBondContact O-N 3.07Å
417	L	88.9	Confident	87.6	Confident	8 Å²	8	70 Å²	70	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-57.8	-51.2	172.4	-90	172.3	0	0	0	111.7	I405 L408 Y412 T413 Q415 D419 R420 L421 I432 I440	I405-L417 HydrophobicContact CD1-CD2 3.73Å; L408-L417 HydrophobicContact CD1-CD1 3.93Å; L408-L417 HydrophobicContact CD1-CD2 4.18Å; L408-L417 HydrophobicContact CD2-CD1 4.35Å; L408-L417 HydrophobicContact CD2-CD2 3.57Å; L408-L417 HydrophobicContact CD2-CG 4.08Å; Y412-L417 HydrophobicContact CD1-CD2 4.33Å; Y412-L417 HydrophobicContact CD1-CG 3.92Å; Y412-L417 HydrophobicContact CE1-CD2 4.27Å; Y412-L417 HydrophobicContact CE1-CG 4.18Å; T413-L417 PolarHBondContact O-N 2.86Å; T413-L417 VanDerWaalsContact O-N 3.08Å; Q415-L417 VanDerWaalsContact C-N 3.32Å; Q415-L417 PolarHBondContact O-N 2.91Å; L417-D419 PolarHBondContact O-N 2.94Å; L417-R420 PolarHBondContact O-N 2.88Å; L417-L421 HydrophobicContact CD2-CD1 4.3Å; L417-L421 VanDerWaalsContact O-CB 3.31Å; L417-L421 WeakPolarHBondContact O-CB 3.41Å; L417-L421 WeakPolarHBondContact O-CD1 3.42Å; L417-L421 VanDerWaalsContact O-CG 3.3Å; L417-L421 WeakPolarHBondContact O-CG 3.31Å; L417-L421 PolarHBondContact O-N 2.92Å; L417-L421 VanDerWaalsContact O-N 3.08Å; L417-I432 HydrophobicContact CD1-CG1 4.44Å; L417-I440 HydrophobicContact CB-CD1 4.04Å; L417-I440 HydrophobicContact CD1-CD1 4.27Å; L417-I440 HydrophobicContact CD2-CD1 4.07Å; L417-I440 HydrophobicContact CG-CD1 4.34Å
418	R	89.2	Confident	87.7	Confident	90 Å²	90	71.6 Å²	71.6	34%	0.34	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-47.5	179.9	178.5	-176.2	-87	-170.9	-7.2	111.2	W414 Q415 R420 L421 R422 I427 A430	W414-R418 WeakPolarHBondContact O-CB 3.36Å; W414-R418 PolarHBondContact O-N 3.27Å; Q415-R418 WeakPolarHBondContact O-CB 3.2Å; Q415-R418 PolarHBondContact O-N 2.92Å; Q415-R418 VanDerWaalsContact O-N 3.13Å; R418-R420 VanDerWaalsContact C-N 3.35Å; R418-R420 PolarHBondContact O-N 2.82Å; R418-L421 PolarHBondContact O-N 2.83Å; R418-R422 WeakPolarHBondContact O-CB 3.4Å; R418-R422 PolarHBondContact O-N 3.44Å; R418-I427 HydrophobicContact CB-CD1 4.34Å; R418-I427 HydrophobicContact CG-CD1 3.88Å; R418-I427 WeakPolarHBondContact O-CD1 3.42Å; R418-A430 HydrophobicContact CB-CB 4Å
419	D	89.6	Confident	87.8	Confident	110 Å²	110	76.2 Å²	76.2	59%	0.588	37%	0.371	S	S	*	.	H	α-helix	trans	-64.1	-40.3	-177.8	-71.9	-21.6	0	0	0	111.9	Q415 T416 L417 L421	Q415-D419 PolarHBondContact O-N 3.01Å; T416-D419 PolarHBondContact O-N 2.84Å; L417-D419 PolarHBondContact O-N 2.94Å; D419-L421 VanDerWaalsContact C-N 3.28Å; D419-L421 PolarHBondContact O-N 2.79Å
420	R	86.4	Confident	88.1	Confident	147 Å²	147	76.5 Å²	76.5	56%	0.555	37%	0.373	S	S	*	.	H	α-helix	trans	-67.4	-30.4	176.7	-171.5	57.8	173.9	-168.9	1.7	112.9	T416 L417 R418 S423	T416-R420 WeakPolarHBondContact O-CB 3.29Å; T416-R420 PolarHBondContact O-N 3.07Å; L417-R420 PolarHBondContact O-N 2.88Å; R418-R420 VanDerWaalsContact C-N 3.35Å; R418-R420 PolarHBondContact O-N 2.82Å; R420-S423 PolarHBondContact O-OG 3.04Å
421	L	87.3	Confident	88.5	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-91.9	-16.6	-174.2	-75.4	165.6	0	0	0	114.3	I403 I405 L417 R418 D419 S423 F424 I427 I440 F442 A451 L455	I403-L421 HydrophobicContact CD1-CD1 4.34Å; I403-L421 HydrophobicContact CD1-CD2 4.46Å; I405-L421 HydrophobicContact CD1-CD1 3.72Å; L417-L421 HydrophobicContact CD2-CD1 4.3Å; L417-L421 VanDerWaalsContact O-CB 3.31Å; L417-L421 WeakPolarHBondContact O-CB 3.41Å; L417-L421 WeakPolarHBondContact O-CD1 3.42Å; L417-L421 VanDerWaalsContact O-CG 3.3Å; L417-L421 WeakPolarHBondContact O-CG 3.31Å; L417-L421 PolarHBondContact O-N 2.92Å; L417-L421 VanDerWaalsContact O-N 3.08Å; R418-L421 PolarHBondContact O-N 2.83Å; D419-L421 VanDerWaalsContact C-N 3.28Å; D419-L421 PolarHBondContact O-N 2.79Å; L421-S423 PolarHBondContact O-N 3.26Å; L421-S423 VanDerWaalsContact O-N 3.16Å; L421-F424 HydrophobicContact CD2-CD2 4.03Å; L421-F424 HydrophobicContact CD2-CE2 4.48Å; L421-F424 PolarHBondContact O-N 3.34Å; L421-I427 HydrophobicContact CB-CD1 3.51Å; L421-I427 HydrophobicContact CB-CG1 4.48Å; L421-I440 HydrophobicContact CD1-CD1 3.01Å; L421-I440 HydrophobicContact CD1-CG1 4.34Å; L421-I440 HydrophobicContact CD1-CG2 4.35Å; L421-I440 HydrophobicContact CG-CD1 4.48Å; L421-F442 HydrophobicContact CB-CZ 4.21Å; L421-F442 HydrophobicContact CD2-CZ 4.22Å; L421-A451 HydrophobicContact CD2-CB 4.45Å; L421-L455 HydrophobicContact CD2-CD1 3.06Å; L421-L455 HydrophobicContact CD2-CD2 3.96Å; L421-L455 HydrophobicContact CD2-CG 4.07Å; L421-L455 HydrophobicContact CG-CD1 4.4Å
422	R	88	Confident	88.7	Confident	176 Å²	176	70.6 Å²	70.6	66%	0.664	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-23	177.6	-162.1	174.8	-175.4	-163	-0.9	112.9	R418 F424	R418-R422 WeakPolarHBondContact O-CB 3.4Å; R418-R422 PolarHBondContact O-N 3.44Å; R422-F424 VanDerWaalsContact C-N 3.25Å; R422-F424 PolarHBondContact O-N 3.25Å
423	S	88.4	Confident	88.8	Confident	95 Å²	95	72.9 Å²	72.9	66%	0.664	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.8	173.9	61.8	0	0	0	0	113.6	R420 L421	R420-S423 PolarHBondContact O-OG 3.04Å; L421-S423 PolarHBondContact O-N 3.26Å; L421-S423 VanDerWaalsContact O-N 3.16Å
424	F	85.9	Confident	88.5	Confident	47 Å²	47	76.6 Å²	76.6	21%	0.206	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-27.5	-179.7	-65.5	-80.4	0	0	0	112.8	L421 R422 A451 T454 L455	L421-F424 HydrophobicContact CD2-CD2 4.03Å; L421-F424 HydrophobicContact CD2-CE2 4.48Å; L421-F424 PolarHBondContact O-N 3.34Å; R422-F424 VanDerWaalsContact C-N 3.25Å; R422-F424 PolarHBondContact O-N 3.25Å; F424-A451 HydrophobicContact CB-CB 3.99Å; F424-A451 HydrophobicContact CG-CB 4.17Å; F424-T454 HydrophobicContact CE1-CG2 3.69Å; F424-T454 HydrophobicContact CZ-CG2 3.9Å; F424-L455 HydrophobicContact CE2-CD2 3.95Å; F424-L455 HydrophobicContact CE2-CG 4.3Å; F424-L455 HydrophobicContact CZ-CD2 4.37Å
425	G	87.8	Confident	88.2	Confident	12 Å²	12	76.9 Å²	76.9	12%	0.124	39%	0.387	C	S	.	.	S	Bend	trans	170.5	179.3	177.8	0	0	0	0	0	113.6
426	D	89.9	Confident	87.9	Confident	97 Å²	97	72.8 Å²	72.8	52%	0.519	37%	0.372	S	S	.	.			trans	-74.7	125.8	178.8	-75.6	-30.4	0	0	0	111.5	K443	D426-K443 HydrophobicContact CB-CB 4.08Å; D426-K443 HydrophobicContact CB-CD 4.21Å; D426-K443 PolarHBondContact O-N 3.2Å
427	I	89.8	Confident	87.9	Confident	31 Å²	31	71.9 Å²	71.9	16%	0.159	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.1	-177.7	-58.9	166.3	0	0	0	109.5	R418 L421 F429 A430 I440 F442	R418-I427 HydrophobicContact CB-CD1 4.34Å; R418-I427 HydrophobicContact CG-CD1 3.88Å; R418-I427 WeakPolarHBondContact O-CD1 3.42Å; L421-I427 HydrophobicContact CB-CD1 3.51Å; L421-I427 HydrophobicContact CB-CG1 4.48Å; I427-F429 WeakPolarHBondContact CG2-O 3.41Å; I427-A430 HydrophobicContact CG2-CB 4.19Å; I427-I440 HydrophobicContact CG2-CG2 3.81Å; I427-F442 HydrophobicContact CG1-CD1 4.17Å; I427-F442 HydrophobicContact CG1-CE1 3.87Å; I427-F442 HydrophobicContact CG1-CZ 4.42Å
428	E	89.5	Confident	88	Confident	107 Å²	107	71.5 Å²	71.5	50%	0.5	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-42	176.4	-170	178.7	179.3	0	0	110.8	R441	E428-R441 HydrophobicContact CB-CB 4.47Å; E428-R441 HydrophobicContact CB-CG 4.3Å; E428-R441 VanDerWaalsContact CD-NE 3.31Å; E428-R441 PolarHBondContact N-O 3.41Å; E428-R441 IonicContact OE1-CZ 3.83Å; E428-R441 IonicContact OE1-NE 3.96Å; E428-R441 IonicContact OE1-NH2 3.93Å; E428-R441 WeakPolarHBondContact OE2-CD 3.33Å; E428-R441 IonicContact OE2-CZ 3.93Å; E428-R441 IonicContact OE2-NE 3.86Å; E428-R441 PolarHBondContact OE2-NE 3.04Å; E428-R441 IonicContact OE2-NH2 3.58Å
429	F	89	Confident	88.1	Confident	107 Å²	107	69.5 Å²	69.5	47%	0.469	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	140.1	-179.3	178.8	-93.5	0	0	0	111	I427 I440 R441	I427-F429 WeakPolarHBondContact CG2-O 3.41Å; F429-I440 CarbonylContact O-C 3.59Å; F429-I440 WeakPolarHBondContact O-CA 3.42Å; F429-R441 HydrophobicContact CB-CB 3.87Å; F429-R441 PolarHBondContact N-O 3.49Å; F429-R441 PolarHBondContact O-N 2.91Å
430	A	90	Very high	88.1	Confident	9 Å²	9	64.3 Å²	64.3	7%	0.074	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	124.9	171.4	0	0	0	0	0	108.4	R418 I427 I440	R418-A430 HydrophobicContact CB-CB 4Å; I427-A430 HydrophobicContact CG2-CB 4.19Å; A430-I440 HydrophobicContact CB-CG1 4.37Å
431	G	89.6	Confident	88.3	Confident	12 Å²	12	59.9 Å²	59.9	12%	0.124	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	154.3	-179.9	0	0	0	0	0	111.7	G438 K439	G431-G438 CarbonylContact O-C 3.51Å; G431-G438 WeakPolarHBondContact O-CA 3.44Å; G431-K439 PolarHBondContact N-O 3Å; G431-K439 PolarHBondContact O-N 3.34Å; G431-K439 VanDerWaalsContact O-O 3.1Å
432	I	88.9	Confident	88.5	Confident	72 Å²	72	59.8 Å²	59.8	37%	0.369	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	120.2	173.5	-67.1	168.4	0	0	0	107.4	Y412 W414 L417 Q434	Y412-I432 WeakPolarHBondContact O-CD1 3.35Å; W414-I432 HydrophobicContact CB-CD1 4.3Å; W414-I432 HydrophobicContact CB-CG1 4.14Å; W414-I432 VanDerWaalsContact N-CD1 3.26Å; L417-I432 HydrophobicContact CD1-CG1 4.44Å; I432-Q434 WeakPolarHBondContact CG2-O 3.33Å
433	V	86.7	Confident	88.5	Confident	93 Å²	93	58.2 Å²	58.2	56%	0.564	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	-42	-179.9	-176.3	0	0	0	0	109.8	V437 K439	V433-V437 PolarHBondContact N-O 3.29Å; V433-K439 HydrophobicContact CG2-CB 3.62Å
434	Q	84.1	Confident	88.5	Confident	127 Å²	127	55.4 Å²	55.4	59%	0.593	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.9	178.4	-70.3	-179	24.6	0	0	108.9	I432 G436 V437	I432-Q434 WeakPolarHBondContact CG2-O 3.33Å; Q434-G436 PolarHBondContact O-N 3.1Å; Q434-V437 HydrophobicContact CB-CB 4.4Å; Q434-V437 PolarHBondContact N-O 3.36Å; Q434-V437 PolarHBondContact O-N 3.22Å; Q434-V437 VanDerWaalsContact O-O 3.07Å
435	P	83.5	Confident	88.6	Confident	115 Å²	115	54.7 Å²	54.7	75%	0.747	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	119.3	174.3	22.5	-33.2	0	0	0	110.1
436	G	84.4	Confident	88.7	Confident	14 Å²	14	63.3 Å²	63.3	14%	0.144	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	1.7	-175.9	0	0	0	0	0	116.4	R406 N407 L408 Q434	R406-G436 CarbonylContact C-O 3.57Å; N407-G436 PolarHBondContact N-O 3.08Å; L408-G436 PolarHBondContact N-O 3.38Å; L408-G436 WeakPolarHBondContact O-CA 3.49Å; Q434-G436 PolarHBondContact O-N 3.1Å
437	V	89.3	Confident	88.7	Confident	39 Å²	39	59.9 Å²	59.9	24%	0.236	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	115.3	175.3	-174.4	0	0	0	0	111.6	I404 I405 V433 Q434	I404-V437 HydrophobicContact CG2-CG1 3.74Å; I405-V437 CarbonylContact O-C 3.57Å; I405-V437 VanDerWaalsContact O-CA 3.29Å; I405-V437 WeakPolarHBondContact O-CA 3.18Å; V433-V437 PolarHBondContact N-O 3.29Å; Q434-V437 HydrophobicContact CB-CB 4.4Å; Q434-V437 PolarHBondContact N-O 3.36Å; Q434-V437 PolarHBondContact O-N 3.22Å; Q434-V437 VanDerWaalsContact O-O 3.07Å
438	G	90	Very high	88.7	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.4	176.5	0	0	0	0	0	112.5	I404 I405 G431	I404-G438 WeakPolarHBondContact CA-O 2.98Å; I405-G438 PolarHBondContact N-O 3.22Å; I405-G438 PolarHBondContact O-N 2.99Å; G431-G438 CarbonylContact O-C 3.51Å; G431-G438 WeakPolarHBondContact O-CA 3.44Å
439	K	91.2	Very high	88.6	Confident	48 Å²	48	57.8 Å²	57.8	21%	0.209	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	127.9	171.1	-177.6	178.4	179.4	-176.6	0	109.1	F402 G431 V433 D473	F402-K439 HydrophobicContact CD1-CD 4.44Å; F402-K439 HydrophobicContact CD1-CG 4.26Å; G431-K439 PolarHBondContact N-O 3Å; G431-K439 PolarHBondContact O-N 3.34Å; G431-K439 VanDerWaalsContact O-O 3.1Å; V433-K439 HydrophobicContact CG2-CB 3.62Å; K439-D473 PolarHBondContact NZ-OXT 3.13Å
440	I	90.6	Very high	88.6	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137	-173.6	-54.3	177.4	0	0	0	109.5	F402 I403 I405 L417 L421 I427 F429 A430 F442	F402-I440 CarbonylContact C-O 3.53Å; F402-I440 VanDerWaalsContact CA-O 3.31Å; F402-I440 WeakPolarHBondContact CA-O 3.26Å; I403-I440 HydrophobicContact CD1-CB 4.33Å; I403-I440 HydrophobicContact CG1-CB 3.78Å; I403-I440 HydrophobicContact CG1-CG2 4.39Å; I403-I440 PolarHBondContact N-O 3.08Å; I403-I440 PolarHBondContact O-N 2.9Å; I405-I440 HydrophobicContact CD1-CD1 3.8Å; L417-I440 HydrophobicContact CB-CD1 4.04Å; L417-I440 HydrophobicContact CD1-CD1 4.27Å; L417-I440 HydrophobicContact CD2-CD1 4.07Å; L417-I440 HydrophobicContact CG-CD1 4.34Å; L421-I440 HydrophobicContact CD1-CD1 3.01Å; L421-I440 HydrophobicContact CD1-CG1 4.34Å; L421-I440 HydrophobicContact CD1-CG2 4.35Å; L421-I440 HydrophobicContact CG-CD1 4.48Å; I427-I440 HydrophobicContact CG2-CG2 3.81Å; F429-I440 CarbonylContact O-C 3.59Å; F429-I440 WeakPolarHBondContact O-CA 3.42Å; A430-I440 HydrophobicContact CB-CG1 4.37Å; I440-F442 HydrophobicContact CG2-CE2 4.24Å
441	R	89.9	Confident	88.6	Confident	54 Å²	54	59.5 Å²	59.5	20%	0.204	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.5	-180	-171.4	-177.1	170.1	137.8	1	109.3	R401 F402 E428 F429 D473	R401-R441 HydrophobicContact CB-CG 4.43Å; R401-R441 WeakPolarHBondContact O-CA 3.47Å; F402-R441 HydrophobicContact CD1-CB 3.71Å; F402-R441 HydrophobicContact CD1-CG 3.97Å; F402-R441 HydrophobicContact CE1-CB 3.63Å; F402-R441 HydrophobicContact CE1-CG 3.7Å; F402-R441 HydrophobicContact CE2-CG 4.37Å; F402-R441 HydrophobicContact CG-CG 4.45Å; F402-R441 HydrophobicContact CZ-CB 4.38Å; F402-R441 HydrophobicContact CZ-CG 3.94Å; E428-R441 HydrophobicContact CB-CB 4.47Å; E428-R441 HydrophobicContact CB-CG 4.3Å; E428-R441 VanDerWaalsContact CD-NE 3.31Å; E428-R441 PolarHBondContact N-O 3.41Å; E428-R441 IonicContact OE1-CZ 3.83Å; E428-R441 IonicContact OE1-NE 3.96Å; E428-R441 IonicContact OE1-NH2 3.93Å; E428-R441 WeakPolarHBondContact OE2-CD 3.33Å; E428-R441 IonicContact OE2-CZ 3.93Å; E428-R441 IonicContact OE2-NE 3.86Å; E428-R441 PolarHBondContact OE2-NE 3.04Å; E428-R441 IonicContact OE2-NH2 3.58Å; F429-R441 HydrophobicContact CB-CB 3.87Å; F429-R441 PolarHBondContact N-O 3.49Å; F429-R441 PolarHBondContact O-N 2.91Å; R441-D473 IonicContact CZ-OD1 3.25Å; R441-D473 IonicContact NH1-OD1 3.71Å; R441-D473 PolarHBondContact NH1-OD1 3.43Å; R441-D473 IonicContact NH2-OD1 3.68Å
442	F	91.2	Very high	88.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	149.9	172.3	-74.1	-89.6	0	0	0	111.3	R401 I403 L421 I427 I440 S444 D447 A448 A451	R401-F442 PolarHBondContact O-N 3.49Å; I403-F442 HydrophobicContact CD1-CE2 3.61Å; I403-F442 HydrophobicContact CD1-CZ 4.38Å; I403-F442 HydrophobicContact CG1-CD2 4.44Å; I403-F442 HydrophobicContact CG1-CE2 3.91Å; I403-F442 HydrophobicContact CG2-CE2 4.44Å; L421-F442 HydrophobicContact CB-CZ 4.21Å; L421-F442 HydrophobicContact CD2-CZ 4.22Å; I427-F442 HydrophobicContact CG1-CD1 4.17Å; I427-F442 HydrophobicContact CG1-CE1 3.87Å; I427-F442 HydrophobicContact CG1-CZ 4.42Å; I440-F442 HydrophobicContact CG2-CE2 4.24Å; F442-S444 WeakPolarHBondContact CB-O 3.3Å; F442-S444 PolarHBondContact O-N 2.86Å; F442-D447 HydrophobicContact CD1-CB 4.06Å; F442-D447 HydrophobicContact CG-CB 4.44Å; F442-A448 HydrophobicContact CB-CB 4.13Å; F442-A448 HydrophobicContact CD2-CB 3.76Å; F442-A448 HydrophobicContact CG-CB 4.23Å; F442-A451 HydrophobicContact CE1-CB 4.5Å; F442-A451 HydrophobicContact CE2-CB 3.82Å; F442-A451 HydrophobicContact CZ-CB 3.64Å
443	K	89.4	Confident	88.5	Confident	143 Å²	143	58.8 Å²	58.8	62%	0.622	30%	0.302	S	S	*	.	S	Bend	trans	-64.3	-33.9	172.6	-168.4	174.9	-178.9	-178.1	0	111.6	D426	D426-K443 HydrophobicContact CB-CB 4.08Å; D426-K443 HydrophobicContact CB-CD 4.21Å; D426-K443 PolarHBondContact O-N 3.2Å
444	S	88.3	Confident	88.5	Confident	36 Å²	36	58.1 Å²	58.1	25%	0.252	30%	0.298	S	S	.	.	S	Bend	trans	-114.4	129.5	-179.8	176.8	0	0	0	0	111.1	F442 R446 D447 A448	F442-S444 WeakPolarHBondContact CB-O 3.3Å; F442-S444 PolarHBondContact O-N 2.86Å; S444-R446 VanDerWaalsContact C-N 3.28Å; S444-R446 PolarHBondContact O-N 2.85Å; S444-R446 PolarHBondContact OG-N 2.9Å; S444-D447 VanDerWaalsContact CB-OD2 3.27Å; S444-D447 WeakPolarHBondContact CB-OD2 3.31Å; S444-D447 PolarHBondContact O-N 3.49Å; S444-A448 PolarHBondContact O-N 2.69Å
445	P	88.1	Confident	88.5	Confident	32 Å²	32	52.2 Å²	52.2	21%	0.208	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-30.1	176.3	26.9	-33.3	0	0	0	112.6	A399 R401 D447 A448 E449	A399-P445 HydrophobicContact CB-CB 3.64Å; A399-P445 HydrophobicContact CB-CG 4.29Å; R401-P445 HydrophobicContact CG-CB 4.15Å; P445-D447 PolarHBondContact O-N 3.4Å; P445-A448 WeakPolarHBondContact O-CB 3.27Å; P445-A448 PolarHBondContact O-N 3.22Å; P445-E449 PolarHBondContact O-N 3.31Å
446	R	88.4	Confident	88.7	Confident	193 Å²	193	51.4 Å²	51.4	73%	0.728	26%	0.26	S	S	*	.	H	α-helix	trans	-65.5	-28.8	175.2	-68.2	-174.4	179.2	-173.4	0	112.5	S444 R450	S444-R446 VanDerWaalsContact C-N 3.28Å; S444-R446 PolarHBondContact O-N 2.85Å; S444-R446 PolarHBondContact OG-N 2.9Å; R446-R450 PolarHBondContact O-N 2.78Å
447	D	90.7	Very high	88.6	Confident	26 Å²	26	53 Å²	53	14%	0.139	28%	0.277	C	S	.	.	H	α-helix	trans	-78.6	-37.8	177.6	-61	-11.1	0	0	0	110.1	F442 S444 P445 E449 R450 A451	F442-D447 HydrophobicContact CD1-CB 4.06Å; F442-D447 HydrophobicContact CG-CB 4.44Å; S444-D447 VanDerWaalsContact CB-OD2 3.27Å; S444-D447 WeakPolarHBondContact CB-OD2 3.31Å; S444-D447 PolarHBondContact O-N 3.49Å; P445-D447 PolarHBondContact O-N 3.4Å; D447-E449 PolarHBondContact O-N 3.44Å; D447-R450 PolarHBondContact O-N 2.92Å; D447-R450 IonicContact OD1-CZ 3.71Å; D447-R450 IonicContact OD1-NH2 2.69Å; D447-R450 PolarHBondContact OD1-NH2 3.11Å; D447-A451 WeakPolarHBondContact O-CB 3.1Å; D447-A451 PolarHBondContact O-N 3.4Å
448	A	89.4	Confident	88.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-45	172	0	0	0	0	0	112	I403 F442 S444 P445 A451 A452 L469	I403-A448 HydrophobicContact CG2-CB 4.03Å; F442-A448 HydrophobicContact CB-CB 4.13Å; F442-A448 HydrophobicContact CD2-CB 3.76Å; F442-A448 HydrophobicContact CG-CB 4.23Å; S444-A448 PolarHBondContact O-N 2.69Å; P445-A448 WeakPolarHBondContact O-CB 3.27Å; P445-A448 PolarHBondContact O-N 3.22Å; A448-A451 PolarHBondContact O-N 2.95Å; A448-A452 VanDerWaalsContact O-CB 3.31Å; A448-A452 WeakPolarHBondContact O-CB 3.4Å; A448-A452 PolarHBondContact O-N 3.16Å; A448-L469 HydrophobicContact CB-CD2 4.45Å
449	E	88.8	Confident	88	Confident	93 Å²	93	61 Å²	61	44%	0.435	31%	0.313	S	S	.	.	H	α-helix	trans	-64.4	-45.7	177.4	-73.2	172.9	-176.4	0	0	112.5	P445 D447 A451 A452 G453 L469	P445-E449 PolarHBondContact O-N 3.31Å; D447-E449 PolarHBondContact O-N 3.44Å; E449-A451 PolarHBondContact O-N 3.37Å; E449-A452 PolarHBondContact O-N 3.03Å; E449-G453 PolarHBondContact O-N 3.45Å; E449-L469 HydrophobicContact CG-CD1 4.32Å; E449-L469 HydrophobicContact CG-CD2 4.44Å
450	R	88.4	Confident	87.4	Confident	153 Å²	153	59.9 Å²	59.9	58%	0.577	31%	0.309	S	S	*	.	H	α-helix	trans	-61.8	-43.2	175.2	-89.7	-172.6	-67.9	177.7	-0.4	112.3	R446 D447 T454	R446-R450 PolarHBondContact O-N 2.78Å; D447-R450 PolarHBondContact O-N 2.92Å; D447-R450 IonicContact OD1-CZ 3.71Å; D447-R450 IonicContact OD1-NH2 2.69Å; D447-R450 PolarHBondContact OD1-NH2 3.11Å; R450-T454 WeakPolarHBondContact O-CB 3.21Å; R450-T454 PolarHBondContact O-N 3.41Å; R450-T454 PolarHBondContact O-OG1 2.88Å
451	A	89.4	Confident	86.8	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-50	176.9	0	0	0	0	0	109.9	L421 F424 F442 D447 A448 E449 G453 T454 L455	L421-A451 HydrophobicContact CD2-CB 4.45Å; F424-A451 HydrophobicContact CB-CB 3.99Å; F424-A451 HydrophobicContact CG-CB 4.17Å; F442-A451 HydrophobicContact CE1-CB 4.5Å; F442-A451 HydrophobicContact CE2-CB 3.82Å; F442-A451 HydrophobicContact CZ-CB 3.64Å; D447-A451 WeakPolarHBondContact O-CB 3.1Å; D447-A451 PolarHBondContact O-N 3.4Å; A448-A451 PolarHBondContact O-N 2.95Å; E449-A451 PolarHBondContact O-N 3.37Å; A451-G453 PolarHBondContact O-N 3.39Å; A451-T454 PolarHBondContact O-N 3.25Å; A451-L455 HydrophobicContact CB-CD1 3.89Å; A451-L455 WeakPolarHBondContact O-CB 3.2Å; A451-L455 WeakPolarHBondContact O-CD1 3.2Å; A451-L455 WeakPolarHBondContact O-CG 3.31Å; A451-L455 PolarHBondContact O-N 2.87Å
452	A	88.9	Confident	86.2	Confident	7 Å²	7	67.4 Å²	67.4	6%	0.058	36%	0.363	C	S	.	.	H	α-helix	trans	-58.2	-46.6	179.1	0	0	0	0	0	112.4	I403 A448 E449 T454 N456 V467 L469	I403-A452 HydrophobicContact CG2-CB 4.22Å; A448-A452 VanDerWaalsContact O-CB 3.31Å; A448-A452 WeakPolarHBondContact O-CB 3.4Å; A448-A452 PolarHBondContact O-N 3.16Å; E449-A452 PolarHBondContact O-N 3.03Å; A452-T454 PolarHBondContact O-N 3.49Å; A452-N456 WeakPolarHBondContact O-CB 3.41Å; A452-N456 PolarHBondContact O-N 3.47Å; A452-N456 VanDerWaalsContact O-N 3.16Å; A452-V467 HydrophobicContact CB-CG1 3.96Å; A452-L469 HydrophobicContact CB-CD1 4.44Å; A452-L469 HydrophobicContact CB-CD2 3.89Å; A452-L469 HydrophobicContact CB-CG 3.91Å
453	G	87.5	Confident	85.8	Confident	61 Å²	61	73 Å²	73	63%	0.629	38%	0.384	S	S	*	.	H	α-helix	trans	-64.9	-36.3	178.8	0	0	0	0	0	113.8	E449 A451	E449-G453 PolarHBondContact O-N 3.45Å; A451-G453 PolarHBondContact O-N 3.39Å
454	T	86.1	Confident	85.6	Confident	79 Å²	79	69.8 Å²	69.8	49%	0.485	38%	0.378	S	S	.	.	H	α-helix	trans	-84	-33.2	-176.8	-47.5	0	0	0	0	112.7	F424 R450 A451 A452	F424-T454 HydrophobicContact CE1-CG2 3.69Å; F424-T454 HydrophobicContact CZ-CG2 3.9Å; R450-T454 WeakPolarHBondContact O-CB 3.21Å; R450-T454 PolarHBondContact O-N 3.41Å; R450-T454 PolarHBondContact O-OG1 2.88Å; A451-T454 PolarHBondContact O-N 3.25Å; A452-T454 PolarHBondContact O-N 3.49Å
455	L	85.3	Confident	85.7	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-83.5	-24.5	-177	-65.5	158.7	0	0	0	112.8	I403 L421 F424 A451 G457 M458 V467	I403-L455 HydrophobicContact CD1-CD1 4.28Å; L421-L455 HydrophobicContact CD2-CD1 3.06Å; L421-L455 HydrophobicContact CD2-CD2 3.96Å; L421-L455 HydrophobicContact CD2-CG 4.07Å; L421-L455 HydrophobicContact CG-CD1 4.4Å; F424-L455 HydrophobicContact CE2-CD2 3.95Å; F424-L455 HydrophobicContact CE2-CG 4.3Å; F424-L455 HydrophobicContact CZ-CD2 4.37Å; A451-L455 HydrophobicContact CB-CD1 3.89Å; A451-L455 WeakPolarHBondContact O-CB 3.2Å; A451-L455 WeakPolarHBondContact O-CD1 3.2Å; A451-L455 WeakPolarHBondContact O-CG 3.31Å; A451-L455 PolarHBondContact O-N 2.87Å; L455-G457 PolarHBondContact O-N 3.19Å; L455-G457 VanDerWaalsContact O-N 3.11Å; L455-M458 HydrophobicContact CD2-CE 3.62Å; L455-M458 WeakPolarHBondContact O-CB 3.49Å; L455-M458 PolarHBondContact O-N 2.98Å; L455-V467 HydrophobicContact CB-CB 4.47Å; L455-V467 HydrophobicContact CB-CG2 3.55Å
456	N	87.3	Confident	85.7	Confident	97 Å²	97	68.8 Å²	68.8	52%	0.519	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	113.8	-178.4	-165.9	12.8	0	0	0	110	A452 V467	A452-N456 WeakPolarHBondContact O-CB 3.41Å; A452-N456 PolarHBondContact O-N 3.47Å; A452-N456 VanDerWaalsContact O-N 3.16Å; N456-V467 HydrophobicContact CB-CB 4.44Å
457	G	81.8	Confident	85.8	Confident	48 Å²	48	59.9 Å²	59.9	50%	0.495	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	1.3	-176.5	0	0	0	0	0	115.4	L455 I465	L455-G457 PolarHBondContact O-N 3.19Å; L455-G457 VanDerWaalsContact O-N 3.11Å; G457-I465 PolarHBondContact N-O 2.95Å
458	M	84.3	Confident	85.6	Confident	56 Å²	56	61.9 Å²	61.9	28%	0.276	35%	0.351	S	S	.	.			trans	-64	144.3	169.8	-81.2	-129	-76.2	0	0	110.7	L455 P464 I465	L455-M458 HydrophobicContact CD2-CE 3.62Å; L455-M458 WeakPolarHBondContact O-CB 3.49Å; L455-M458 PolarHBondContact O-N 2.98Å; M458-P464 WeakPolarHBondContact O-CA 3.07Å; M458-I465 HydrophobicContact CB-CD1 4.19Å; M458-I465 HydrophobicContact CB-CG1 4.22Å; M458-I465 WeakPolarHBondContact O-CG1 3.39Å; M458-I465 PolarHBondContact O-N 3.23Å
459	Q	82.7	Confident	85.5	Confident	152 Å²	152	65.7 Å²	65.7	71%	0.71	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	121.4	175.7	-66.7	-178	40	0	0	109.7	R463	Q459-R463 WeakPolarHBondContact CA-O 2.99Å
460	V	79.9	Confident	85	Confident	23 Å²	23	62.1 Å²	62.1	14%	0.139	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.8	171.7	178.3	0	0	0	0	106.8	P409 Y412 G462 R463 I465	P409-V460 HydrophobicContact CG-CG1 4.07Å; Y412-V460 HydrophobicContact CD2-CG1 4.15Å; Y412-V460 HydrophobicContact CE2-CG1 3.46Å; Y412-V460 VanDerWaalsContact CE2-CG1 3.46Å; V460-G462 PolarHBondContact O-N 3.42Å; V460-R463 PolarHBondContact N-O 3.22Å; V460-R463 PolarHBondContact O-N 2.97Å; V460-I465 HydrophobicContact CB-CD1 4.33Å; V460-I465 HydrophobicContact CG2-CD1 3.38Å; V460-I465 HydrophobicContact CG2-CG1 3.98Å
461	E	76.3	Confident	84.1	Confident	153 Å²	153	60.9 Å²	60.9	72%	0.715	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	38.2	-175.1	-59.5	-59.8	126.5	0	0	113.2	P409 R463	P409-E461 HydrophobicContact CG-CB 3.99Å; P409-E461 HydrophobicContact CG-CG 3.98Å; E461-R463 PolarHBondContact O-N 3.16Å
462	G	78.6	Confident	82.8	Confident	60 Å²	60	67 Å²	67	62%	0.619	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	6	-178.5	0	0	0	0	0	115.1	V460	V460-G462 PolarHBondContact O-N 3.42Å
463	R	81.4	Confident	80.8	Confident	117 Å²	117	74.4 Å²	74.4	44%	0.442	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127	175.3	-63.5	-176.1	-179.1	-174.3	1.3	110.4	Q459 V460 E461 I465	Q459-R463 WeakPolarHBondContact CA-O 2.99Å; V460-R463 PolarHBondContact N-O 3.22Å; V460-R463 PolarHBondContact O-N 2.97Å; E461-R463 PolarHBondContact O-N 3.16Å; R463-I465 PolarHBondContact O-N 2.99Å
464	P	86.9	Confident	80.5	Confident	75 Å²	75	75.1 Å²	75.1	49%	0.487	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	119.3	173.4	28.1	-32.1	0	0	0	109.6	N407 M458	N407-P464 PolarHBondContact ND2-O 3.24Å; M458-P464 WeakPolarHBondContact O-CA 3.07Å
465	I	90.1	Very high	80.2	Confident	11 Å²	11	74.8 Å²	74.8	6%	0.056	42%	0.419	C	S	.	.			trans	-81	137.9	173.5	22.2	172.6	0	0	0	109.7	I405 R406 L408 G457 M458 V460 R463	I405-I465 HydrophobicContact CG2-CB 4.08Å; I405-I465 HydrophobicContact CG2-CG2 3.67Å; R406-I465 WeakPolarHBondContact O-CG2 3.08Å; L408-I465 HydrophobicContact CD2-CG2 4.24Å; L408-I465 HydrophobicContact CG-CG2 3.93Å; G457-I465 PolarHBondContact N-O 2.95Å; M458-I465 HydrophobicContact CB-CD1 4.19Å; M458-I465 HydrophobicContact CB-CG1 4.22Å; M458-I465 WeakPolarHBondContact O-CG1 3.39Å; M458-I465 PolarHBondContact O-N 3.23Å; V460-I465 HydrophobicContact CB-CD1 4.33Å; V460-I465 HydrophobicContact CG2-CD1 3.38Å; V460-I465 HydrophobicContact CG2-CG1 3.98Å; R463-I465 PolarHBondContact O-N 2.99Å
466	A	87.7	Confident	79.9	Confident	36 Å²	36	78.8 Å²	78.8	30%	0.298	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.2	173.9	0	0	0	0	0	109	I405 R406	I405-A466 CarbonylContact C-O 3.57Å; I405-A466 WeakPolarHBondContact CA-O 3.22Å; R406-A466 HydrophobicContact CB-CB 4.43Å; R406-A466 PolarHBondContact N-O 2.88Å; R406-A466 PolarHBondContact O-N 2.79Å
467	V	89.8	Confident	79.5	Confident	7 Å²	7	77.7 Å²	77.7	4%	0.042	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	120.3	-178.9	-172	0	0	0	0	110.1	I403 I404 I405 A452 L455 N456	I403-V467 HydrophobicContact CB-CG1 3.98Å; I403-V467 HydrophobicContact CD1-CG1 4.15Å; I403-V467 HydrophobicContact CG2-CG1 4.47Å; I404-V467 WeakPolarHBondContact O-CA 3.45Å; I405-V467 HydrophobicContact CB-CG2 4.46Å; I405-V467 HydrophobicContact CG1-CG1 4.11Å; I405-V467 HydrophobicContact CG1-CG2 3.92Å; I405-V467 HydrophobicContact CG2-CG2 4.24Å; A452-V467 HydrophobicContact CB-CG1 3.96Å; L455-V467 HydrophobicContact CB-CB 4.47Å; L455-V467 HydrophobicContact CB-CG2 3.55Å; N456-V467 HydrophobicContact CB-CB 4.44Å
468	D	87.5	Confident	79.4	Confident	68 Å²	68	79.6 Å²	79.6	36%	0.364	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.7	177.8	-65.3	-34.8	0	0	0	110.3	I403 I404 R406	I403-D468 CarbonylContact C-O 3.59Å; I403-D468 WeakPolarHBondContact CA-O 3.41Å; I404-D468 PolarHBondContact N-O 2.91Å; I404-D468 PolarHBondContact O-N 2.73Å; R406-D468 IonicContact CZ-OD2 3.24Å; R406-D468 VanDerWaalsContact CZ-OD2 3.24Å; R406-D468 IonicContact NE-OD2 2.73Å; R406-D468 PolarHBondContact NE-OD2 3.03Å; R406-D468 IonicContact NH2-OD2 2.91Å; R406-D468 PolarHBondContact NH2-OD2 2.77Å
469	L	86.1	Confident	79	Confident	79 Å²	79	81.1 Å²	81.1	41%	0.414	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	122.2	167.8	-71.3	162.4	0	0	0	108.7	P400 I403 A448 E449 A452	P400-L469 HydrophobicContact CB-CB 4.4Å; P400-L469 HydrophobicContact CG-CB 3.85Å; P400-L469 HydrophobicContact CG-CD2 4.12Å; P400-L469 HydrophobicContact CG-CG 4.38Å; I403-L469 HydrophobicContact CG2-CD2 3.95Å; A448-L469 HydrophobicContact CB-CD2 4.45Å; E449-L469 HydrophobicContact CG-CD1 4.32Å; E449-L469 HydrophobicContact CG-CD2 4.44Å; A452-L469 HydrophobicContact CB-CD1 4.44Å; A452-L469 HydrophobicContact CB-CD2 3.89Å; A452-L469 HydrophobicContact CB-CG 3.91Å
470	A	79.8	Confident	78.8	Confident	18 Å²	18	76.1 Å²	76.1	15%	0.149	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128	179.4	0	0	0	0	0	110.4	P400 F402 I404	P400-A470 WeakPolarHBondContact CB-O 3.4Å; F402-A470 HydrophobicContact CB-CB 4.2Å; F402-A470 WeakPolarHBondContact CB-O 3.48Å; F402-A470 PolarHBondContact O-N 3.05Å; I404-A470 HydrophobicContact CD1-CB 3.58Å; I404-A470 HydrophobicContact CG1-CB 3.8Å
471	I	68.2	Low	78.7	Confident	127 Å²	127	80.2 Å²	80.2	65%	0.651	45%	0.446	S	S	*	.			trans	-96.9	99.7	167.2	-52.8	163.5	0	0	0	103.7	P400	P400-I471 HydrophobicContact CB-CG1 3.92Å; P400-I471 HydrophobicContact CG-CG1 4.28Å
472	N	63.2	Low	78.9	Confident	129 Å²	129	74.1 Å²	74.1	69%	0.69	42%	0.423	S	S	*	.			trans	173.2	129.7	159.9	-80.8	-25.8	0	0	0	110.4	F402	F402-N472 WeakPolarHBondContact CD2-O 3.4Å
473	D	47.3	Very low	78.9	Confident	162 Å²	162	75.4 Å²	75.4	87%	0.866	41%	0.405	S	S	*	.			trans	-61.6	0	167.8	-91.2	-71.4	0	0	0	111	K439 R441	K439-D473 PolarHBondContact NZ-OXT 3.13Å; R441-D473 IonicContact CZ-OD1 3.25Å; R441-D473 IonicContact NH1-OD1 3.71Å; R441-D473 PolarHBondContact NH1-OD1 3.43Å; R441-D473 IonicContact NH2-OD1 3.68Å

Retrieved 473 of 473 residues in 100.7 ms (Link to these results)

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