A0A096LQA2_POEFO Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A096LQA2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 554 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	34.6	Very low	33.5	Very low	216 Å²	216	163.8 Å²	163.8	100%	1.064	82%	0.817	S	S	*	*				0	59.6	0	-55	171.4	-161.2	0	0	106.5
2	E	33.8	Very low	33.6	Very low	175 Å²	175	168.3 Å²	168.3	82%	0.818	82%	0.817	S	S	*	*				74.3	122.3	63.7	-64.7	142.9	141.8	0	0	110
3	D	33.3	Very low	33.5	Very low	157 Å²	157	164.8 Å²	164.8	84%	0.84	81%	0.813	S	S	*	*			cis	-143.5	-180	6.2	-149.7	-11.2	0	0	0	113.7
4	V	36.8	Very low	33.3	Very low	122 Å²	122	160.8 Å²	160.8	74%	0.739	81%	0.809	S	S	*	*			trans	-108.7	147.5	-152.8	173	0	0	0	0	115.2
5	F	39.9	Very low	33.5	Very low	189 Å²	189	159.5 Å²	159.5	83%	0.829	81%	0.805	S	S	*	*			trans	-4.8	135	164.4	-81.1	-101.5	0	0	0	119.7
6	Q	34.4	Very low	34.2	Very low	198 Å²	198	161.2 Å²	161.2	93%	0.925	81%	0.809	S	S	*	*			trans	-149.3	161.1	142.8	-121.8	173.1	23.3	0	0	113.9
7	T	32	Very low	34.9	Very low	120 Å²	120	156.4 Å²	156.4	74%	0.736	80%	0.795	S	S	*	*			trans	-143.1	148.2	-165.9	-39.7	0	0	0	0	111.5
8	R	31.1	Very low	35.6	Very low	229 Å²	229	153 Å²	153	86%	0.864	78%	0.783	S	S	*	*			trans	102.8	112.9	158.6	-70.2	-173.7	155.5	165.9	-5.6	121
9	V	30.8	Very low	36.4	Very low	117 Å²	117	151.2 Å²	151.2	71%	0.709	78%	0.775	S	S	*	*				80.2	149.9	119.9	177.6	0	0	0	0	119.9
10	L	32	Very low	36.9	Very low	147 Å²	147	149.2 Å²	149.2	77%	0.77	76%	0.764	S	S	*	*			trans	86.8	137	-179.7	-53.9	-170	0	0	0	114.8
11	L	30.3	Very low	37.7	Very low	132 Å²	132	147.6 Å²	147.6	69%	0.691	76%	0.757	S	S	*	*			cis	-157.9	153.1	2.4	-112.5	163.2	0	0	0	112.7
12	R	34.1	Very low	38.5	Very low	217 Å²	217	143.8 Å²	143.8	82%	0.819	74%	0.736	S	S	*	*			trans	32.7	116.2	149.9	-78.9	-178.5	-177.1	169.9	-1	121.4
13	T	32.7	Very low	39.4	Very low	124 Å²	124	141.9 Å²	141.9	76%	0.761	73%	0.727	S	S	*	*				72.3	112.7	75.6	64.6	0	0	0	0	117.5
14	S	30.8	Very low	40.9	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	71%	0.714	S	S	*	*			trans	-152.6	164	152.9	-68.5	0	0	0	0	110.1
15	D	35.8	Very low	42.2	Very low	141 Å²	141	136.8 Å²	136.8	75%	0.754	70%	0.699	S	S	*	*			trans	58.2	89.4	156	-50	-24.8	0	0	0	119.1
16	Q	44.3	Very low	43.2	Very low	187 Å²	187	132.9 Å²	132.9	87%	0.874	69%	0.687	S	S	*	*			trans	-139.6	14.4	163.7	-136.6	176.5	5.7	0	0	113.2
17	S	46.6	Very low	44.6	Very low	80 Å²	80	132.3 Å²	132.3	56%	0.559	68%	0.676	S	S	*	*	S	Bend	trans	-98.5	-19.6	-173.6	54	0	0	0	0	115	D19	S17-D19 VanDerWaalsContact C-N 3.35Å; S17-D19 PolarHBondContact O-N 2.88Å
18	T	48	Very low	46	Very low	95 Å²	95	131.6 Å²	131.6	58%	0.583	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-7.9	-173	52	0	0	0	0	114.9
19	D	50.5	Low	47.3	Very low	119 Å²	119	126.2 Å²	126.2	64%	0.636	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-34.9	-176	-156.3	48	0	0	0	111.6	S17 Q23	S17-D19 VanDerWaalsContact C-N 3.35Å; S17-D19 PolarHBondContact O-N 2.88Å; D19-Q23 PolarHBondContact O-N 3.3Å
20	M	45.3	Very low	48.8	Very low	111 Å²	111	124.8 Å²	124.8	55%	0.547	64%	0.639	S	S	.	*	H	α-helix	trans	-62.7	-51.3	176.7	-82.2	-63.6	-49.2	0	0	112.3	Q22 Q23 E24	M20-Q22 PolarHBondContact O-N 3.44Å; M20-Q23 PolarHBondContact O-N 2.93Å; M20-E24 PolarHBondContact O-N 2.78Å
21	D	53.6	Low	50.2	Low	115 Å²	115	123.7 Å²	123.7	62%	0.615	63%	0.628	S	S	*	*	H	α-helix	trans	-61.5	-34.6	-175	-59.6	-8.4	0	0	0	112	A25	D21-A25 WeakPolarHBondContact O-CB 3.49Å; D21-A25 PolarHBondContact O-N 2.97Å
22	Q	51.4	Low	51.5	Low	136 Å²	136	123.7 Å²	123.7	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-71	-37.5	175.9	-64.5	-175.3	19.5	0	0	111.9	M20 L26	M20-Q22 PolarHBondContact O-N 3.44Å; Q22-L26 PolarHBondContact O-N 2.57Å; Q22-L26 VanDerWaalsContact O-N 3.15Å
23	Q	52.8	Low	52.6	Low	136 Å²	136	120 Å²	120	64%	0.636	62%	0.617	S	S	*	*	H	α-helix	trans	-72.8	-29	178	-169.2	167.8	87.5	0	0	112.5	D19 M20 R27	D19-Q23 PolarHBondContact O-N 3.3Å; M20-Q23 PolarHBondContact O-N 2.93Å; Q23-R27 WeakPolarHBondContact O-CB 2.99Å
24	E	66.2	Low	53.5	Low	120 Å²	120	120.3 Å²	120.3	56%	0.561	61%	0.61	S	S	*	*	H	α-helix	trans	-78	-40.1	172.9	-170.3	147.3	-134.6	0	0	112.1	M20 L26 R27 L28	M20-E24 PolarHBondContact O-N 2.78Å; E24-L26 PolarHBondContact O-N 3.28Å; E24-R27 WeakPolarHBondContact O-CB 3.38Å; E24-R27 PolarHBondContact O-N 3.06Å; E24-L28 PolarHBondContact O-N 2.91Å; E24-L28 VanDerWaalsContact O-N 3.14Å
25	A	62.4	Low	54.6	Low	51 Å²	51	121.7 Å²	121.7	42%	0.421	60%	0.604	S	S	.	*	H	α-helix	trans	-58.4	-45.3	174.2	0	0	0	0	0	112.8	D21 R27 L28 Q29	D21-A25 WeakPolarHBondContact O-CB 3.49Å; D21-A25 PolarHBondContact O-N 2.97Å; A25-R27 PolarHBondContact O-N 3.07Å; A25-L28 PolarHBondContact O-N 3.48Å; A25-Q29 PolarHBondContact O-N 3.02Å
26	L	62.3	Low	55.2	Low	108 Å²	108	122.6 Å²	122.6	57%	0.565	60%	0.604	S	S	*	*	H	α-helix	trans	-62	-29.1	176.6	-152.5	80.8	0	0	0	112.3	Q22 E24 I30	Q22-L26 PolarHBondContact O-N 2.57Å; Q22-L26 VanDerWaalsContact O-N 3.15Å; E24-L26 PolarHBondContact O-N 3.28Å; L26-I30 WeakPolarHBondContact O-CD1 3.46Å; L26-I30 WeakPolarHBondContact O-CG1 3.45Å; L26-I30 PolarHBondContact O-N 3.27Å
27	R	63.6	Low	55	Low	185 Å²	185	119.2 Å²	119.2	70%	0.698	59%	0.591	S	S	*	*	H	α-helix	trans	-82.7	-18.3	-178	-157.6	179.1	-167.9	-172.4	4.7	113.5	Q23 E24 A25	Q23-R27 WeakPolarHBondContact O-CB 2.99Å; E24-R27 WeakPolarHBondContact O-CB 3.38Å; E24-R27 PolarHBondContact O-N 3.06Å; A25-R27 PolarHBondContact O-N 3.07Å
28	L	62.2	Low	54.6	Low	105 Å²	105	119.1 Å²	119.1	55%	0.55	59%	0.59	S	S	.	*	H	α-helix	trans	-80.3	-44	170	-70.5	167.2	0	0	0	110.7	E24 A25 I30 K31 E32	E24-L28 PolarHBondContact O-N 2.91Å; E24-L28 VanDerWaalsContact O-N 3.14Å; A25-L28 PolarHBondContact O-N 3.48Å; L28-I30 VanDerWaalsContact C-N 3.33Å; L28-I30 PolarHBondContact O-N 2.74Å; L28-K31 WeakPolarHBondContact O-CB 3.42Å; L28-K31 PolarHBondContact O-N 3.25Å; L28-E32 PolarHBondContact O-N 3.23Å; L28-E32 VanDerWaalsContact O-N 3.11Å
29	Q	56.9	Low	54.3	Low	117 Å²	117	120 Å²	120	55%	0.547	60%	0.595	S	S	.	*	H	α-helix	trans	-58.2	-42.3	177.5	-69	-178.5	-37	0	0	112.6	A25 K31 E32 E33	A25-Q29 PolarHBondContact O-N 3.02Å; Q29-K31 PolarHBondContact O-N 3.35Å; Q29-E32 PolarHBondContact O-N 2.95Å; Q29-E33 PolarHBondContact O-N 2.88Å; Q29-E33 VanDerWaalsContact O-N 3.08Å
30	I	61.8	Low	53.9	Low	86 Å²	86	117.8 Å²	117.8	44%	0.441	59%	0.588	S	S	.	*	H	α-helix	trans	-61.3	-31.3	176.2	-68.2	165.9	0	0	0	112	L26 L28 E34	L26-I30 WeakPolarHBondContact O-CD1 3.46Å; L26-I30 WeakPolarHBondContact O-CG1 3.45Å; L26-I30 PolarHBondContact O-N 3.27Å; L28-I30 VanDerWaalsContact C-N 3.33Å; L28-I30 PolarHBondContact O-N 2.74Å; I30-E34 WeakPolarHBondContact O-CG 3.31Å; I30-E34 PolarHBondContact O-N 2.77Å; I30-E34 VanDerWaalsContact O-N 3.08Å
31	K	61.9	Low	53.7	Low	124 Å²	124	119.4 Å²	119.4	54%	0.539	59%	0.594	S	S	.	*	H	α-helix	trans	-75.4	-39.4	176.6	-76.4	-175.6	162.4	-157.6	0	112.9	L28 Q29 E33 E34 E35	L28-K31 WeakPolarHBondContact O-CB 3.42Å; L28-K31 PolarHBondContact O-N 3.25Å; Q29-K31 PolarHBondContact O-N 3.35Å; K31-E33 VanDerWaalsContact C-N 3.28Å; K31-E33 PolarHBondContact O-N 3.26Å; K31-E34 PolarHBondContact O-N 3.47Å; K31-E35 PolarHBondContact O-N 3.2Å
32	E	58.8	Low	53	Low	132 Å²	132	121 Å²	121	62%	0.617	60%	0.598	S	S	*	*	H	α-helix	trans	-62.9	-38.7	176.1	-66.7	176.5	145.9	0	0	110.4	L28 Q29 E35 E36	L28-E32 PolarHBondContact O-N 3.23Å; L28-E32 VanDerWaalsContact O-N 3.11Å; Q29-E32 PolarHBondContact O-N 2.95Å; E32-E35 PolarHBondContact O-N 2.79Å; E32-E36 PolarHBondContact O-N 3.45Å
33	E	56.1	Low	52.4	Low	140 Å²	140	117.4 Å²	117.4	65%	0.654	60%	0.598	S	S	*	*	H	α-helix	trans	-67.8	-36.7	172.1	-68.9	-173.5	157.7	0	0	113.5	Q29 K31 L37	Q29-E33 PolarHBondContact O-N 2.88Å; Q29-E33 VanDerWaalsContact O-N 3.08Å; K31-E33 VanDerWaalsContact C-N 3.28Å; K31-E33 PolarHBondContact O-N 3.26Å; E33-L37 PolarHBondContact O-N 3.2Å
34	E	52.9	Low	51.8	Low	131 Å²	131	119 Å²	119	61%	0.612	61%	0.605	S	S	*	*	H	α-helix	trans	-69.3	-32.9	175.2	-78.4	-178.1	157.3	0	0	112.8	I30 K31 C38	I30-E34 WeakPolarHBondContact O-CG 3.31Å; I30-E34 PolarHBondContact O-N 2.77Å; I30-E34 VanDerWaalsContact O-N 3.08Å; K31-E34 PolarHBondContact O-N 3.47Å; E34-C38 PolarHBondContact O-N 3.27Å
35	E	52.9	Low	50.4	Low	136 Å²	136	121.4 Å²	121.4	64%	0.636	62%	0.616	S	S	*	*	H	α-helix	trans	-75.5	-40.3	178.6	-73.6	-178.4	-170.7	0	0	112.7	K31 E32 L37 C38 V39	K31-E35 PolarHBondContact O-N 3.2Å; E32-E35 PolarHBondContact O-N 2.79Å; E35-L37 VanDerWaalsContact C-N 3.31Å; E35-L37 PolarHBondContact O-N 3.27Å; E35-C38 WeakPolarHBondContact O-CB 3.47Å; E35-C38 PolarHBondContact O-N 2.85Å; E35-C38 VanDerWaalsContact O-N 3.12Å; E35-V39 PolarHBondContact O-N 3.45Å
36	E	48.7	Very low	49.2	Very low	160 Å²	160	127 Å²	127	75%	0.748	64%	0.638	S	S	*	*	H	α-helix	trans	-65.1	-32.5	173.8	-71.6	-156.5	154.6	0	0	112.9	E32 C38 S40	E32-E36 PolarHBondContact O-N 3.45Å; E36-C38 VanDerWaalsContact C-N 3.27Å; E36-C38 PolarHBondContact O-N 2.51Å; E36-S40 PolarHBondContact O-N 2.64Å; E36-S40 PolarHBondContact O-OG 3.31Å
37	L	39.3	Very low	48	Very low	117 Å²	117	132.9 Å²	132.9	61%	0.613	65%	0.653	S	S	*	*	H	α-helix	trans	-67.6	-25	173.1	-97.9	162.3	0	0	0	113.4	E33 E35 S40	E33-L37 PolarHBondContact O-N 3.2Å; E35-L37 VanDerWaalsContact C-N 3.31Å; E35-L37 PolarHBondContact O-N 3.27Å; L37-S40 WeakPolarHBondContact CA-OG 3.21Å; L37-S40 PolarHBondContact O-OG 3.38Å
38	C	38.3	Very low	46.7	Very low	78 Å²	78	130.2 Å²	130.2	53%	0.527	66%	0.657	S	S	.	*	H	α-helix	trans	-80.5	-48.3	177.8	-152.4	0	0	0	0	111.2	E34 E35 E36 S40 Q41	E34-C38 PolarHBondContact O-N 3.27Å; E35-C38 WeakPolarHBondContact O-CB 3.47Å; E35-C38 PolarHBondContact O-N 2.85Å; E35-C38 VanDerWaalsContact O-N 3.12Å; E36-C38 VanDerWaalsContact C-N 3.27Å; E36-C38 PolarHBondContact O-N 2.51Å; C38-S40 PolarHBondContact O-N 2.51Å; C38-S40 VanDerWaalsContact O-N 3.15Å; C38-Q41 PolarHBondContact O-N 3.21Å
39	V	41.4	Very low	45.2	Very low	114 Å²	114	135 Å²	135	69%	0.691	67%	0.673	S	S	*	*	H	α-helix	trans	-59.2	-28.9	179	175	0	0	0	0	112.4	E35	E35-V39 PolarHBondContact O-N 3.45Å
40	S	42.3	Very low	44	Very low	72 Å²	72	138.5 Å²	138.5	50%	0.503	69%	0.69	S	S	.	*	H	α-helix	trans	-78.8	-19.6	177.8	45.9	0	0	0	0	114.8	E36 L37 C38	E36-S40 PolarHBondContact O-N 2.64Å; E36-S40 PolarHBondContact O-OG 3.31Å; L37-S40 WeakPolarHBondContact CA-OG 3.21Å; L37-S40 PolarHBondContact O-OG 3.38Å; C38-S40 PolarHBondContact O-N 2.51Å; C38-S40 VanDerWaalsContact O-N 3.15Å
41	Q	41.3	Very low	42.5	Very low	144 Å²	144	143.1 Å²	143.1	67%	0.673	71%	0.709	S	S	*	*	H	α-helix	trans	-88.4	-25.3	177.3	-74.8	-162.3	-24.7	0	0	114.6	C38 G43	C38-Q41 PolarHBondContact O-N 3.21Å; Q41-G43 VanDerWaalsContact C-N 3.32Å
42	E	39.2	Very low	40.9	Very low	148 Å²	148	144.4 Å²	144.4	69%	0.692	73%	0.728	S	S	*	*	H	α-helix	trans	-74.9	-24.2	177	-61.2	-163.3	132.9	0	0	112.6	E44	E42-E44 VanDerWaalsContact C-N 3.34Å; E42-E44 PolarHBondContact O-N 3.47Å
43	G	39.5	Very low	39.3	Very low	61 Å²	61	146.5 Å²	146.5	63%	0.629	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-22.1	-178.6	0	0	0	0	0	116.1	Q41	Q41-G43 VanDerWaalsContact C-N 3.32Å
44	E	39.5	Very low	37.8	Very low	170 Å²	170	143 Å²	143	79%	0.794	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-14.6	-174.9	-66.6	-157.5	120.7	0	0	114.8	E42	E42-E44 VanDerWaalsContact C-N 3.34Å; E42-E44 PolarHBondContact O-N 3.47Å
45	Q	37.4	Very low	36.6	Very low	170 Å²	170	148 Å²	148	79%	0.794	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-86.5	-12.2	-176.5	-69.6	-171.8	73.5	0	0	114.5	R47	Q45-R47 VanDerWaalsContact C-N 3.33Å; Q45-R47 PolarHBondContact O-N 3.47Å
46	L	37.8	Very low	35.4	Very low	169 Å²	169	151 Å²	151	89%	0.885	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-88.5	18.6	-178	-95.4	166.7	0	0	0	115
47	R	36	Very low	34.7	Very low	231 Å²	231	149.3 Å²	149.3	87%	0.872	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-126.4	25.2	-174.4	-144.4	-179.7	-177.6	172.2	2.5	117	Q45	Q45-R47 VanDerWaalsContact C-N 3.33Å; Q45-R47 PolarHBondContact O-N 3.47Å
48	V	36	Very low	34.1	Very low	129 Å²	129	148.7 Å²	148.7	78%	0.782	78%	0.777	S	S	*	*	S	Bend	trans	-140.7	88.3	167.7	-172	0	0	0	0	111.5
49	K	32.1	Very low	33.5	Very low	205 Å²	205	151.9 Å²	151.9	89%	0.891	80%	0.795	S	S	*	*			trans	170.5	74.6	151.6	-95.2	157.5	-174.7	174.8	0	111.9
50	E	30.3	Very low	32.8	Very low	191 Å²	191	151 Å²	151	89%	0.893	80%	0.799	S	S	*	*			trans	-129.6	170.7	151.3	-71.7	-163.9	127.8	0	0	108.1
51	E	30.2	Very low	32	Very low	183 Å²	183	152.2 Å²	152.2	86%	0.855	81%	0.814	S	S	*	*			trans	64.1	93.6	-175.3	-55.1	-169.2	163.7	0	0	115.9
52	T	28.2	Very low	31.3	Very low	151 Å²	151	151 Å²	151	93%	0.926	82%	0.821	S	S	*	*				-177.3	104.9	103.7	25.7	0	0	0	0	110.4
53	D	25.5	Very low	30.9	Very low	177 Å²	177	151.5 Å²	151.5	95%	0.947	83%	0.827	S	S	*	*			trans	-123.8	133.8	170.1	-157.1	-14.7	0	0	0	109.1
54	G	25.6	Very low	30.3	Very low	65 Å²	65	154.3 Å²	154.3	67%	0.67	83%	0.832	S	S	*	*			trans	-165.3	69.2	-143.1	0	0	0	0	0	118.6
55	R	26.6	Very low	29.7	Very low	238 Å²	238	154.1 Å²	154.1	90%	0.898	84%	0.836	S	S	*	*			trans	70.2	105	147.4	178.8	178.7	-88.2	-118.2	-1.7	118.3
56	F	28.2	Very low	29.2	Very low	197 Å²	197	152.5 Å²	152.5	86%	0.864	84%	0.838	S	S	*	*			trans	-58.2	164.2	152	-70.8	-92.6	0	0	0	112.5
57	P	34.6	Very low	28.8	Very low	126 Å²	126	153.5 Å²	153.5	82%	0.818	84%	0.835	S	S	*	*				-133.4	152.4	107.7	37.5	-30.4	0	0	0	114.5
58	S	25.3	Very low	28.3	Very low	103 Å²	103	151.5 Å²	151.5	72%	0.72	84%	0.836	S	S	*	*			trans	-92.7	150.6	170.8	175.6	0	0	0	0	111.1
59	T	27.1	Very low	27.9	Very low	145 Å²	145	154 Å²	154	89%	0.89	84%	0.839	S	S	*	*			trans	-133.7	137.3	155.1	51	0	0	0	0	109.1
60	A	25.7	Very low	28.3	Very low	95 Å²	95	149.7 Å²	149.7	79%	0.785	83%	0.832	S	S	*	*			trans	-115.5	149.4	-177.2	0	0	0	0	0	111.1
61	A	25.4	Very low	28	Very low	99 Å²	99	146.7 Å²	146.7	82%	0.818	83%	0.829	S	S	*	*			trans	-144.7	130.2	165.2	0	0	0	0	0	109
62	S	27	Very low	27.8	Very low	117 Å²	117	146.6 Å²	146.6	82%	0.818	83%	0.829	S	S	*	*			trans	-116.7	126.6	-178	-53.1	0	0	0	0	110
63	I	30	Very low	27.8	Very low	159 Å²	159	147.3 Å²	147.3	82%	0.815	82%	0.822	S	S	*	*			trans	-132.9	110.5	173.7	-62.8	-175.5	0	0	0	110.3
64	T	27.7	Very low	27.7	Very low	121 Å²	121	148.1 Å²	148.1	74%	0.742	82%	0.819	S	S	*	*			trans	15.2	134.4	157.6	59.3	0	0	0	0	122.4
65	N	26.4	Very low	27.8	Very low	165 Å²	165	150.2 Å²	150.2	88%	0.882	82%	0.824	S	S	*	*			trans	-58.5	145.3	152.8	-68.3	-27.5	0	0	0	112.3
66	V	27.3	Very low	27.8	Very low	137 Å²	137	144.4 Å²	144.4	83%	0.83	82%	0.817	S	S	*	*			trans	-129.3	152	149.2	179.9	0	0	0	0	107.3
67	K	29.1	Very low	27.7	Very low	189 Å²	189	142.7 Å²	142.7	82%	0.822	82%	0.817	S	S	*	*			trans	-137.6	118.2	-169.4	176.9	-161.4	178.2	-169.5	0	109.8
68	E	25.4	Very low	27.4	Very low	189 Å²	189	143 Å²	143	88%	0.883	82%	0.816	S	S	*	*			trans	-155.9	152.9	168.5	-115.9	154.8	-147.1	0	0	110.1
69	E	28.7	Very low	27.4	Very low	181 Å²	181	144.9 Å²	144.9	85%	0.846	82%	0.818	S	S	*	*			trans	-105.9	-157.9	179.1	-50.4	-176.1	124.1	0	0	110.1
70	P	39.4	Very low	27.5	Very low	115 Å²	115	144 Å²	144	75%	0.747	82%	0.815	S	S	*	*			trans	-109	178.3	-132.5	36.9	-18.9	0	0	0	114.3
71	P	25.5	Very low	27.9	Very low	128 Å²	128	146.9 Å²	146.9	83%	0.831	82%	0.816	S	S	*	*			trans	-122	163.2	143.9	36.4	-27.8	0	0	0	112.9
72	E	26.2	Very low	28.5	Very low	181 Å²	181	150.1 Å²	150.1	85%	0.846	81%	0.814	S	S	*	*			trans	-90.7	168.5	-171.4	-65.1	167.7	120.8	0	0	114.1
73	E	26.2	Very low	28.8	Very low	167 Å²	167	150 Å²	150	78%	0.78	81%	0.809	S	S	*	*			trans	38.9	115.1	154.9	-67.5	-173.5	173.7	0	0	120.7
74	Q	24.1	Very low	29	Very low	193 Å²	193	151 Å²	151	90%	0.902	81%	0.81	S	S	*	*				-168	137.5	110.3	-103	146.4	97.7	0	0	112.3
75	S	28.5	Very low	29.2	Very low	110 Å²	110	151.5 Å²	151.5	77%	0.769	80%	0.804	S	S	*	*			trans	-90.7	151.2	165	50.9	0	0	0	0	111.1
76	P	25.8	Very low	29.4	Very low	115 Å²	115	150.6 Å²	150.6	75%	0.747	79%	0.794	S	S	*	*			trans	-135	146.5	133.4	36.2	-26.4	0	0	0	112.9
77	D	27	Very low	29.6	Very low	162 Å²	162	150.5 Å²	150.5	87%	0.866	79%	0.789	S	S	*	*			trans	-67.6	137.3	175.2	-61.3	-86.6	0	0	0	113.1
78	V	27.4	Very low	29.7	Very low	131 Å²	131	147.9 Å²	147.9	79%	0.794	78%	0.784	S	S	*	*			trans	-146	135.7	164	-164.7	0	0	0	0	109.8	P80	V78-P80 WeakPolarHBondContact O-CD 3.38Å
79	D	26.3	Very low	30	Very low	143 Å²	143	144 Å²	144	77%	0.765	76%	0.764	S	S	*	*			trans	-61.9	128.2	-173.2	-75.7	-71.4	0	0	0	115.6	L81	D79-L81 PolarHBondContact O-N 2.85Å
80	P	29	Very low	30	Very low	127 Å²	127	142 Å²	142	83%	0.825	76%	0.758	S	S	*	*			trans	-74.1	53.9	171.8	-19.9	34.8	0	0	0	115.4	V78 H82	V78-P80 WeakPolarHBondContact O-CD 3.38Å; P80-H82 VanDerWaalsContact C-N 3.34Å; P80-H82 PolarHBondContact O-N 3.01Å
81	L	33.9	Very low	29.6	Very low	156 Å²	156	142.6 Å²	142.6	82%	0.817	76%	0.764	S	S	*	*			trans	-93.1	29	177.2	-101	173.3	0	0	0	114.8	D79	D79-L81 PolarHBondContact O-N 2.85Å
82	H	37.5	Very low	29.6	Very low	167 Å²	167	140.6 Å²	140.6	77%	0.773	75%	0.752	S	S	*	*	S	Bend	trans	-150.2	104.9	169.4	-121.5	55.3	0	0	0	112.9	P80	P80-H82 VanDerWaalsContact C-N 3.34Å; P80-H82 PolarHBondContact O-N 3.01Å
83	T	34.2	Very low	29.6	Very low	114 Å²	114	142 Å²	142	70%	0.699	75%	0.75	S	S	*	*	S	Bend	trans	175.9	-11.6	156.3	20.3	0	0	0	0	113.9	E85	T83-E85 VanDerWaalsContact C-N 3.27Å; T83-E85 PolarHBondContact O-N 3.33Å
84	Q	33.6	Very low	29.7	Very low	180 Å²	180	143.2 Å²	143.2	84%	0.841	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-6.3	179.5	-98.2	-172.9	0.8	0	0	115.5
85	E	32.1	Very low	29.9	Very low	132 Å²	132	143.4 Å²	143.4	62%	0.617	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-3.7	-169.8	-135	-156.4	111.8	0	0	115.7	T83 K89	T83-E85 VanDerWaalsContact C-N 3.27Å; T83-E85 PolarHBondContact O-N 3.33Å; E85-K89 WeakPolarHBondContact O-CE 3.37Å; E85-K89 PolarHBondContact O-NZ 2.93Å; E85-K89 IonicContact OE1-NZ 2.93Å; E85-K89 PolarHBondContact OE1-NZ 3.21Å
86	E	30.3	Very low	29.8	Very low	146 Å²	146	146.7 Å²	146.7	68%	0.682	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-39.1	-179.2	-61.6	-159.1	112.2	0	0	113.2	N88 K89	E86-N88 PolarHBondContact O-N 3.41Å; E86-K89 WeakPolarHBondContact O-CB 3.08Å; E86-K89 PolarHBondContact O-N 3.35Å
87	N	30.5	Very low	29.9	Very low	135 Å²	135	150.2 Å²	150.2	72%	0.722	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-14.3	179.8	-73.1	-43.8	0	0	0	114.3
88	N	32.3	Very low	29.9	Very low	134 Å²	134	150.8 Å²	150.8	72%	0.717	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-5.2	171.3	-82.1	-44	0	0	0	114.3	E86	E86-N88 PolarHBondContact O-N 3.41Å
89	K	30.7	Very low	29.8	Very low	107 Å²	107	152.3 Å²	152.3	47%	0.465	77%	0.771	S	S	.	*	S	Bend	trans	-92.9	-8	-177.6	-68.5	173.7	174.5	122.4	0	114.1	E85 E86 S92	E85-K89 WeakPolarHBondContact O-CE 3.37Å; E85-K89 PolarHBondContact O-NZ 2.93Å; E85-K89 IonicContact OE1-NZ 2.93Å; E85-K89 PolarHBondContact OE1-NZ 3.21Å; E86-K89 WeakPolarHBondContact O-CB 3.08Å; E86-K89 PolarHBondContact O-N 3.35Å; K89-S92 PolarHBondContact O-OG 3.23Å
90	I	30.4	Very low	30	Very low	139 Å²	139	157.3 Å²	157.3	71%	0.713	78%	0.779	S	S	*	*	S	Bend	trans	-92.4	-28.7	-178.2	-61.5	177.4	0	0	0	112.1	S92	I90-S92 VanDerWaalsContact C-N 3.28Å; I90-S92 PolarHBondContact O-N 3.3Å
91	C	30.1	Very low	29.8	Very low	128 Å²	128	158.2 Å²	158.2	87%	0.865	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	13.2	-179.4	-159.2	0	0	0	0	114.3
92	S	25.9	Very low	29.3	Very low	85 Å²	85	160.6 Å²	160.6	59%	0.594	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.4	-0.3	-174.4	57.3	0	0	0	0	115.1	K89 I90	K89-S92 PolarHBondContact O-OG 3.23Å; I90-S92 VanDerWaalsContact C-N 3.28Å; I90-S92 PolarHBondContact O-N 3.3Å
93	R	26.1	Very low	28.7	Very low	210 Å²	210	159.8 Å²	159.8	79%	0.792	78%	0.782	S	S	*	*	S	Bend	trans	-97.8	6	-176.3	-70.8	-170.5	65	108.6	3	115.7
94	H	27.4	Very low	28.3	Very low	193 Å²	193	162.8 Å²	162.8	89%	0.894	79%	0.788	S	S	*	*	S	Bend	trans	-113.9	16.3	-171.2	-131.8	-66.3	0	0	0	115.6
95	E	28.2	Very low	27.9	Very low	197 Å²	197	158.1 Å²	158.1	92%	0.921	77%	0.773	S	S	*	*	S	Bend	trans	-104.3	-5.7	170.8	-76.8	-159.6	128.1	0	0	114.3
96	E	26.6	Very low	27.6	Very low	180 Å²	180	156.1 Å²	156.1	84%	0.841	77%	0.767	S	S	*	*	S	Bend	trans	-89.2	-15.7	-169.1	-96.4	-174.3	147.1	0	0	116.8
97	E	28.1	Very low	27.4	Very low	188 Å²	188	159.2 Å²	159.2	88%	0.879	77%	0.774	S	S	*	*	S	Bend	trans	-110.5	37	-168	-150.2	176.5	-167.3	0	0	115.9
98	L	27.5	Very low	27.3	Very low	174 Å²	174	156.9 Å²	156.9	91%	0.911	77%	0.768	S	S	*	*			trans	-132.1	59.8	171	-77.9	179.7	0	0	0	113.8
99	L	25	Very low	27.1	Very low	163 Å²	163	158.8 Å²	158.8	85%	0.853	77%	0.766	S	S	*	*			trans	-110.2	78.2	175	-109.7	174.8	0	0	0	112.6
100	R	29.9	Very low	26.8	Very low	248 Å²	248	162.6 Å²	162.6	94%	0.936	78%	0.782	S	S	*	*			trans	-175.1	68.1	156.2	-105.8	161.7	-163.7	-132.9	6.8	115.5
101	V	26.1	Very low	26.5	Very low	146 Å²	146	161.1 Å²	161.1	89%	0.885	78%	0.782	S	S	*	*	S	Bend	trans	-131.6	144.8	153.5	-175.4	0	0	0	0	108.4
102	K	24	Very low	26.2	Very low	206 Å²	206	159.7 Å²	159.7	90%	0.896	77%	0.765	S	S	*	*			trans	-70.1	140.9	-169.3	-64.3	174.8	-179.4	173.9	0	112.2
103	E	24.3	Very low	26.1	Very low	150 Å²	150	160.9 Å²	160.9	70%	0.701	77%	0.765	S	S	*	*			trans	-81.8	127.7	178.8	-63.8	-168.8	102.8	0	0	112
104	E	25.3	Very low	26.1	Very low	177 Å²	177	156.5 Å²	156.5	83%	0.827	76%	0.756	S	S	*	*			trans	-133.2	155.6	163.5	-81.5	-64	156.1	0	0	109.1
105	P	24.4	Very low	25.8	Very low	82 Å²	82	152.3 Å²	152.3	53%	0.532	74%	0.744	S	S	.	*			trans	-79.9	137.1	-154	29.3	-36.3	0	0	0	116.2	Y107	P105-Y107 HydrophobicContact CB-CD2 4.38Å; P105-Y107 HydrophobicContact CB-CE2 4.26Å; P105-Y107 HydrophobicContact CG-CD2 4.01Å; P105-Y107 HydrophobicContact CG-CE2 3.62Å; P105-Y107 PolarHBondContact O-N 2.81Å
106	D	27.1	Very low	25.5	Very low	91 Å²	91	152.1 Å²	152.1	49%	0.487	74%	0.736	S	S	.	*			trans	-69.9	87.6	170.8	175	18.4	0	0	0	112.3	S108 R109	D106-S108 PolarHBondContact O-N 3.28Å; D106-S108 WeakPolarHBondContact OD1-CA 3.4Å; D106-S108 VanDerWaalsContact OD1-CB 3.32Å; D106-S108 WeakPolarHBondContact OD1-CB 3.24Å; D106-S108 PolarHBondContact OD1-N 3.01Å; D106-S108 PolarHBondContact OD1-OG 3.07Å; D106-R109 VanDerWaalsContact OD2-CB 3.28Å; D106-R109 WeakPolarHBondContact OD2-CB 3.35Å
107	Y	26.6	Very low	25.4	Very low	210 Å²	210	149.3 Å²	149.3	82%	0.824	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-0	172	-86.6	-79.5	0	0	0	114.7	P105	P105-Y107 HydrophobicContact CB-CD2 4.38Å; P105-Y107 HydrophobicContact CB-CE2 4.26Å; P105-Y107 HydrophobicContact CG-CD2 4.01Å; P105-Y107 HydrophobicContact CG-CE2 3.62Å; P105-Y107 PolarHBondContact O-N 2.81Å
108	S	27.6	Very low	25.2	Very low	86 Å²	86	146.2 Å²	146.2	60%	0.601	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-14.1	177.1	78.7	0	0	0	0	113.5	D106	D106-S108 PolarHBondContact O-N 3.28Å; D106-S108 WeakPolarHBondContact OD1-CA 3.4Å; D106-S108 VanDerWaalsContact OD1-CB 3.32Å; D106-S108 WeakPolarHBondContact OD1-CB 3.24Å; D106-S108 PolarHBondContact OD1-N 3.01Å; D106-S108 PolarHBondContact OD1-OG 3.07Å
109	R	27.5	Very low	25.3	Very low	175 Å²	175	143 Å²	143	66%	0.66	71%	0.712	S	S	*	*			trans	-109	91.9	-169.8	-164.5	176.3	-158.3	119	5.9	113.1	D106	D106-R109 VanDerWaalsContact OD2-CB 3.28Å; D106-R109 WeakPolarHBondContact OD2-CB 3.35Å
110	F	25.2	Very low	25.4	Very low	186 Å²	186	143.2 Å²	143.2	82%	0.816	71%	0.709	S	S	*	*			trans	-54.3	134.9	165.7	-81.4	-87.3	0	0	0	110.6	L112	F110-L112 PolarHBondContact O-N 2.93Å
111	P	23	Very low	25.2	Very low	108 Å²	108	138.1 Å²	138.1	70%	0.701	70%	0.7	S	S	*	*			trans	-69.5	128.4	-175.2	26.7	-33.9	0	0	0	111.3	N113	P111-N113 VanDerWaalsContact C-N 3.28Å; P111-N113 PolarHBondContact O-N 2.62Å
112	L	25.6	Very low	25.1	Very low	99 Å²	99	138.5 Å²	138.5	52%	0.518	70%	0.697	S	S	.	*			trans	-67.8	84.3	170.3	-70.5	171.1	0	0	0	110.3	F110 I114	F110-L112 PolarHBondContact O-N 2.93Å; L112-I114 PolarHBondContact O-N 2.87Å; L112-I114 VanDerWaalsContact O-N 3.14Å
113	N	23	Very low	25.2	Very low	110 Å²	110	136.7 Å²	136.7	59%	0.588	69%	0.692	S	S	*	*			trans	-69.4	101	158	-94	3.7	0	0	0	107.9	P111 V115	P111-N113 VanDerWaalsContact C-N 3.28Å; P111-N113 PolarHBondContact O-N 2.62Å; N113-V115 VanDerWaalsContact C-N 3.33Å; N113-V115 HydrophobicContact CB-CG2 4.46Å; N113-V115 PolarHBondContact O-N 3.15Å
114	I	25.3	Very low	25.3	Very low	118 Å²	118	137 Å²	137	61%	0.605	69%	0.693	S	S	*	*			trans	-65.5	101	157.5	-60	173.3	0	0	0	105.9	L112 Y116	L112-I114 PolarHBondContact O-N 2.87Å; L112-I114 VanDerWaalsContact O-N 3.14Å; I114-Y116 HydrophobicContact CG2-CD2 4.02Å; I114-Y116 HydrophobicContact CG2-CE2 4.27Å; I114-Y116 PolarHBondContact O-N 3.06Å
115	V	22.7	Very low	25.3	Very low	105 Å²	105	136.9 Å²	136.9	64%	0.636	69%	0.69	S	S	*	*			trans	-83.5	106.1	164.8	-179.1	0	0	0	0	106	N113 V117	N113-V115 VanDerWaalsContact C-N 3.33Å; N113-V115 HydrophobicContact CB-CG2 4.46Å; N113-V115 PolarHBondContact O-N 3.15Å; V115-V117 HydrophobicContact CG1-CG2 3.93Å; V115-V117 PolarHBondContact O-N 3.45Å
116	Y	21.6	Very low	25.5	Very low	193 Å²	193	138.5 Å²	138.5	76%	0.757	70%	0.7	S	S	*	*			trans	-64.8	115.4	154.3	-97.9	-102	0	0	0	106.3	I114	I114-Y116 HydrophobicContact CG2-CD2 4.02Å; I114-Y116 HydrophobicContact CG2-CE2 4.27Å; I114-Y116 PolarHBondContact O-N 3.06Å
117	V	23.9	Very low	25.4	Very low	120 Å²	120	141.1 Å²	141.1	73%	0.727	72%	0.72	S	S	*	*			trans	-90.1	97.7	164.9	-175.6	0	0	0	0	105	V115	V115-V117 HydrophobicContact CG1-CG2 3.93Å; V115-V117 PolarHBondContact O-N 3.45Å
118	N	23.2	Very low	25.2	Very low	124 Å²	124	139 Å²	139	66%	0.663	72%	0.719	S	S	*	*			trans	-73.1	129.8	159.8	-69.5	17.5	0	0	0	106.1
119	S	30.6	Very low	25.1	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	72%	0.722	S	S	*	*			trans	-87.1	121.9	172.5	-53.5	0	0	0	0	108.2
120	E	26	Very low	25.1	Very low	167 Å²	167	138.4 Å²	138.4	78%	0.78	73%	0.725	S	S	*	*			trans	-158.7	110.9	164	-104.1	140.3	-148.4	0	0	108
121	D	26.5	Very low	25.1	Very low	141 Å²	141	136.8 Å²	136.8	75%	0.754	72%	0.724	S	S	*	*			trans	63.5	114.3	145.3	-47.6	-12.9	0	0	0	122.8
122	D	24.5	Very low	25.2	Very low	154 Å²	154	138.1 Å²	138.1	82%	0.824	72%	0.721	S	S	*	*			trans	41.6	126	134.6	-58.7	-24.1	0	0	0	123.7
123	E	25.6	Very low	25.4	Very low	169 Å²	169	141.4 Å²	141.4	79%	0.79	73%	0.733	S	S	*	*				-165.9	156.7	102	-108.4	-69.1	164.3	0	0	111.1
124	E	26.3	Very low	25.6	Very low	156 Å²	156	144.3 Å²	144.3	73%	0.729	74%	0.743	S	S	*	*			trans	-94.3	144.2	-175.2	-65.7	-167.9	141	0	0	113.4
125	K	25.4	Very low	25.5	Very low	175 Å²	175	147.3 Å²	147.3	76%	0.761	75%	0.754	S	S	*	*				-176.1	158.2	112	-96.9	154.2	-165.6	104	0	114.7
126	P	28	Very low	25.6	Very low	115 Å²	115	148.2 Å²	148.2	75%	0.747	76%	0.761	S	S	*	*			trans	-95.4	158.3	-167.6	37.3	-35.7	0	0	0	114
127	V	25.3	Very low	25.7	Very low	147 Å²	147	147.2 Å²	147.2	89%	0.891	76%	0.763	S	S	*	*			trans	-128.4	130.3	156.1	-178.6	0	0	0	0	108.4
128	M	21.8	Very low	25.7	Very low	164 Å²	164	146.9 Å²	146.9	81%	0.808	77%	0.766	S	S	*	*			trans	-108.3	161.6	-179	-118	-79.3	-82.6	0	0	110.4
129	S	26.2	Very low	25.7	Very low	96 Å²	96	144.7 Å²	144.7	67%	0.671	77%	0.773	S	S	*	*			trans	71.2	157.2	172.9	86.8	0	0	0	0	115.7
130	Q	27.1	Very low	25.2	Very low	153 Å²	153	146.9 Å²	146.9	72%	0.715	78%	0.776	S	S	*	*			cis	-127	149.1	8.3	-64.9	178.7	5.1	0	0	112.9	H132	Q130-H132 PolarHBondContact OE1-CE1 2.87Å
131	L	24.8	Very low	25.1	Very low	152 Å²	152	146.9 Å²	146.9	80%	0.796	78%	0.78	S	S	*	*			trans	-72.1	129.9	161.9	175.3	70.5	0	0	0	109
132	H	26.4	Very low	25	Very low	137 Å²	137	145.7 Å²	145.7	63%	0.634	78%	0.78	S	S	*	*			trans	-132.7	124.6	162	-93.2	77.4	0	0	0	109.7	Q130	Q130-H132 PolarHBondContact OE1-CE1 2.87Å
133	Q	29.1	Very low	25	Very low	168 Å²	168	145.1 Å²	145.1	79%	0.785	78%	0.783	S	S	*	*			trans	-88	130.9	168.3	-66.6	174	-19.3	0	0	108.1
134	H	26.7	Very low	24.9	Very low	171 Å²	171	141.4 Å²	141.4	79%	0.792	78%	0.776	S	S	*	*			trans	-135.5	124.6	160.2	-89.8	-80	0	0	0	109.9
135	Q	24.7	Very low	24.9	Very low	180 Å²	180	139.2 Å²	139.2	84%	0.841	78%	0.778	S	S	*	*			trans	-108.3	134.2	166.5	-65.6	176.4	-6.4	0	0	108
136	T	24.8	Very low	25	Very low	125 Å²	125	134.7 Å²	134.7	77%	0.767	77%	0.768	S	S	*	*			trans	161.1	147	156.1	27.7	0	0	0	0	105.9
137	E	23.7	Very low	24.9	Very low	171 Å²	171	132 Å²	132	80%	0.799	76%	0.761	S	S	*	*			cis	175.7	144.7	-26	-116.1	-179.1	162	0	0	104
138	S	22.8	Very low	25.2	Very low	113 Å²	113	128 Å²	128	79%	0.79	74%	0.735	S	S	*	*			trans	41.1	126.2	160.9	60.4	0	0	0	0	121.3
139	G	23.3	Very low	25.5	Very low	79 Å²	79	128.8 Å²	128.8	81%	0.814	74%	0.736	S	S	*	*			trans	-163.6	44.8	172.9	0	0	0	0	0	113.4
140	D	21.1	Very low	25.7	Very low	151 Å²	151	127 Å²	127	81%	0.807	72%	0.718	S	S	*	*			trans	-77.2	131.6	-171.8	-69.3	-74.5	0	0	0	114.5
141	L	23	Very low	25.7	Very low	167 Å²	167	129.2 Å²	129.2	87%	0.874	73%	0.726	S	S	*	*			trans	-141.9	148.7	146.2	-87.7	-177.9	0	0	0	109.5
142	P	25	Very low	25.8	Very low	116 Å²	116	123.5 Å²	123.5	75%	0.753	70%	0.701	S	S	*	*			trans	-87.2	148.4	-155.1	33	-36.8	0	0	0	114.5
143	T	23.6	Very low	25.8	Very low	142 Å²	142	125 Å²	125	87%	0.871	71%	0.708	S	S	*	*			trans	-130.9	126.9	157.5	50.2	0	0	0	0	110.4
144	S	24.3	Very low	25.9	Very low	92 Å²	92	121.6 Å²	121.6	64%	0.643	69%	0.694	S	S	*	*			trans	-97	105.4	-173	58	0	0	0	0	112.6
145	S	25.6	Very low	26.1	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	69%	0.692	S	S	*	*			trans	-158.6	125.2	156.1	61.6	0	0	0	0	111.9	G147	S145-G147 VanDerWaalsContact C-N 3.31Å; S145-G147 PolarHBondContact O-N 2.92Å
146	S	27.4	Very low	26.6	Very low	80 Å²	80	116 Å²	116	56%	0.559	67%	0.674	S	S	*	*			trans	-70.5	82.2	169	47.7	0	0	0	0	111.2	D148 V343	S146-D148 PolarHBondContact O-N 2.91Å; S146-D148 VanDerWaalsContact O-N 3.11Å; S146-V343 VanDerWaalsContact CB-CG2 3.48Å
147	G	27.3	Very low	27.3	Very low	58 Å²	58	117.8 Å²	117.8	60%	0.598	67%	0.673	S	S	*	*			trans	-75.6	89.5	167.9	0	0	0	0	0	110.2	S145 Q149	S145-G147 VanDerWaalsContact C-N 3.31Å; S145-G147 PolarHBondContact O-N 2.92Å; G147-Q149 WeakPolarHBondContact O-CG 2.98Å; G147-Q149 PolarHBondContact O-N 3.27Å
148	D	31.6	Very low	28.1	Very low	64 Å²	64	110.7 Å²	110.7	34%	0.342	64%	0.64	S	S	.	*			trans	-67.2	100.9	175.3	-128.7	-23.7	0	0	0	108.7	S146 I150 K348 S360	S146-D148 PolarHBondContact O-N 2.91Å; S146-D148 VanDerWaalsContact O-N 3.11Å; D148-I150 VanDerWaalsContact C-N 3.35Å; D148-I150 PolarHBondContact O-N 3.33Å; D148-K348 WeakPolarHBondContact OD1-CE 3.38Å; D148-K348 IonicContact OD1-NZ 2.68Å; D148-K348 PolarHBondContact OD1-NZ 2.83Å; D148-S360 PolarHBondContact OD2-OG 3.21Å
149	Q	26.8	Very low	28.4	Very low	179 Å²	179	107.4 Å²	107.4	84%	0.836	62%	0.617	S	S	*	*			trans	-73.2	80.6	-167.1	-67.9	-172.9	47.7	0	0	112.9	G147 K151	G147-Q149 WeakPolarHBondContact O-CG 2.98Å; G147-Q149 PolarHBondContact O-N 3.27Å; Q149-K151 PolarHBondContact O-N 3.31Å
150	I	30.4	Very low	28.8	Very low	58 Å²	58	107 Å²	107	30%	0.297	61%	0.613	S	S	.	*			trans	-71.8	106.3	160.4	-49.1	-173.7	0	0	0	107.5	D148 A152 F359 I371	D148-I150 VanDerWaalsContact C-N 3.35Å; D148-I150 PolarHBondContact O-N 3.33Å; I150-A152 HydrophobicContact CG2-CB 4.03Å; I150-A152 PolarHBondContact O-N 2.95Å; I150-F359 HydrophobicContact CD1-CE1 3.87Å; I150-F359 HydrophobicContact CG1-CE1 3.93Å; I150-I371 HydrophobicContact CG2-CD1 4.24Å
151	K	27.8	Very low	28.9	Very low	200 Å²	200	104.5 Å²	104.5	87%	0.87	61%	0.613	S	S	*	*			trans	-77.1	56.1	172.8	-164.9	-162.3	170.2	-169.5	0	111.2	Q149	Q149-K151 PolarHBondContact O-N 3.31Å
152	A	26.3	Very low	29	Very low	33 Å²	33	101.7 Å²	101.7	27%	0.273	61%	0.614	S	S	.	*			trans	-96.5	132.1	159.3	0	0	0	0	0	107.4	I150 I154 I371	I150-A152 HydrophobicContact CG2-CB 4.03Å; I150-A152 PolarHBondContact O-N 2.95Å; A152-I154 HydrophobicContact CB-CG1 4.17Å; A152-I154 PolarHBondContact O-N 2.8Å; A152-I371 HydrophobicContact CB-CD1 3.95Å
153	E	26.3	Very low	29	Very low	168 Å²	168	101.7 Å²	101.7	79%	0.785	60%	0.604	S	S	*	*			trans	-76.6	76	174.3	-69	-171.3	140.9	0	0	109.4	E155	E153-E155 PolarHBondContact O-N 3.13Å
154	I	32.2	Very low	29.1	Very low	97 Å²	97	100.1 Å²	100.1	50%	0.497	60%	0.598	S	S	.	*			trans	-73.9	77.9	169.1	-48	170.7	0	0	0	107.2	A152 V156	A152-I154 HydrophobicContact CB-CG1 4.17Å; A152-I154 PolarHBondContact O-N 2.8Å; I154-V156 HydrophobicContact CG2-CG2 3.64Å; I154-V156 PolarHBondContact O-N 3.21Å
155	E	30.6	Very low	29.2	Very low	160 Å²	160	100.5 Å²	100.5	75%	0.748	60%	0.601	S	S	*	*			trans	-68	86.1	166.5	-68.1	-159.9	126.2	0	0	108.8	E153 E157	E153-E155 PolarHBondContact O-N 3.13Å; E155-E157 HydrophobicContact CB-CG 4.38Å; E155-E157 PolarHBondContact O-N 3.17Å
156	V	35.3	Very low	29.2	Very low	74 Å²	74	105 Å²	105	45%	0.448	60%	0.601	S	S	.	*			trans	-69.4	79.6	169.1	-173.8	0	0	0	0	108.1	I154 I158 L417	I154-V156 HydrophobicContact CG2-CG2 3.64Å; I154-V156 PolarHBondContact O-N 3.21Å; V156-I158 HydrophobicContact CG1-CB 3.92Å; V156-I158 HydrophobicContact CG1-CD1 3.74Å; V156-I158 HydrophobicContact CG1-CG1 3.63Å; V156-I158 PolarHBondContact O-N 3.08Å; V156-L417 HydrophobicContact CG1-CD1 3.92Å
157	E	38.8	Very low	29.1	Very low	161 Å²	161	107.1 Å²	107.1	75%	0.752	61%	0.606	S	S	*	*			trans	-69.6	24.7	175.5	-69	-157.7	115.1	0	0	113.6	E155 C159	E155-E157 HydrophobicContact CB-CG 4.38Å; E155-E157 PolarHBondContact O-N 3.17Å; E157-C159 PolarHBondContact O-N 2.94Å; E157-C159 VanDerWaalsContact O-N 3.11Å
158	I	40.1	Very low	29	Very low	22 Å²	22	110.4 Å²	110.4	11%	0.113	62%	0.617	C	S	.	*			trans	-84.6	29	177.8	-43	179.4	0	0	0	110.8	V156 I399 S416 L417 C420	V156-I158 HydrophobicContact CG1-CB 3.92Å; V156-I158 HydrophobicContact CG1-CD1 3.74Å; V156-I158 HydrophobicContact CG1-CG1 3.63Å; V156-I158 PolarHBondContact O-N 3.08Å; I158-I399 HydrophobicContact CG1-CD1 4.36Å; I158-I399 HydrophobicContact CG2-CD1 4.15Å; I158-I399 HydrophobicContact CG2-CG1 4.09Å; I158-S416 PolarHBondContact O-OG 2.73Å; I158-L417 HydrophobicContact CB-CD1 3.82Å; I158-L417 HydrophobicContact CG2-CD1 4.07Å; I158-L417 HydrophobicContact CG2-CG 4.31Å; I158-C420 PolarHBondContact O-SG 2.91Å; I158-C420 VanDerWaalsContact O-SG 3.34Å
159	C	30.1	Very low	28.7	Very low	44 Å²	44	114 Å²	114	30%	0.297	64%	0.636	S	S	.	*	S	Bend	trans	-129	56.1	164.4	-48.2	0	0	0	0	108.8	E157 A161 C420 R423	E157-C159 PolarHBondContact O-N 2.94Å; E157-C159 VanDerWaalsContact O-N 3.11Å; C159-A161 PolarHBondContact O-N 2.86Å; C159-C420 HydrophobicContact CB-CB 4.12Å; C159-C420 WeakPolarHBondContact CB-SG 3.5Å; C159-C420 WeakPolarHBondContact SG-CB 3.29Å; C159-C420 CovalentContact SG-SG 2.05Å; C159-C420 PolarHBondContact SG-SG 2.91Å; C159-R423 PolarHBondContact SG-NH2 2.89Å; C159-R423 VanDerWaalsContact SG-NH2 3.38Å
160	G	31.1	Very low	28.6	Very low	71 Å²	71	113.2 Å²	113.2	73%	0.732	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-65.3	128.1	-166.5	0	0	0	0	0	115.2
161	A	23.4	Very low	28.3	Very low	98 Å²	98	117.3 Å²	117.3	81%	0.81	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-99.2	124.9	132.3	0	0	0	0	0	105.7	C159 E163	C159-A161 PolarHBondContact O-N 2.86Å; A161-E163 PolarHBondContact O-N 3.16Å
162	A	24.4	Very low	28.4	Very low	108 Å²	108	113.5 Å²	113.5	89%	0.893	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-65.4	127.3	-164.7	0	0	0	0	0	113.6
163	E	24.8	Very low	28.6	Very low	117 Å²	117	117.8 Å²	117.8	55%	0.547	68%	0.678	S	S	.	*			trans	-129.1	131.6	155.1	-80.5	-150	-169.7	0	0	110	A161 K478	A161-E163 PolarHBondContact O-N 3.16Å; E163-K478 VanDerWaalsContact OE2-CD 3.27Å; E163-K478 WeakPolarHBondContact OE2-CD 3.36Å; E163-K478 VanDerWaalsContact OE2-CE 3.26Å; E163-K478 WeakPolarHBondContact OE2-CE 3.42Å; E163-K478 IonicContact OE2-NZ 3.74Å; E163-K478 PolarHBondContact OE2-NZ 2.97Å
164	S	25.9	Very low	28.4	Very low	108 Å²	108	113.8 Å²	113.8	76%	0.755	68%	0.682	S	S	*	*			trans	-82.7	135.6	176.8	-177.6	0	0	0	0	111.9	K478	S164-K478 PolarHBondContact O-NZ 3.31Å; S164-K478 VanDerWaalsContact O-NZ 3.09Å
165	S	26.1	Very low	28	Very low	101 Å²	101	112.7 Å²	112.7	71%	0.706	69%	0.694	S	S	*	*			trans	-159.9	131.5	155.4	-69.8	0	0	0	0	108.3	K478	S165-K478 PolarHBondContact OG-NZ 2.97Å
166	R	26.3	Very low	27.6	Very low	203 Å²	203	110.9 Å²	110.9	77%	0.766	69%	0.694	S	S	*	*			trans	-121.4	145.1	174.3	-100.6	-176.2	172.2	165.1	-2.8	109.2
167	N	25.2	Very low	27.1	Very low	125 Å²	125	115 Å²	115	67%	0.668	71%	0.712	S	S	*	*			trans	54.5	147.8	153.2	-58.8	16.3	0	0	0	120.3
168	P	26.6	Very low	26.4	Very low	127 Å²	127	111.7 Å²	111.7	83%	0.825	71%	0.708	S	S	*	*				-113.1	167.9	115.5	35.2	-35.7	0	0	0	112.3
169	D	23.5	Very low	25.5	Very low	139 Å²	139	118.8 Å²	118.8	74%	0.743	74%	0.74	S	S	*	*			trans	-93.6	167.9	-167.7	-52.6	-78.9	0	0	0	115.3
170	I	26.5	Very low	25.2	Very low	163 Å²	163	120.9 Å²	120.9	84%	0.836	76%	0.755	S	S	*	*			trans	179.1	109.7	134	-91.8	155.1	0	0	0	111.5
171	N	23.8	Very low	24.8	Very low	145 Å²	145	126 Å²	126	78%	0.775	76%	0.76	S	S	*	*				13.7	142.4	125.6	-74.7	-7.6	0	0	0	120.5
172	T	29.3	Very low	24.8	Very low	119 Å²	119	127.2 Å²	127.2	73%	0.73	76%	0.757	S	S	*	*			cis	-151.5	-142.2	-9.8	-44.7	0	0	0	0	110
173	P	30.6	Very low	24.7	Very low	124 Å²	124	129.4 Å²	129.4	81%	0.805	75%	0.754	S	S	*	*				-116.2	170.2	-126.5	41.1	-25.5	0	0	0	119.1
174	G	22.6	Very low	24.8	Very low	84 Å²	84	132.8 Å²	132.8	87%	0.866	77%	0.77	S	S	*	*			trans	135.5	138.5	144.9	0	0	0	0	0	117.1
175	G	22.3	Very low	24.7	Very low	73 Å²	73	135.9 Å²	135.9	75%	0.753	78%	0.777	S	S	*	*			trans	123.5	51.1	157.1	0	0	0	0	0	121.2
176	T	22.5	Very low	24.9	Very low	123 Å²	123	139.2 Å²	139.2	76%	0.755	79%	0.787	S	S	*	*			trans	25.4	123.7	145.4	53.9	0	0	0	0	123.2
177	L	24.4	Very low	25	Very low	159 Å²	159	136.3 Å²	136.3	83%	0.832	78%	0.783	S	S	*	*			trans	64.9	149.6	135.4	-67.1	163.8	0	0	0	119.2
178	S	23.9	Very low	25.1	Very low	93 Å²	93	139.1 Å²	139.1	65%	0.65	79%	0.792	S	S	*	*			cis	-155.9	155.8	9.1	47.8	0	0	0	0	112.5
179	H	22.3	Very low	25.2	Very low	171 Å²	171	138.4 Å²	138.4	79%	0.792	78%	0.781	S	S	*	*			trans	32.6	148	141.8	-70.4	-86	0	0	0	122.5
180	S	23.6	Very low	25.7	Very low	87 Å²	87	140.4 Å²	140.4	61%	0.608	79%	0.786	S	S	*	*			cis	172.5	-178.3	-28	48.6	0	0	0	0	106.8
181	E	23.8	Very low	25.8	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	78%	0.778	S	S	*	*			cis	-132.3	-86	10.5	-68.8	175	63.9	0	0	112.9
182	T	22.9	Very low	26	Very low	122 Å²	122	135.6 Å²	135.6	75%	0.748	76%	0.762	S	S	*	*			trans	-140.3	165.8	-171.5	51.9	0	0	0	0	114.1
183	D	22.5	Very low	26.4	Very low	154 Å²	154	136.7 Å²	136.7	82%	0.824	76%	0.759	S	S	*	*				-174.6	167.2	110.3	-84.6	-5.8	0	0	0	111.5
184	E	26.4	Very low	26.4	Very low	189 Å²	189	136.2 Å²	136.2	88%	0.883	75%	0.746	S	S	*	*			trans	-100.7	147.2	-170.2	-56.5	-178.8	145.6	0	0	112.3
185	D	22.9	Very low	26.9	Very low	172 Å²	172	137.2 Å²	137.2	92%	0.92	73%	0.731	S	S	*	*			trans	-171.8	151.5	147.2	-107.8	-29.2	0	0	0	112
186	D	30.5	Very low	27.1	Very low	171 Å²	171	140 Å²	140	91%	0.914	73%	0.729	S	S	*	*			trans	-89.2	98.4	175.9	-92.3	-47.5	0	0	0	111.3
187	E	28.1	Very low	27.5	Very low	143 Å²	143	140.9 Å²	140.9	67%	0.668	73%	0.729	S	S	*	*			trans	-113.4	153	156.5	-80.4	-164.7	168.8	0	0	110.8	K301	E187-K301 IonicContact OE1-NZ 2.69Å; E187-K301 PolarHBondContact OE1-NZ 2.84Å; E187-K301 IonicContact OE2-NZ 2.79Å; E187-K301 PolarHBondContact OE2-NZ 2.99Å
188	E	28	Very low	27.6	Very low	184 Å²	184	139 Å²	139	86%	0.86	72%	0.72	S	S	*	*			trans	-61.3	159.4	-173.4	-56.8	-168.8	141.6	0	0	112.9	E190	E188-E190 PolarHBondContact O-N 3.42Å
189	D	29.1	Very low	27.9	Very low	111 Å²	111	139.5 Å²	139.5	59%	0.594	72%	0.715	S	S	*	*			trans	-70	67.8	177.8	-76.3	-46.6	0	0	0	112	K394	D189-K394 IonicContact OD1-NZ 3.88Å; D189-K394 PolarHBondContact OD1-NZ 2.99Å
190	E	32.9	Very low	28.1	Very low	182 Å²	182	137.9 Å²	137.9	85%	0.85	71%	0.712	S	S	*	*			trans	-63.9	133	149.9	-64.7	-157.7	137.8	0	0	107.9	E188	E188-E190 PolarHBondContact O-N 3.42Å
191	D	29.3	Very low	28.3	Very low	126 Å²	126	140.3 Å²	140.3	67%	0.674	71%	0.708	S	S	*	*			trans	-59.4	150.6	177.1	-94.5	-63.6	0	0	0	110.2	E193	D191-E193 PolarHBondContact O-N 2.97Å
192	D	28.8	Very low	28.6	Very low	80 Å²	80	136.3 Å²	136.3	43%	0.428	69%	0.692	S	S	.	*			trans	-62.5	76	174.5	-69.7	-75.9	0	0	0	112.1	E194 K390	D192-E194 PolarHBondContact O-N 2.81Å; D192-K390 HydrophobicContact CB-CD 4.41Å; D192-K390 WeakPolarHBondContact OD1-CD 3.39Å; D192-K390 WeakPolarHBondContact OD1-CE 3.47Å; D192-K390 IonicContact OD1-NZ 3.69Å; D192-K390 PolarHBondContact OD1-NZ 3.31Å; D192-K390 WeakPolarHBondContact OD2-CB 3.38Å; D192-K390 WeakPolarHBondContact OD2-CD 3.39Å; D192-K390 WeakPolarHBondContact OD2-CG 3.41Å
193	E	37.8	Very low	28.7	Very low	143 Å²	143	133.1 Å²	133.1	67%	0.668	68%	0.675	S	S	*	*			trans	-73.7	70.2	162.7	-66.2	-160.7	152.5	0	0	108.6	D191 D195	D191-E193 PolarHBondContact O-N 2.97Å; E193-D195 PolarHBondContact O-N 3.09Å
194	E	30.5	Very low	28.9	Very low	113 Å²	113	131.9 Å²	131.9	53%	0.528	66%	0.664	S	S	.	*			trans	-63.8	75.2	155.5	-77.6	173.4	-161	0	0	108	D192 N196 K390	D192-E194 PolarHBondContact O-N 2.81Å; E194-N196 PolarHBondContact O-N 3.34Å; E194-K390 IonicContact OE1-NZ 3.89Å; E194-K390 PolarHBondContact OE1-NZ 2.96Å
195	D	32.5	Very low	28.9	Very low	106 Å²	106	130 Å²	130	57%	0.567	66%	0.655	S	S	*	*			trans	-69.1	55.9	-176.1	-125.3	19.7	0	0	0	111.1	E193 D197	E193-D195 PolarHBondContact O-N 3.09Å; D195-D197 PolarHBondContact O-N 3.1Å
196	N	26.6	Very low	29.1	Very low	130 Å²	130	126.7 Å²	126.7	70%	0.695	65%	0.645	S	S	*	*			trans	-73.5	60.6	159.5	-67.2	-76.5	0	0	0	108.4	E194 D198	E194-N196 PolarHBondContact O-N 3.34Å; N196-D198 PolarHBondContact O-N 2.9Å
197	D	29.9	Very low	29	Very low	142 Å²	142	125.9 Å²	125.9	76%	0.759	64%	0.636	S	S	*	*			trans	-80.5	57.3	175.6	-145.8	29.6	0	0	0	108.5	D195 D199	D195-D197 PolarHBondContact O-N 3.1Å; D197-D199 PolarHBondContact O-N 3.47Å; D197-D199 VanDerWaalsContact O-N 3.11Å
198	D	28	Very low	28.9	Very low	121 Å²	121	127.6 Å²	127.6	65%	0.647	65%	0.648	S	S	*	*			trans	-67	106.8	178	-96.3	-50.6	0	0	0	110.3	N196 K273	N196-D198 PolarHBondContact O-N 2.9Å; D198-K273 IonicContact OD1-NZ 3.48Å
199	D	29.3	Very low	28.9	Very low	103 Å²	103	128.9 Å²	128.9	55%	0.551	65%	0.646	S	S	*	*	S	Bend	trans	66.1	81.7	158.2	-58.2	-43.1	0	0	0	119	D197 K273	D197-D199 PolarHBondContact O-N 3.47Å; D197-D199 VanDerWaalsContact O-N 3.11Å; D199-K273 IonicContact OD1-NZ 3.58Å; D199-K273 PolarHBondContact OD1-NZ 3.4Å; D199-K273 VanDerWaalsContact OD2-CE 3.29Å; D199-K273 WeakPolarHBondContact OD2-CE 3.46Å; D199-K273 IonicContact OD2-NZ 3.56Å; D199-K273 PolarHBondContact OD2-NZ 3.26Å
200	D	26.2	Very low	29	Very low	136 Å²	136	129.5 Å²	129.5	73%	0.727	66%	0.655	S	S	*	*				-134.2	72.8	122.4	-169.6	17.9	0	0	0	110.8	N202	D200-N202 PolarHBondContact O-N 3.39Å
201	W	29.1	Very low	28.6	Very low	138 Å²	138	129.2 Å²	129.2	52%	0.523	66%	0.659	S	S	.	*			trans	-72	67.2	175.1	-175	-92.7	0	0	0	111.4	C203 L305	W201-C203 PolarHBondContact O-N 2.89Å; W201-C203 VanDerWaalsContact O-N 3.11Å; W201-L305 HydrophobicContact CH2-CD1 4.4Å
202	N	28.5	Very low	28.5	Very low	96 Å²	96	128.5 Å²	128.5	51%	0.513	66%	0.664	S	S	.	*			trans	-85.9	79.3	176.4	-165.5	25.3	0	0	0	110.7	D200 H204	D200-N202 PolarHBondContact O-N 3.39Å; N202-H204 PolarHBondContact O-N 3.44Å
203	C	25.5	Very low	28.4	Very low	55 Å²	55	132.7 Å²	132.7	37%	0.372	69%	0.686	S	S	.	*			trans	-59.2	104.3	-179.2	-174	0	0	0	0	112.2	W201	W201-C203 PolarHBondContact O-N 2.89Å; W201-C203 VanDerWaalsContact O-N 3.11Å
204	H	26.3	Very low	28	Very low	129 Å²	129	131.4 Å²	131.4	60%	0.597	69%	0.693	S	S	*	*			trans	-110.8	77	171.3	-106.9	-73.4	0	0	0	110.8	N202 S206	N202-H204 PolarHBondContact O-N 3.44Å; H204-S206 PolarHBondContact O-N 3.42Å
205	E	26.8	Very low	27.9	Very low	150 Å²	150	134.8 Å²	134.8	70%	0.701	71%	0.709	S	S	*	*			trans	-76.8	109.9	173	-167.7	172.2	129.4	0	0	110.6	K283	E205-K283 IonicContact OE2-NZ 2.6Å
206	S	27.8	Very low	27.7	Very low	101 Å²	101	136.1 Å²	136.1	71%	0.706	72%	0.721	S	S	*	*			trans	-126.1	70.8	179.5	-72.2	0	0	0	0	111.8	H204	H204-S206 PolarHBondContact O-N 3.42Å
207	Q	27.9	Very low	27.7	Very low	154 Å²	154	139.1 Å²	139.1	72%	0.72	73%	0.731	S	S	*	*			trans	43.8	102.8	155.7	-63	-176.8	73.5	0	0	118.5
208	L	26.5	Very low	27.6	Very low	179 Å²	179	135.8 Å²	135.8	94%	0.937	73%	0.73	S	S	*	*			trans	-109.1	131.5	139.4	-69.4	175.7	0	0	0	107.9
209	R	27.8	Very low	27.5	Very low	212 Å²	212	140.3 Å²	140.3	80%	0.8	75%	0.745	S	S	*	*			trans	-88.4	149.8	170.1	-74.2	-171.7	-179.7	-166.1	0.5	109.5
210	P	30.1	Very low	27.5	Very low	123 Å²	123	143.6 Å²	143.6	80%	0.799	76%	0.756	S	S	*	*			trans	-67.3	149	172.8	30.4	-35.3	0	0	0	110.7
211	L	25.6	Very low	27.6	Very low	176 Å²	176	146.3 Å²	146.3	92%	0.921	76%	0.764	S	S	*	*			trans	-108.7	143.3	158.9	-69.6	173.4	0	0	0	107.7
212	S	26.8	Very low	27.9	Very low	112 Å²	112	149 Å²	149	78%	0.783	78%	0.78	S	S	*	*			trans	-122.1	146.7	172.8	55.1	0	0	0	0	108.4
213	D	27	Very low	28	Very low	167 Å²	167	150.1 Å²	150.1	89%	0.893	80%	0.795	S	S	*	*			trans	-73.8	140.1	-164.3	-47.3	-82.2	0	0	0	114.5
214	S	28.5	Very low	28.2	Very low	116 Å²	116	155.5 Å²	155.5	81%	0.811	82%	0.815	S	S	*	*			trans	-163	130.4	151.8	62.8	0	0	0	0	109.4
215	E	28.5	Very low	28.4	Very low	185 Å²	185	156.4 Å²	156.4	86%	0.864	82%	0.823	S	S	*	*			trans	-80.3	151.4	-173.1	-56.7	159.7	113.1	0	0	113
216	T	28.7	Very low	28.5	Very low	134 Å²	134	154.4 Å²	154.4	82%	0.822	83%	0.826	S	S	*	*				176.9	146.9	120.6	26.2	0	0	0	0	113.5
217	E	27.8	Very low	28.8	Very low	192 Å²	192	159.3 Å²	159.3	90%	0.897	83%	0.834	S	S	*	*			trans	17.8	131.5	150.4	-59.4	-90.6	106.4	0	0	120
218	G	26.3	Very low	28.9	Very low	73 Å²	73	157 Å²	157	75%	0.753	84%	0.835	S	S	*	*			trans	-106.3	173.6	179.5	0	0	0	0	0	115.4
219	F	25.7	Very low	29.2	Very low	216 Å²	216	152.7 Å²	152.7	95%	0.947	83%	0.825	S	S	*	*			trans	-147.6	157	164.5	-141.2	-96.8	0	0	0	113.3
220	H	30.1	Very low	29.3	Very low	171 Å²	171	150.6 Å²	150.6	79%	0.792	82%	0.822	S	S	*	*			trans	-92.4	123.9	-175.8	-133	9.4	0	0	0	110.9
221	Q	29.3	Very low	29.5	Very low	193 Å²	193	150 Å²	150	90%	0.902	82%	0.816	S	S	*	*			trans	-150.5	145.1	153.4	-145.6	159.8	24.2	0	0	113.4
222	K	34.9	Very low	30.2	Very low	195 Å²	195	148.4 Å²	148.4	85%	0.848	80%	0.804	S	S	*	*			trans	-98.5	135.9	174.8	-63.3	173.2	-179.4	173.6	0	109.2
223	S	30.1	Very low	30.8	Very low	119 Å²	119	150.8 Å²	150.8	83%	0.832	80%	0.8	S	S	*	*			trans	-133.2	141.9	165.5	56.8	0	0	0	0	110
224	H	29.9	Very low	31.9	Very low	169 Å²	169	148.1 Å²	148.1	78%	0.782	79%	0.786	S	S	*	*			trans	-85.8	147.9	-171.5	-89.7	-122.1	0	0	0	113
225	L	31.3	Very low	33.4	Very low	147 Å²	147	148.7 Å²	148.7	77%	0.77	78%	0.776	S	S	*	*			trans	46.4	100.2	143.5	-65.3	166.1	0	0	0	118.1
226	S	27.1	Very low	35.6	Very low	109 Å²	109	143.5 Å²	143.5	76%	0.762	75%	0.75	S	S	*	*			trans	-124.9	130.5	135.5	63.7	0	0	0	0	109.6	S228	S226-S228 PolarHBondContact O-N 2.73Å
227	K	35.8	Very low	38	Very low	204 Å²	204	140.6 Å²	140.6	89%	0.887	73%	0.734	S	S	*	*			trans	-87.1	88.6	175.3	-76.2	-178	176.9	178.1	0	109.3
228	S	29.7	Very low	40.4	Very low	104 Å²	104	134.9 Å²	134.9	73%	0.727	71%	0.706	S	S	*	*			trans	-89.7	97.6	165.2	37.5	0	0	0	0	109.6	S226 K230	S226-S228 PolarHBondContact O-N 2.73Å; S228-K230 PolarHBondContact O-N 2.91Å; S228-K230 VanDerWaalsContact O-N 3.14Å
229	A	31.4	Very low	43	Very low	89 Å²	89	132.8 Å²	132.8	74%	0.736	69%	0.685	S	S	*	*			trans	-66	111.6	173.7	0	0	0	0	0	109.5	V231	A229-V231 PolarHBondContact O-N 3.27Å
230	K	30.3	Very low	45.6	Very low	168 Å²	168	122.7 Å²	122.7	73%	0.73	64%	0.641	S	S	*	*			trans	-77.7	74	-179.5	-155.8	-162.9	-166.2	-161.6	0	111	S228 E232	S228-K230 PolarHBondContact O-N 2.91Å; S228-K230 VanDerWaalsContact O-N 3.14Å; K230-E232 HydrophobicContact CD-CG 4.18Å; K230-E232 WeakPolarHBondContact CE-OE1 3.1Å; K230-E232 HydrophobicContact CG-CG 4.21Å; K230-E232 IonicContact NZ-OE1 2.61Å; K230-E232 PolarHBondContact NZ-OE1 3.47Å; K230-E232 PolarHBondContact O-N 3.15Å; K230-E232 VanDerWaalsContact O-N 3.11Å
231	V	35.3	Very low	47.8	Very low	112 Å²	112	122.5 Å²	122.5	68%	0.679	65%	0.646	S	S	*	*			trans	-76.4	91	169.8	-177.7	0	0	0	0	108.1	A229 F233	A229-V231 PolarHBondContact O-N 3.27Å; V231-F233 HydrophobicContact CG1-CD2 3.99Å; V231-F233 PolarHBondContact O-N 3.41Å
232	E	38.8	Very low	50	Low	142 Å²	142	117.4 Å²	117.4	66%	0.664	63%	0.631	S	S	*	*			trans	-74.3	80.5	169.1	-73.1	-174.1	158.9	0	0	109.9	K230 D234	K230-E232 HydrophobicContact CD-CG 4.18Å; K230-E232 WeakPolarHBondContact CE-OE1 3.1Å; K230-E232 HydrophobicContact CG-CG 4.21Å; K230-E232 IonicContact NZ-OE1 2.61Å; K230-E232 PolarHBondContact NZ-OE1 3.47Å; K230-E232 PolarHBondContact O-N 3.15Å; K230-E232 VanDerWaalsContact O-N 3.11Å; E232-D234 PolarHBondContact O-N 2.97Å; E232-D234 VanDerWaalsContact O-N 3.11Å
233	F	40.5	Very low	52.1	Low	162 Å²	162	110.9 Å²	110.9	71%	0.711	61%	0.609	S	S	*	*			trans	-70.9	97.8	159.2	-120.7	-103.2	0	0	0	107.2	V231 E235	V231-F233 HydrophobicContact CG1-CD2 3.99Å; V231-F233 PolarHBondContact O-N 3.41Å; F233-E235 HydrophobicContact CB-CG 4.36Å; F233-E235 HydrophobicContact CD1-CG 3.76Å; F233-E235 PolarHBondContact O-N 3.31Å
234	D	49.3	Very low	54.3	Low	111 Å²	111	108 Å²	108	59%	0.594	60%	0.599	S	S	*	*			trans	-73.7	56.6	179.9	-174	20.4	0	0	0	111	E232 K236	E232-D234 PolarHBondContact O-N 2.97Å; E232-D234 VanDerWaalsContact O-N 3.11Å; D234-K236 PolarHBondContact O-N 2.89Å; D234-K236 WeakPolarHBondContact OD1-CE 3.21Å; D234-K236 IonicContact OD1-NZ 3.29Å; D234-K236 PolarHBondContact OD1-NZ 3.41Å; D234-K236 VanDerWaalsContact OD1-NZ 3.14Å; D234-K236 IonicContact OD2-NZ 3.99Å; D234-K236 PolarHBondContact OD2-NZ 3.22Å
235	E	60.3	Low	56.7	Low	128 Å²	128	105 Å²	105	60%	0.598	58%	0.583	S	S	*	*			trans	-66	117.5	178.4	-66.4	-151.1	151	0	0	110.1	F233 P237	F233-E235 HydrophobicContact CB-CG 4.36Å; F233-E235 HydrophobicContact CD1-CG 3.76Å; F233-E235 PolarHBondContact O-N 3.31Å; E235-P237 WeakPolarHBondContact O-CD 3.46Å
236	K	75.9	Confident	59.1	Low	75 Å²	75	105.5 Å²	105.5	33%	0.326	58%	0.575	S	S	.	*			trans	-108.9	72.9	170.9	-71.7	159.4	178.2	149.2	0	108	D234 F238 R246 F247	D234-K236 PolarHBondContact O-N 2.89Å; D234-K236 WeakPolarHBondContact OD1-CE 3.21Å; D234-K236 IonicContact OD1-NZ 3.29Å; D234-K236 PolarHBondContact OD1-NZ 3.41Å; D234-K236 VanDerWaalsContact OD1-NZ 3.14Å; D234-K236 IonicContact OD2-NZ 3.99Å; D234-K236 PolarHBondContact OD2-NZ 3.22Å; K236-F238 PolarHBondContact O-N 3.41Å; K236-R246 HydrophobicContact CB-CB 3.8Å; K236-R246 VanDerWaalsContact O-CZ 3.28Å; K236-R246 PolarHBondContact O-NE 3.02Å; K236-R246 PolarHBondContact O-NH2 3.33Å; K236-F247 CarbonylContact C-O 3.58Å; K236-F247 VanDerWaalsContact C-O 3.26Å; K236-F247 VanDerWaalsContact CA-O 3.25Å; K236-F247 WeakPolarHBondContact CA-O 3.23Å
237	P	77.4	Confident	61.7	Low	73 Å²	73	101.5 Å²	101.5	47%	0.474	54%	0.544	S	S	.	.			trans	-69	-21.6	-171.5	28.6	-36	0	0	0	112.7	E235 G239	E235-P237 WeakPolarHBondContact O-CD 3.46Å; P237-G239 PolarHBondContact O-N 3.05Å
238	F	79.2	Confident	64	Low	73 Å²	73	94.7 Å²	94.7	32%	0.32	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	91.8	-176.3	-55.1	-66.5	0	0	0	110.7	K236 R246 F247 S248 L249 K250 L253	K236-F238 PolarHBondContact O-N 3.41Å; F238-R246 WeakPolarHBondContact O-CA 3.2Å; F238-F247 HydrophobicContact CB-CB 4.44Å; F238-F247 PolarHBondContact N-O 3.31Å; F238-F247 PolarHBondContact O-N 3.48Å; F238-S248 WeakPolarHBondContact CE2-O 3.34Å; F238-L249 VanDerWaalsContact CD2-C 3.49Å; F238-K250 HydrophobicContact CD1-CB 4.01Å; F238-K250 HydrophobicContact CD1-CG 4.22Å; F238-K250 HydrophobicContact CD2-CB 4.24Å; F238-K250 VanDerWaalsContact CD2-N 3.31Å; F238-K250 HydrophobicContact CE1-CB 3.89Å; F238-K250 HydrophobicContact CE1-CD 4.28Å; F238-K250 HydrophobicContact CE1-CG 4.23Å; F238-K250 HydrophobicContact CE2-CB 4.11Å; F238-K250 HydrophobicContact CG-CB 4.19Å; F238-K250 HydrophobicContact CZ-CB 3.95Å; F238-L253 HydrophobicContact CB-CB 3.96Å; F238-L253 HydrophobicContact CB-CD2 3.76Å; F238-L253 HydrophobicContact CB-CG 4.45Å
239	G	79.8	Confident	66.5	Low	29 Å²	29	94.2 Å²	94.2	30%	0.299	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	152.3	172.5	0	0	0	0	0	113.2	P237 L253	P237-G239 PolarHBondContact O-N 3.05Å; G239-L253 WeakPolarHBondContact O-CD1 3.45Å; G239-L253 VanDerWaalsContact O-CD2 3.24Å; G239-L253 WeakPolarHBondContact O-CD2 3.39Å
240	C	81.8	Confident	68.8	Low	3 Å²	3	97.2 Å²	97.2	2%	0.02	51%	0.507	C	S	.	.			trans	-102.6	113.9	169.3	-178.1	0	0	0	0	110.6	S242 C243 G244 K245 F247 L253 H256 H260	C240-S242 PolarHBondContact O-N 3.09Å; C240-C243 PolarHBondContact O-N 2.91Å; C240-G244 WeakPolarHBondContact O-CA 3.12Å; C240-G244 PolarHBondContact O-N 3.03Å; C240-K245 WeakPolarHBondContact CB-O 3.1Å; C240-K245 PolarHBondContact N-O 3.29Å; C240-F247 HydrophobicContact CB-CE2 4.29Å; C240-L253 HydrophobicContact CB-CD1 3.54Å; C240-H256 VanDerWaalsContact SG-CD2 3.53Å; C240-H260 VanDerWaalsContact SG-CD2 3.57Å
241	D	76.8	Confident	70.9	Confident	168 Å²	168	92.5 Å²	92.5	90%	0.898	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-28.6	-174.6	-49.6	-59.3	0	0	0	112.9
242	S	74	Confident	72.9	Confident	85 Å²	85	89.1 Å²	89.1	59%	0.594	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-21.4	-178.8	-47.1	0	0	0	0	115	C240	C240-S242 PolarHBondContact O-N 3.09Å
243	C	79	Confident	74.8	Confident	58 Å²	58	83.7 Å²	83.7	39%	0.392	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153	11.5	-178.2	77.1	0	0	0	0	116.2	C240 K245 H256 H260	C240-C243 PolarHBondContact O-N 2.91Å; C243-K245 PolarHBondContact O-N 3.32Å; C243-H256 PolarHBondContact SG-NE2 3.27Å; C243-H260 PolarHBondContact SG-NE2 2.82Å; C243-H260 VanDerWaalsContact SG-NE2 3.44Å
244	G	77.4	Confident	76.4	Confident	59 Å²	59	82.8 Å²	82.8	61%	0.608	45%	0.445	S	S	*	.			trans	71.1	-6	174.9	0	0	0	0	0	116.5	C240 R246	C240-G244 WeakPolarHBondContact O-CA 3.12Å; C240-G244 PolarHBondContact O-N 3.03Å; G244-R246 PolarHBondContact O-N 3.28Å
245	K	80.3	Confident	77.4	Confident	106 Å²	106	80.4 Å²	80.4	46%	0.461	43%	0.432	S	S	.	.			trans	-61.3	133.7	176.6	-71	-175	178.6	-173.5	0	110.5	C240 C243 F247	C240-K245 WeakPolarHBondContact CB-O 3.1Å; C240-K245 PolarHBondContact N-O 3.29Å; C243-K245 PolarHBondContact O-N 3.32Å; K245-F247 HydrophobicContact CB-CE2 3.82Å; K245-F247 HydrophobicContact CB-CZ 3.83Å; K245-F247 WeakPolarHBondContact O-CE2 3.35Å
246	R	81.1	Confident	78.1	Confident	158 Å²	158	75.1 Å²	75.1	60%	0.596	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.8	-176.9	-63.1	-175.1	64.1	155.8	0.4	111.7	K236 F238 G244	K236-R246 HydrophobicContact CB-CB 3.8Å; K236-R246 VanDerWaalsContact O-CZ 3.28Å; K236-R246 PolarHBondContact O-NE 3.02Å; K236-R246 PolarHBondContact O-NH2 3.33Å; F238-R246 WeakPolarHBondContact O-CA 3.2Å; G244-R246 PolarHBondContact O-N 3.28Å
247	F	82.6	Confident	77.8	Confident	25 Å²	25	73.5 Å²	73.5	11%	0.11	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.4	-173.1	-56.1	-88.7	0	0	0	111.6	K236 F238 C240 K245 L253 H256	K236-F247 CarbonylContact C-O 3.58Å; K236-F247 VanDerWaalsContact C-O 3.26Å; K236-F247 VanDerWaalsContact CA-O 3.25Å; K236-F247 WeakPolarHBondContact CA-O 3.23Å; F238-F247 HydrophobicContact CB-CB 4.44Å; F238-F247 PolarHBondContact N-O 3.31Å; F238-F247 PolarHBondContact O-N 3.48Å; C240-F247 HydrophobicContact CB-CE2 4.29Å; K245-F247 HydrophobicContact CB-CE2 3.82Å; K245-F247 HydrophobicContact CB-CZ 3.83Å; K245-F247 WeakPolarHBondContact O-CE2 3.35Å; F247-L253 HydrophobicContact CB-CB 4.27Å; F247-L253 HydrophobicContact CD2-CB 3.89Å; F247-L253 HydrophobicContact CD2-CD1 3.82Å; F247-L253 HydrophobicContact CD2-CG 4.47Å; F247-L253 HydrophobicContact CE2-CD1 4.01Å; F247-L253 HydrophobicContact CG-CB 4.26Å; F247-H256 HydrophobicContact CE1-CB 4.08Å; F247-H256 HydrophobicContact CE2-CB 3.97Å; F247-H256 AromaticContact CE2-CD2 3.44Å; F247-H256 VanDerWaalsContact CE2-CD2 3.44Å; F247-H256 WeakPolarHBondContact CE2-CD2 3.16Å; F247-H256 AromaticContact CE2-CG 3.77Å; F247-H256 HydrophobicContact CZ-CB 3.52Å; F247-H256 AromaticContact CZ-CD2 3.46Å; F247-H256 VanDerWaalsContact CZ-CD2 3.46Å; F247-H256 WeakPolarHBondContact CZ-CD2 3.34Å; F247-H256 AromaticContact CZ-CG 3.34Å; F247-H256 AromaticContact CZ-ND1 4Å
248	S	83.5	Confident	77.5	Confident	60 Å²	60	71.5 Å²	71.5	42%	0.42	39%	0.388	S	S	.	.	S	Bend	trans	-77.8	-25.9	174.7	49.2	0	0	0	0	112.6	F238	F238-S248 WeakPolarHBondContact CE2-O 3.34Å
249	L	82.1	Confident	77	Confident	94 Å²	94	72.4 Å²	72.4	49%	0.492	40%	0.395	S	S	.	.	S	Bend	trans	-118.9	136.1	179.7	-60.8	176.3	0	0	0	111.7	F238 S251 S252 L253	F238-L249 VanDerWaalsContact CD2-C 3.49Å; L249-S251 PolarHBondContact O-N 2.92Å; L249-S252 WeakPolarHBondContact O-CB 3.4Å; L249-S252 PolarHBondContact O-N 2.84Å; L249-S252 VanDerWaalsContact O-N 3.08Å; L249-L253 PolarHBondContact O-N 3.3Å; L249-L253 VanDerWaalsContact O-N 3.09Å
250	K	78.7	Confident	76.4	Confident	152 Å²	152	74.9 Å²	74.9	66%	0.661	40%	0.398	S	S	*	.	H	α-helix	trans	-61.3	-28.9	174.9	-169.5	174.6	-179.4	178	0	112.5	F238 Y254	F238-K250 HydrophobicContact CD1-CB 4.01Å; F238-K250 HydrophobicContact CD1-CG 4.22Å; F238-K250 HydrophobicContact CD2-CB 4.24Å; F238-K250 VanDerWaalsContact CD2-N 3.31Å; F238-K250 HydrophobicContact CE1-CB 3.89Å; F238-K250 HydrophobicContact CE1-CD 4.28Å; F238-K250 HydrophobicContact CE1-CG 4.23Å; F238-K250 HydrophobicContact CE2-CB 4.11Å; F238-K250 HydrophobicContact CG-CB 4.19Å; F238-K250 HydrophobicContact CZ-CB 3.95Å; K250-Y254 VanDerWaalsContact O-CB 3.29Å; K250-Y254 WeakPolarHBondContact O-CB 3.39Å; K250-Y254 PolarHBondContact O-N 3.14Å
251	S	76.1	Confident	75.7	Confident	69 Å²	69	78.8 Å²	78.8	48%	0.483	42%	0.422	S	S	.	.	H	α-helix	trans	-67.7	-39.2	172.9	48.6	0	0	0	0	112.8	L249 Y254 N255	L249-S251 PolarHBondContact O-N 2.92Å; S251-Y254 PolarHBondContact O-N 3.34Å; S251-N255 WeakPolarHBondContact O-CB 3.41Å; S251-N255 PolarHBondContact O-N 3.24Å
252	S	76.4	Confident	75	Confident	41 Å²	41	72.8 Å²	72.8	29%	0.287	40%	0.4	S	S	.	.	H	α-helix	trans	-67	-42.7	174.1	-55.7	0	0	0	0	111.3	L249 N255 H256	L249-S252 WeakPolarHBondContact O-CB 3.4Å; L249-S252 PolarHBondContact O-N 2.84Å; L249-S252 VanDerWaalsContact O-N 3.08Å; S252-N255 PolarHBondContact O-N 3.08Å; S252-H256 WeakPolarHBondContact O-CB 3.42Å; S252-H256 PolarHBondContact O-N 3.32Å
253	L	77.8	Confident	74.1	Confident	28 Å²	28	75.8 Å²	75.8	15%	0.147	41%	0.405	C	S	.	.	H	α-helix	trans	-58	-49.1	170.3	173.6	62.1	0	0	0	111	F238 G239 C240 F247 L249 N255 H256 T257	F238-L253 HydrophobicContact CB-CB 3.96Å; F238-L253 HydrophobicContact CB-CD2 3.76Å; F238-L253 HydrophobicContact CB-CG 4.45Å; G239-L253 WeakPolarHBondContact O-CD1 3.45Å; G239-L253 VanDerWaalsContact O-CD2 3.24Å; G239-L253 WeakPolarHBondContact O-CD2 3.39Å; C240-L253 HydrophobicContact CB-CD1 3.54Å; F247-L253 HydrophobicContact CB-CB 4.27Å; F247-L253 HydrophobicContact CD2-CB 3.89Å; F247-L253 HydrophobicContact CD2-CD1 3.82Å; F247-L253 HydrophobicContact CD2-CG 4.47Å; F247-L253 HydrophobicContact CE2-CD1 4.01Å; F247-L253 HydrophobicContact CG-CB 4.26Å; L249-L253 PolarHBondContact O-N 3.3Å; L249-L253 VanDerWaalsContact O-N 3.09Å; L253-N255 VanDerWaalsContact C-N 3.35Å; L253-N255 PolarHBondContact O-N 2.8Å; L253-H256 CarbonylContact O-C 3.56Å; L253-H256 WeakPolarHBondContact O-CA 3.4Å; L253-H256 WeakPolarHBondContact O-CB 3.44Å; L253-H256 PolarHBondContact O-N 3.34Å; L253-T257 HydrophobicContact CD1-CG2 3.87Å; L253-T257 HydrophobicContact CG-CG2 4.27Å; L253-T257 PolarHBondContact O-N 3.2Å; L253-T257 PolarHBondContact O-OG1 2.57Å
254	Y	76.1	Confident	73.1	Confident	144 Å²	144	81.7 Å²	81.7	57%	0.565	42%	0.424	S	S	*	.	H	α-helix	trans	-61.8	-38.7	-178.9	176.3	-116.9	0	0	0	113.3	K250 S251 H256 T257 K258	K250-Y254 VanDerWaalsContact O-CB 3.29Å; K250-Y254 WeakPolarHBondContact O-CB 3.39Å; K250-Y254 PolarHBondContact O-N 3.14Å; S251-Y254 PolarHBondContact O-N 3.34Å; Y254-H256 VanDerWaalsContact C-N 3.29Å; Y254-T257 WeakPolarHBondContact CA-OG1 3.35Å; Y254-T257 PolarHBondContact O-OG1 2.87Å; Y254-K258 WeakPolarHBondContact O-CG 3.45Å; Y254-K258 PolarHBondContact O-N 2.89Å
255	N	69.9	Low	72.4	Confident	61 Å²	61	80.7 Å²	80.7	33%	0.326	41%	0.407	S	S	.	.	H	α-helix	trans	-73.4	-21.1	174.3	-75	-13.9	0	0	0	113.1	S251 S252 L253 K258 N276	S251-N255 WeakPolarHBondContact O-CB 3.41Å; S251-N255 PolarHBondContact O-N 3.24Å; S252-N255 PolarHBondContact O-N 3.08Å; L253-N255 VanDerWaalsContact C-N 3.35Å; L253-N255 PolarHBondContact O-N 2.8Å; N255-K258 PolarHBondContact OD1-NZ 3.14Å; N255-N276 PolarHBondContact O-ND2 3.27Å
256	H	73.6	Confident	71.9	Confident	17 Å²	17	79.1 Å²	79.1	8%	0.079	40%	0.404	C	S	.	.	H	α-helix	trans	-82.3	-39.1	171.4	172.6	64.9	0	0	0	112.4	C240 C243 F247 S252 L253 Y254 K258 I259 H260	C240-H256 VanDerWaalsContact SG-CD2 3.53Å; C243-H256 PolarHBondContact SG-NE2 3.27Å; F247-H256 HydrophobicContact CE1-CB 4.08Å; F247-H256 HydrophobicContact CE2-CB 3.97Å; F247-H256 AromaticContact CE2-CD2 3.44Å; F247-H256 VanDerWaalsContact CE2-CD2 3.44Å; F247-H256 WeakPolarHBondContact CE2-CD2 3.16Å; F247-H256 AromaticContact CE2-CG 3.77Å; F247-H256 HydrophobicContact CZ-CB 3.52Å; F247-H256 AromaticContact CZ-CD2 3.46Å; F247-H256 VanDerWaalsContact CZ-CD2 3.46Å; F247-H256 WeakPolarHBondContact CZ-CD2 3.34Å; F247-H256 AromaticContact CZ-CG 3.34Å; F247-H256 AromaticContact CZ-ND1 4Å; S252-H256 WeakPolarHBondContact O-CB 3.42Å; S252-H256 PolarHBondContact O-N 3.32Å; L253-H256 CarbonylContact O-C 3.56Å; L253-H256 WeakPolarHBondContact O-CA 3.4Å; L253-H256 WeakPolarHBondContact O-CB 3.44Å; L253-H256 PolarHBondContact O-N 3.34Å; Y254-H256 VanDerWaalsContact C-N 3.29Å; H256-K258 PolarHBondContact O-N 3.03Å; H256-I259 VanDerWaalsContact O-CB 3.24Å; H256-I259 WeakPolarHBondContact O-CB 3.37Å; H256-I259 WeakPolarHBondContact O-CG1 3.49Å; H256-I259 PolarHBondContact O-N 2.77Å; H256-H260 AromaticContact CD2-NE2 3.9Å; H256-H260 AromaticContact CE1-NE2 3.33Å; H256-H260 PolarHBondContact CE1-NE2 3.49Å; H256-H260 VanDerWaalsContact CE1-NE2 3.33Å; H256-H260 AromaticContact NE2-CD2 3.85Å; H256-H260 AromaticContact NE2-NE2 3.02Å; H256-H260 PolarHBondContact NE2-NE2 3.01Å
257	T	71.2	Confident	71.5	Confident	41 Å²	41	74.6 Å²	74.6	25%	0.252	40%	0.396	S	S	.	.	H	α-helix	trans	-62.7	-29.6	178.7	47.1	0	0	0	0	113	L253 Y254 I259 H260 T261	L253-T257 HydrophobicContact CD1-CG2 3.87Å; L253-T257 HydrophobicContact CG-CG2 4.27Å; L253-T257 PolarHBondContact O-N 3.2Å; L253-T257 PolarHBondContact O-OG1 2.57Å; Y254-T257 WeakPolarHBondContact CA-OG1 3.35Å; Y254-T257 PolarHBondContact O-OG1 2.87Å; T257-I259 PolarHBondContact O-N 3.25Å; T257-H260 PolarHBondContact O-N 3.5Å; T257-T261 PolarHBondContact O-N 3.45Å; T257-T261 PolarHBondContact O-OG1 3.36Å
258	K	70.9	Confident	71.4	Confident	31 Å²	31	73.4 Å²	73.4	14%	0.135	39%	0.391	C	S	.	.	H	α-helix	trans	-58.1	-25.4	171.6	-68.1	170.5	-169.3	166.7	0	113.9	Y254 N255 H256 H260 G262	Y254-K258 WeakPolarHBondContact O-CG 3.45Å; Y254-K258 PolarHBondContact O-N 2.89Å; N255-K258 PolarHBondContact OD1-NZ 3.14Å; H256-K258 PolarHBondContact O-N 3.03Å; K258-H260 VanDerWaalsContact C-N 3.3Å; K258-G262 WeakPolarHBondContact O-CA 3.38Å; K258-G262 PolarHBondContact O-N 2.95Å
259	I	67.4	Low	71.1	Confident	92 Å²	92	77.7 Å²	77.7	47%	0.472	41%	0.41	S	S	.	.	H	α-helix	trans	-69.2	-33.6	176.3	-52.7	175	0	0	0	110	H256 T257	H256-I259 VanDerWaalsContact O-CB 3.24Å; H256-I259 WeakPolarHBondContact O-CB 3.37Å; H256-I259 WeakPolarHBondContact O-CG1 3.49Å; H256-I259 PolarHBondContact O-N 2.77Å; T257-I259 PolarHBondContact O-N 3.25Å
260	H	68.2	Low	70.8	Confident	80 Å²	80	79.7 Å²	79.7	37%	0.37	41%	0.414	S	S	.	.	H	α-helix	trans	-85.9	-32.4	177.3	-54.6	-64.3	0	0	0	113.1	C240 C243 H256 T257 K258	C240-H260 VanDerWaalsContact SG-CD2 3.57Å; C243-H260 PolarHBondContact SG-NE2 2.82Å; C243-H260 VanDerWaalsContact SG-NE2 3.44Å; H256-H260 AromaticContact CD2-NE2 3.9Å; H256-H260 AromaticContact CE1-NE2 3.33Å; H256-H260 PolarHBondContact CE1-NE2 3.49Å; H256-H260 VanDerWaalsContact CE1-NE2 3.33Å; H256-H260 AromaticContact NE2-CD2 3.85Å; H256-H260 AromaticContact NE2-NE2 3.02Å; H256-H260 PolarHBondContact NE2-NE2 3.01Å; T257-H260 PolarHBondContact O-N 3.5Å; K258-H260 VanDerWaalsContact C-N 3.3Å
261	T	66.5	Low	70.9	Confident	85 Å²	85	75.1 Å²	75.1	52%	0.521	40%	0.401	S	S	.	.	H	α-helix	trans	-91.9	-10.5	-178.1	64.9	0	0	0	0	114.4	T257 E263	T257-T261 PolarHBondContact O-N 3.45Å; T257-T261 PolarHBondContact O-OG1 3.36Å; T261-E263 PolarHBondContact O-N 3.26Å
262	G	61	Low	70.7	Confident	42 Å²	42	74.2 Å²	74.2	43%	0.433	40%	0.402	S	S	.	.			trans	72.3	-24.7	-178.8	0	0	0	0	0	115.3	K258 K264 S265	K258-G262 WeakPolarHBondContact O-CA 3.38Å; K258-G262 PolarHBondContact O-N 2.95Å; G262-K264 PolarHBondContact O-N 3.08Å; G262-K264 VanDerWaalsContact O-N 3.13Å; G262-S265 PolarHBondContact O-N 2.94Å; G262-S265 PolarHBondContact O-OG 3.26Å
263	E	57.1	Low	70.7	Confident	148 Å²	148	75.4 Å²	75.4	69%	0.692	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	113.1	-178.4	-68.8	-166.8	119.2	0	0	112.7	T261 S265	T261-E263 PolarHBondContact O-N 3.26Å; E263-S265 PolarHBondContact O-N 2.9Å
264	K	56.2	Low	70.5	Confident	182 Å²	182	77.9 Å²	77.9	79%	0.791	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	43	-179.1	-60.6	180	177.7	175.4	0	113.6	G262	G262-K264 PolarHBondContact O-N 3.08Å; G262-K264 VanDerWaalsContact O-N 3.13Å
265	S	63.2	Low	70.6	Confident	38 Å²	38	72.1 Å²	72.1	27%	0.266	40%	0.397	S	S	.	.			trans	-81	145.8	146.5	69.6	0	0	0	0	110	G262 E263 F275	G262-S265 PolarHBondContact O-N 2.94Å; G262-S265 PolarHBondContact O-OG 3.26Å; E263-S265 PolarHBondContact O-N 2.9Å; S265-F275 CarbonylContact C-O 3.38Å; S265-F275 WeakPolarHBondContact CA-O 3.29Å
266	L	70.7	Confident	70.8	Confident	74 Å²	74	72.2 Å²	72.2	39%	0.387	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	111.5	174.7	-62.2	171.3	0	0	0	107.9	F275 L281	L266-F275 PolarHBondContact N-O 3.36Å; L266-F275 PolarHBondContact O-N 3.24Å; L266-L281 HydrophobicContact CB-CD2 3.86Å
267	S	73.2	Confident	71	Confident	62 Å²	62	73.2 Å²	73.2	43%	0.434	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	148.7	175.6	47.6	0	0	0	0	111.6	K273	S267-K273 CarbonylContact C-O 3.54Å
268	C	80.1	Confident	71.4	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.007	42%	0.421	C	S	.	.			trans	-88.5	121	163.9	-173.5	0	0	0	0	110.4	F270 C271 G272 K273 F275 L281 H288	C268-F270 PolarHBondContact O-N 3.38Å; C268-F270 VanDerWaalsContact O-N 3.11Å; C268-C271 PolarHBondContact O-N 2.85Å; C268-G272 WeakPolarHBondContact O-CA 3.49Å; C268-G272 PolarHBondContact O-N 2.8Å; C268-K273 PolarHBondContact N-O 3.14Å; C268-F275 HydrophobicContact CB-CE2 4.16Å; C268-L281 HydrophobicContact CB-CD1 3.63Å; C268-H288 VanDerWaalsContact SG-CD2 3.54Å
269	D	77.5	Confident	71.9	Confident	150 Å²	150	77.3 Å²	77.3	80%	0.802	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-21.2	-174.2	-50.5	-52.8	0	0	0	113.7
270	F	75.8	Confident	72.6	Confident	136 Å²	136	73.4 Å²	73.4	60%	0.596	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-25.2	179.6	-63.5	-80.9	0	0	0	114.5	C268 H288	C268-F270 PolarHBondContact O-N 3.38Å; C268-F270 VanDerWaalsContact O-N 3.11Å; F270-H288 HydrophobicContact CB-CB 4.05Å; F270-H288 HydrophobicContact CD1-CB 4.19Å; F270-H288 HydrophobicContact CD2-CB 3.82Å; F270-H288 AromaticContact CD2-CD2 3.97Å; F270-H288 AromaticContact CD2-CG 3.99Å; F270-H288 HydrophobicContact CE2-CB 4.32Å; F270-H288 HydrophobicContact CG-CB 3.76Å; F270-H288 AromaticContact CG-CG 3.81Å
271	C	79.3	Confident	73.2	Confident	55 Å²	55	71 Å²	71	37%	0.372	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.3	1.7	-169.5	69.7	0	0	0	0	115.5	C268 K273 H284 H288	C268-C271 PolarHBondContact O-N 2.85Å; C271-K273 PolarHBondContact O-N 2.95Å; C271-H284 PolarHBondContact SG-NE2 2.78Å; C271-H288 PolarHBondContact SG-NE2 2.83Å; C271-H288 VanDerWaalsContact SG-NE2 3.43Å
272	G	72.9	Confident	74	Confident	50 Å²	50	73.3 Å²	73.3	52%	0.515	41%	0.413	S	S	.	.			trans	71.6	-11.1	179.8	0	0	0	0	0	116.2	C268 T274	C268-G272 WeakPolarHBondContact O-CA 3.49Å; C268-G272 PolarHBondContact O-N 2.8Å; G272-T274 PolarHBondContact O-N 3.41Å
273	K	75.1	Confident	75.2	Confident	66 Å²	66	74 Å²	74	29%	0.287	40%	0.404	S	S	.	.			trans	-55.8	132.2	179.7	-69.2	-175.7	175.5	-173.6	0	110.7	D198 D199 S267 C268 C271 F275	D198-K273 IonicContact OD1-NZ 3.48Å; D199-K273 IonicContact OD1-NZ 3.58Å; D199-K273 PolarHBondContact OD1-NZ 3.4Å; D199-K273 VanDerWaalsContact OD2-CE 3.29Å; D199-K273 WeakPolarHBondContact OD2-CE 3.46Å; D199-K273 IonicContact OD2-NZ 3.56Å; D199-K273 PolarHBondContact OD2-NZ 3.26Å; S267-K273 CarbonylContact C-O 3.54Å; C268-K273 PolarHBondContact N-O 3.14Å; C271-K273 PolarHBondContact O-N 2.95Å; K273-F275 HydrophobicContact CB-CE2 3.81Å; K273-F275 HydrophobicContact CB-CZ 4.07Å; K273-F275 WeakPolarHBondContact O-CD2 3.44Å; K273-F275 VanDerWaalsContact O-CE2 3.27Å; K273-F275 WeakPolarHBondContact O-CE2 3.39Å
274	T	75.4	Confident	76.5	Confident	81 Å²	81	68.3 Å²	68.3	50%	0.497	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	127.7	-170.6	49.2	0	0	0	0	112.5	G272	G272-T274 PolarHBondContact O-N 3.41Å
275	F	77	Confident	77.8	Confident	22 Å²	22	61.4 Å²	61.4	10%	0.096	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	144.1	-175.1	-63.2	-88.9	0	0	0	111.6	S265 L266 C268 K273 S277 D280 L281 H284	S265-F275 CarbonylContact C-O 3.38Å; S265-F275 WeakPolarHBondContact CA-O 3.29Å; L266-F275 PolarHBondContact N-O 3.36Å; L266-F275 PolarHBondContact O-N 3.24Å; C268-F275 HydrophobicContact CB-CE2 4.16Å; K273-F275 HydrophobicContact CB-CE2 3.81Å; K273-F275 HydrophobicContact CB-CZ 4.07Å; K273-F275 WeakPolarHBondContact O-CD2 3.44Å; K273-F275 VanDerWaalsContact O-CE2 3.27Å; K273-F275 WeakPolarHBondContact O-CE2 3.39Å; F275-S277 VanDerWaalsContact C-N 3.32Å; F275-D280 HydrophobicContact CD1-CB 4.21Å; F275-L281 HydrophobicContact CB-CB 4.09Å; F275-L281 HydrophobicContact CD2-CB 4.22Å; F275-L281 HydrophobicContact CD2-CD1 3.76Å; F275-L281 HydrophobicContact CE2-CD1 4.18Å; F275-L281 HydrophobicContact CG-CB 4.21Å; F275-H284 HydrophobicContact CE1-CB 3.8Å; F275-H284 HydrophobicContact CE2-CB 4.02Å; F275-H284 AromaticContact CE2-CD2 3.41Å; F275-H284 VanDerWaalsContact CE2-CD2 3.41Å; F275-H284 WeakPolarHBondContact CE2-CD2 3.39Å; F275-H284 AromaticContact CE2-CG 3.73Å; F275-H284 HydrophobicContact CZ-CB 3.49Å; F275-H284 VanDerWaalsContact CZ-CB 3.49Å; F275-H284 AromaticContact CZ-CD2 3.39Å; F275-H284 WeakPolarHBondContact CZ-CD2 3.46Å; F275-H284 AromaticContact CZ-CG 3.23Å; F275-H284 AromaticContact CZ-ND1 3.74Å; F275-H284 AromaticContact CZ-NE2 3.97Å
276	N	73.9	Confident	78.9	Confident	64 Å²	64	61.7 Å²	61.7	34%	0.342	35%	0.346	S	S	.	.	S	Bend	trans	-87.9	1.3	179.1	62.6	5.4	0	0	0	113.8	N255	N255-N276 PolarHBondContact O-ND2 3.27Å
277	S	78.1	Confident	79.6	Confident	38 Å²	38	63.1 Å²	63.1	27%	0.266	36%	0.357	S	S	.	.			trans	-150.2	135.5	-173.9	174.9	0	0	0	0	110.7	F275 S279 D280 L281	F275-S277 VanDerWaalsContact C-N 3.32Å; S277-S279 VanDerWaalsContact C-N 3.27Å; S277-S279 PolarHBondContact O-N 3.5Å; S277-S279 PolarHBondContact OG-N 3.31Å; S277-D280 VanDerWaalsContact CB-OD2 3.27Å; S277-D280 WeakPolarHBondContact CB-OD2 3.2Å; S277-D280 PolarHBondContact O-N 2.84Å; S277-D280 VanDerWaalsContact O-N 3.16Å; S277-L281 PolarHBondContact O-N 3.34Å
278	S	79.6	Confident	80	Confident	81 Å²	81	63.6 Å²	63.6	57%	0.566	35%	0.352	S	S	*	.	H	α-helix	trans	-64.2	-33.7	176.3	-179.1	0	0	0	0	111.9	D280 L281 K282	S278-D280 VanDerWaalsContact C-N 3.29Å; S278-D280 PolarHBondContact O-N 3.36Å; S278-L281 PolarHBondContact O-N 3.1Å; S278-K282 WeakPolarHBondContact O-CB 3.26Å; S278-K282 PolarHBondContact O-N 3.01Å
279	S	81.7	Confident	80.2	Confident	76 Å²	76	67 Å²	67	53%	0.531	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-36.2	174.2	-57.3	0	0	0	0	112.2	S277 K283	S277-S279 VanDerWaalsContact C-N 3.27Å; S277-S279 PolarHBondContact O-N 3.5Å; S277-S279 PolarHBondContact OG-N 3.31Å; S279-K283 VanDerWaalsContact O-CG 3.24Å; S279-K283 WeakPolarHBondContact O-CG 3.42Å; S279-K283 PolarHBondContact O-N 3.26Å
280	D	81.2	Confident	80.5	Confident	10 Å²	10	62.1 Å²	62.1	5%	0.053	36%	0.358	C	S	.	.	H	α-helix	trans	-81.6	-36	-179.5	-64.1	-45.9	0	0	0	112.2	F275 S277 S278 K282 K283 H284	F275-D280 HydrophobicContact CD1-CB 4.21Å; S277-D280 VanDerWaalsContact CB-OD2 3.27Å; S277-D280 WeakPolarHBondContact CB-OD2 3.2Å; S277-D280 PolarHBondContact O-N 2.84Å; S277-D280 VanDerWaalsContact O-N 3.16Å; S278-D280 VanDerWaalsContact C-N 3.29Å; S278-D280 PolarHBondContact O-N 3.36Å; D280-K282 VanDerWaalsContact C-N 3.31Å; D280-K282 PolarHBondContact O-N 3.11Å; D280-K283 PolarHBondContact O-N 3.46Å; D280-K283 WeakPolarHBondContact OD1-CD 3.27Å; D280-K283 WeakPolarHBondContact OD1-CE 3.33Å; D280-K283 IonicContact OD1-NZ 3.14Å; D280-K283 PolarHBondContact OD1-NZ 3.38Å; D280-H284 WeakPolarHBondContact O-CB 3.43Å; D280-H284 PolarHBondContact O-N 2.86Å
281	L	82.5	Confident	81	Confident	29 Å²	29	59.9 Å²	59.9	15%	0.152	35%	0.35	C	S	.	.	H	α-helix	trans	-56.2	-47.3	165.1	176	61.9	0	0	0	110.6	L266 C268 F275 S277 S278 K283 H284 T285	L266-L281 HydrophobicContact CB-CD2 3.86Å; C268-L281 HydrophobicContact CB-CD1 3.63Å; F275-L281 HydrophobicContact CB-CB 4.09Å; F275-L281 HydrophobicContact CD2-CB 4.22Å; F275-L281 HydrophobicContact CD2-CD1 3.76Å; F275-L281 HydrophobicContact CE2-CD1 4.18Å; F275-L281 HydrophobicContact CG-CB 4.21Å; S277-L281 PolarHBondContact O-N 3.34Å; S278-L281 PolarHBondContact O-N 3.1Å; L281-K283 VanDerWaalsContact C-N 3.32Å; L281-K283 PolarHBondContact O-N 2.83Å; L281-H284 CarbonylContact O-C 3.55Å; L281-H284 WeakPolarHBondContact O-CA 3.34Å; L281-H284 WeakPolarHBondContact O-CB 3.49Å; L281-H284 PolarHBondContact O-N 3.39Å; L281-T285 HydrophobicContact CD1-CG2 4.02Å; L281-T285 HydrophobicContact CG-CG2 4.28Å; L281-T285 WeakPolarHBondContact O-CG2 3.42Å; L281-T285 PolarHBondContact O-N 3.48Å; L281-T285 PolarHBondContact O-OG1 3.48Å
282	K	83.6	Confident	81.5	Confident	134 Å²	134	62.7 Å²	62.7	58%	0.583	36%	0.355	S	S	*	.	H	α-helix	trans	-68.1	-26.7	179.7	-172.1	168.8	-177.2	173.2	0	113.7	S278 D280 T285	S278-K282 WeakPolarHBondContact O-CB 3.26Å; S278-K282 PolarHBondContact O-N 3.01Å; D280-K282 VanDerWaalsContact C-N 3.31Å; D280-K282 PolarHBondContact O-N 3.11Å; K282-T285 PolarHBondContact O-OG1 3.26Å
283	K	85.3	Confident	82.3	Confident	57 Å²	57	63.3 Å²	63.3	25%	0.248	35%	0.35	C	S	.	.	H	α-helix	trans	-67.9	-43.7	167	-70.5	165.4	-157.7	168.2	0	110.1	E205 S279 D280 L281 R286 L305	E205-K283 IonicContact OE2-NZ 2.6Å; S279-K283 VanDerWaalsContact O-CG 3.24Å; S279-K283 WeakPolarHBondContact O-CG 3.42Å; S279-K283 PolarHBondContact O-N 3.26Å; D280-K283 PolarHBondContact O-N 3.46Å; D280-K283 WeakPolarHBondContact OD1-CD 3.27Å; D280-K283 WeakPolarHBondContact OD1-CE 3.33Å; D280-K283 IonicContact OD1-NZ 3.14Å; D280-K283 PolarHBondContact OD1-NZ 3.38Å; L281-K283 VanDerWaalsContact C-N 3.32Å; L281-K283 PolarHBondContact O-N 2.83Å; K283-R286 WeakPolarHBondContact O-CB 3.48Å; K283-L305 HydrophobicContact CB-CD2 4.17Å; K283-L305 HydrophobicContact CD-CD2 4.41Å; K283-L305 HydrophobicContact CG-CD2 3.9Å
284	H	84.1	Confident	83	Confident	29 Å²	29	63.5 Å²	63.5	13%	0.134	35%	0.351	C	S	.	.	H	α-helix	trans	-71.3	-37.9	-178.1	178.3	69.7	0	0	0	114.1	C271 F275 D280 L281 R286 V287 H288	C271-H284 PolarHBondContact SG-NE2 2.78Å; F275-H284 HydrophobicContact CE1-CB 3.8Å; F275-H284 HydrophobicContact CE2-CB 4.02Å; F275-H284 AromaticContact CE2-CD2 3.41Å; F275-H284 VanDerWaalsContact CE2-CD2 3.41Å; F275-H284 WeakPolarHBondContact CE2-CD2 3.39Å; F275-H284 AromaticContact CE2-CG 3.73Å; F275-H284 HydrophobicContact CZ-CB 3.49Å; F275-H284 VanDerWaalsContact CZ-CB 3.49Å; F275-H284 AromaticContact CZ-CD2 3.39Å; F275-H284 WeakPolarHBondContact CZ-CD2 3.46Å; F275-H284 AromaticContact CZ-CG 3.23Å; F275-H284 AromaticContact CZ-ND1 3.74Å; F275-H284 AromaticContact CZ-NE2 3.97Å; D280-H284 WeakPolarHBondContact O-CB 3.43Å; D280-H284 PolarHBondContact O-N 2.86Å; L281-H284 CarbonylContact O-C 3.55Å; L281-H284 WeakPolarHBondContact O-CA 3.34Å; L281-H284 WeakPolarHBondContact O-CB 3.49Å; L281-H284 PolarHBondContact O-N 3.39Å; H284-R286 PolarHBondContact O-N 3.25Å; H284-V287 VanDerWaalsContact O-CB 3.29Å; H284-V287 WeakPolarHBondContact O-CB 3.46Å; H284-V287 WeakPolarHBondContact O-CG2 3.42Å; H284-V287 PolarHBondContact O-N 3.47Å; H284-H288 AromaticContact CD2-NE2 3.72Å; H284-H288 AromaticContact CE1-NE2 3.63Å; H284-H288 AromaticContact NE2-CD2 3.87Å; H284-H288 AromaticContact NE2-CE1 3.97Å; H284-H288 AromaticContact NE2-NE2 3Å; H284-H288 PolarHBondContact NE2-NE2 3Å
285	T	83.3	Confident	83.7	Confident	36 Å²	36	62.3 Å²	62.3	22%	0.221	35%	0.346	C	S	.	.	H	α-helix	trans	-58.9	-24.2	179.2	49.7	0	0	0	0	113	L281 K282 V287 H288 T289	L281-T285 HydrophobicContact CD1-CG2 4.02Å; L281-T285 HydrophobicContact CG-CG2 4.28Å; L281-T285 WeakPolarHBondContact O-CG2 3.42Å; L281-T285 PolarHBondContact O-N 3.48Å; L281-T285 PolarHBondContact O-OG1 3.48Å; K282-T285 PolarHBondContact O-OG1 3.26Å; T285-V287 PolarHBondContact O-N 3.33Å; T285-H288 PolarHBondContact O-N 3.14Å; T285-H288 VanDerWaalsContact O-N 3.12Å; T285-T289 PolarHBondContact O-N 2.89Å; T285-T289 PolarHBondContact O-OG1 3.3Å
286	R	87.6	Confident	84.4	Confident	45 Å²	45	61.3 Å²	61.3	17%	0.17	34%	0.342	C	S	.	.	H	α-helix	trans	-63.7	-21.8	173.4	-60.9	-167.9	168.5	144.6	5.9	114.5	K283 H284 G290 E291 S304	K283-R286 WeakPolarHBondContact O-CB 3.48Å; H284-R286 PolarHBondContact O-N 3.25Å; R286-G290 CarbonylContact O-C 3.53Å; R286-G290 WeakPolarHBondContact O-CA 3.38Å; R286-G290 PolarHBondContact O-N 2.96Å; R286-G290 VanDerWaalsContact O-N 3.09Å; R286-E291 HydrophobicContact CB-CB 3.89Å; R286-E291 HydrophobicContact CG-CB 3.68Å; R286-E291 IonicContact NE-OE2 3.52Å; R286-E291 PolarHBondContact NE-OE2 3.3Å; R286-E291 VanDerWaalsContact NE-OE2 3.16Å; R286-E291 PolarHBondContact O-N 3.43Å; R286-S304 WeakPolarHBondContact CD-O 3.23Å; R286-S304 PolarHBondContact NH1-O 3.42Å
287	V	83.7	Confident	85.2	Confident	104 Å²	104	67.3 Å²	67.3	63%	0.63	37%	0.368	S	S	*	.	H	α-helix	trans	-67	-41.9	173.3	-177.6	0	0	0	0	109.7	H284 T285	H284-V287 VanDerWaalsContact O-CB 3.29Å; H284-V287 WeakPolarHBondContact O-CB 3.46Å; H284-V287 WeakPolarHBondContact O-CG2 3.42Å; H284-V287 PolarHBondContact O-N 3.47Å; T285-V287 PolarHBondContact O-N 3.33Å
288	H	83.2	Confident	85.7	Confident	71 Å²	71	70.4 Å²	70.4	33%	0.329	38%	0.381	S	S	.	.	H	α-helix	trans	-80.5	-37.4	-179.9	-53.8	-65.5	0	0	0	113.1	C268 F270 C271 H284 T285 G290	C268-H288 VanDerWaalsContact SG-CD2 3.54Å; F270-H288 HydrophobicContact CB-CB 4.05Å; F270-H288 HydrophobicContact CD1-CB 4.19Å; F270-H288 HydrophobicContact CD2-CB 3.82Å; F270-H288 AromaticContact CD2-CD2 3.97Å; F270-H288 AromaticContact CD2-CG 3.99Å; F270-H288 HydrophobicContact CE2-CB 4.32Å; F270-H288 HydrophobicContact CG-CB 3.76Å; F270-H288 AromaticContact CG-CG 3.81Å; C271-H288 PolarHBondContact SG-NE2 2.83Å; C271-H288 VanDerWaalsContact SG-NE2 3.43Å; H284-H288 AromaticContact CD2-NE2 3.72Å; H284-H288 AromaticContact CE1-NE2 3.63Å; H284-H288 AromaticContact NE2-CD2 3.87Å; H284-H288 AromaticContact NE2-CE1 3.97Å; H284-H288 AromaticContact NE2-NE2 3Å; H284-H288 PolarHBondContact NE2-NE2 3Å; T285-H288 PolarHBondContact O-N 3.14Å; T285-H288 VanDerWaalsContact O-N 3.12Å; H288-G290 VanDerWaalsContact C-N 3.35Å
289	T	83.9	Confident	86.2	Confident	73 Å²	73	68.8 Å²	68.8	45%	0.448	37%	0.37	S	S	.	.	H	α-helix	trans	-84.8	-6.1	179.8	62.8	0	0	0	0	114.1	T285 E291	T285-T289 PolarHBondContact O-N 2.89Å; T285-T289 PolarHBondContact O-OG1 3.3Å; T289-E291 PolarHBondContact O-N 2.59Å
290	G	83.9	Confident	86.5	Confident	47 Å²	47	67.2 Å²	67.2	49%	0.485	37%	0.365	S	S	.	.			trans	66.7	8.2	-174.3	0	0	0	0	0	114.6	R286 H288 K292	R286-G290 CarbonylContact O-C 3.53Å; R286-G290 WeakPolarHBondContact O-CA 3.38Å; R286-G290 PolarHBondContact O-N 2.96Å; R286-G290 VanDerWaalsContact O-N 3.09Å; H288-G290 VanDerWaalsContact C-N 3.35Å; G290-K292 PolarHBondContact O-N 2.9Å; G290-K292 VanDerWaalsContact O-N 3.07Å
291	E	86.3	Confident	86.8	Confident	89 Å²	89	71 Å²	71	42%	0.416	38%	0.381	S	S	.	.			trans	-56.5	112.7	-178	-96.7	-176	-140.6	0	0	111.8	R286 T289 P293 S304	R286-E291 HydrophobicContact CB-CB 3.89Å; R286-E291 HydrophobicContact CG-CB 3.68Å; R286-E291 IonicContact NE-OE2 3.52Å; R286-E291 PolarHBondContact NE-OE2 3.3Å; R286-E291 VanDerWaalsContact NE-OE2 3.16Å; R286-E291 PolarHBondContact O-N 3.43Å; T289-E291 PolarHBondContact O-N 2.59Å; E291-P293 WeakPolarHBondContact O-CD 3.39Å; E291-S304 WeakPolarHBondContact O-CA 3.3Å; E291-S304 WeakPolarHBondContact O-CB 3.4Å
292	K	89.4	Confident	87.2	Confident	114 Å²	114	76.5 Å²	76.5	50%	0.496	40%	0.4	S	S	.	.			trans	-120.8	79.7	174.6	-69.9	167	171.5	-172.8	0	110.4	G290 F294 R302 F303	G290-K292 PolarHBondContact O-N 2.9Å; G290-K292 VanDerWaalsContact O-N 3.07Å; K292-F294 VanDerWaalsContact C-N 3.31Å; K292-F294 PolarHBondContact O-N 3.47Å; K292-R302 HydrophobicContact CB-CB 3.71Å; K292-R302 HydrophobicContact CD-CB 4.23Å; K292-R302 WeakPolarHBondContact CD-O 3.25Å; K292-R302 PolarHBondContact O-NE 2.94Å; K292-R302 VanDerWaalsContact O-NE 3.07Å; K292-R302 PolarHBondContact O-NH2 3.18Å; K292-F303 CarbonylContact C-O 3.2Å; K292-F303 VanDerWaalsContact C-O 3.25Å; K292-F303 VanDerWaalsContact CA-O 3.26Å; K292-F303 WeakPolarHBondContact CA-O 3.33Å
293	P	88.9	Confident	87.4	Confident	63 Å²	63	72 Å²	72	41%	0.409	38%	0.381	S	S	.	.			trans	-72.9	-20.9	-173.4	-17.8	33.2	0	0	0	114.3	E291 F303	E291-P293 WeakPolarHBondContact O-CD 3.39Å; P293-F303 WeakPolarHBondContact CD-O 3.46Å
294	F	89.9	Confident	87.6	Confident	70 Å²	70	71 Å²	71	31%	0.307	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133	-176.4	-52.8	-80.6	0	0	0	109.1	K292 R302 F303 S306 L309	K292-F294 VanDerWaalsContact C-N 3.31Å; K292-F294 PolarHBondContact O-N 3.47Å; F294-R302 CarbonylContact O-C 3.57Å; F294-R302 WeakPolarHBondContact O-CA 3.34Å; F294-F303 HydrophobicContact CB-CB 4.43Å; F294-F303 PolarHBondContact N-O 3.32Å; F294-F303 VanDerWaalsContact N-O 3.11Å; F294-F303 PolarHBondContact O-N 3.44Å; F294-S306 VanDerWaalsContact CD2-N 3.3Å; F294-S306 VanDerWaalsContact CE2-N 3.32Å; F294-L309 HydrophobicContact CB-CB 4.27Å; F294-L309 HydrophobicContact CB-CD2 3.92Å
295	C	90	Very high	87.8	Confident	57 Å²	57	71.6 Å²	71.6	39%	0.385	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142.5	-179.5	-159.7	0	0	0	0	109.7	G300 R302 L309	C295-G300 PolarHBondContact SG-O 3.31Å; C295-R302 HydrophobicContact CB-CG 4.38Å; C295-L309 VanDerWaalsContact O-CD2 3.25Å; C295-L309 WeakPolarHBondContact O-CD2 3.33Å
296	C	92	Very high	88.1	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.007	39%	0.391	C	S	.	.			trans	-76.6	134.9	157.1	179.6	0	0	0	0	108.6	D298 C299 G300 K301 F303 L309 M313 H316	C296-D298 PolarHBondContact SG-N 3.18Å; C296-D298 VanDerWaalsContact SG-N 3.43Å; C296-C299 PolarHBondContact SG-N 2.94Å; C296-G300 WeakPolarHBondContact O-CA 3.12Å; C296-G300 PolarHBondContact O-N 3.17Å; C296-G300 VanDerWaalsContact O-N 3.09Å; C296-K301 WeakPolarHBondContact CB-O 3.43Å; C296-K301 PolarHBondContact N-O 3.13Å; C296-F303 HydrophobicContact CB-CE2 4.41Å; C296-L309 HydrophobicContact CB-CD1 3.89Å; C296-M313 HydrophobicContact CB-SD 4.19Å; C296-H316 PolarHBondContact SG-NE2 3.08Å; C296-H316 VanDerWaalsContact SG-NE2 3.44Å
297	E	90.8	Very high	88.1	Confident	189 Å²	189	73.7 Å²	73.7	88%	0.883	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-37.2	175.5	-67.9	174	-171.9	0	0	110.6	C299	E297-C299 VanDerWaalsContact C-N 3.34Å; E297-C299 PolarHBondContact O-N 3.1Å
298	D	88.1	Confident	88.3	Confident	103 Å²	103	70.2 Å²	70.2	55%	0.551	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-31.5	-179.5	-49.3	-20.4	0	0	0	114.3	C296 M313 H316	C296-D298 PolarHBondContact SG-N 3.18Å; C296-D298 VanDerWaalsContact SG-N 3.43Å; D298-M313 WeakPolarHBondContact OD2-CE 3.46Å; D298-H316 WeakPolarHBondContact OD2-CB 3.43Å; D298-H316 IonicContact OD2-CD2 2.71Å; D298-H316 PolarHBondContact OD2-CD2 3.23Å; D298-H316 VanDerWaalsContact OD2-CD2 3.24Å; D298-H316 IonicContact OD2-CG 3.09Å
299	C	90.4	Very high	88.7	Confident	48 Å²	48	67.9 Å²	67.9	32%	0.324	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.3	9.5	-176.3	73	0	0	0	0	115.6	C296 E297 K301 H312 H316	C296-C299 PolarHBondContact SG-N 2.94Å; E297-C299 VanDerWaalsContact C-N 3.34Å; E297-C299 PolarHBondContact O-N 3.1Å; C299-K301 PolarHBondContact O-N 3.46Å; C299-H312 PolarHBondContact SG-NE2 3.3Å; C299-H316 PolarHBondContact SG-NE2 3.03Å
300	G	87.4	Confident	88.9	Confident	43 Å²	43	69 Å²	69	44%	0.443	39%	0.385	S	S	.	.			trans	66.8	-7.7	177.7	0	0	0	0	0	116.5	C295 C296 R302	C295-G300 PolarHBondContact SG-O 3.31Å; C296-G300 WeakPolarHBondContact O-CA 3.12Å; C296-G300 PolarHBondContact O-N 3.17Å; C296-G300 VanDerWaalsContact O-N 3.09Å; G300-R302 VanDerWaalsContact O-CG 3.31Å; G300-R302 WeakPolarHBondContact O-CG 3.34Å; G300-R302 PolarHBondContact O-N 3.12Å
301	K	89	Confident	89.2	Confident	90 Å²	90	72.7 Å²	72.7	39%	0.391	39%	0.385	S	S	.	.			trans	-61.9	131	-178.3	-65.9	178.3	-175.4	177.2	0	109.7	E187 C296 C299 F303	E187-K301 IonicContact OE1-NZ 2.69Å; E187-K301 PolarHBondContact OE1-NZ 2.84Å; E187-K301 IonicContact OE2-NZ 2.79Å; E187-K301 PolarHBondContact OE2-NZ 2.99Å; C296-K301 WeakPolarHBondContact CB-O 3.43Å; C296-K301 PolarHBondContact N-O 3.13Å; C299-K301 PolarHBondContact O-N 3.46Å; K301-F303 HydrophobicContact CB-CE2 4.39Å; K301-F303 HydrophobicContact CB-CZ 4.3Å; K301-F303 WeakPolarHBondContact O-CE2 3.29Å
302	R	89.8	Confident	89.4	Confident	143 Å²	143	70.6 Å²	70.6	54%	0.54	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	144.4	-169.4	-57.8	-176.5	62.4	148.4	0.5	114	K292 F294 C295 G300	K292-R302 HydrophobicContact CB-CB 3.71Å; K292-R302 HydrophobicContact CD-CB 4.23Å; K292-R302 WeakPolarHBondContact CD-O 3.25Å; K292-R302 PolarHBondContact O-NE 2.94Å; K292-R302 VanDerWaalsContact O-NE 3.07Å; K292-R302 PolarHBondContact O-NH2 3.18Å; F294-R302 CarbonylContact O-C 3.57Å; F294-R302 WeakPolarHBondContact O-CA 3.34Å; C295-R302 HydrophobicContact CB-CG 4.38Å; G300-R302 VanDerWaalsContact O-CG 3.31Å; G300-R302 WeakPolarHBondContact O-CG 3.34Å; G300-R302 PolarHBondContact O-N 3.12Å
303	F	88.1	Confident	89.3	Confident	41 Å²	41	67.5 Å²	67.5	18%	0.18	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.3	-171.6	-55	-85.3	0	0	0	113	K292 P293 F294 C296 K301 L309 H312	K292-F303 CarbonylContact C-O 3.2Å; K292-F303 VanDerWaalsContact C-O 3.25Å; K292-F303 VanDerWaalsContact CA-O 3.26Å; K292-F303 WeakPolarHBondContact CA-O 3.33Å; P293-F303 WeakPolarHBondContact CD-O 3.46Å; F294-F303 HydrophobicContact CB-CB 4.43Å; F294-F303 PolarHBondContact N-O 3.32Å; F294-F303 VanDerWaalsContact N-O 3.11Å; F294-F303 PolarHBondContact O-N 3.44Å; C296-F303 HydrophobicContact CB-CE2 4.41Å; K301-F303 HydrophobicContact CB-CE2 4.39Å; K301-F303 HydrophobicContact CB-CZ 4.3Å; K301-F303 WeakPolarHBondContact O-CE2 3.29Å; F303-L309 HydrophobicContact CB-CB 4.35Å; F303-L309 HydrophobicContact CD2-CB 3.81Å; F303-L309 HydrophobicContact CD2-CD1 3.78Å; F303-L309 HydrophobicContact CD2-CG 4.38Å; F303-L309 HydrophobicContact CE2-CD1 3.83Å; F303-L309 HydrophobicContact CG-CB 4.21Å; F303-H312 HydrophobicContact CE1-CB 4.02Å; F303-H312 HydrophobicContact CE2-CB 4.1Å; F303-H312 AromaticContact CE2-CD2 3.42Å; F303-H312 VanDerWaalsContact CE2-CD2 3.42Å; F303-H312 WeakPolarHBondContact CE2-CD2 3.42Å; F303-H312 AromaticContact CE2-CG 3.85Å; F303-H312 HydrophobicContact CZ-CB 3.53Å; F303-H312 AromaticContact CZ-CD2 3.39Å; F303-H312 WeakPolarHBondContact CZ-CD2 3.34Å; F303-H312 AromaticContact CZ-CG 3.35Å; F303-H312 AromaticContact CZ-ND1 3.93Å; F303-H312 AromaticContact CZ-NE2 3.95Å
304	S	88.6	Confident	89.4	Confident	35 Å²	35	67.5 Å²	67.5	25%	0.245	36%	0.355	C	S	.	.	S	Bend	trans	-79.5	-16.7	176.3	55.1	0	0	0	0	113.9	R286 E291	R286-S304 WeakPolarHBondContact CD-O 3.23Å; R286-S304 PolarHBondContact NH1-O 3.42Å; E291-S304 WeakPolarHBondContact O-CA 3.3Å; E291-S304 WeakPolarHBondContact O-CB 3.4Å
305	L	89.4	Confident	89.3	Confident	42 Å²	42	66.8 Å²	66.8	22%	0.22	37%	0.366	C	S	.	.	S	Bend	trans	-136.6	135.1	-177.7	-59.8	174.9	0	0	0	111.3	W201 K283 A307 S308 L309	W201-L305 HydrophobicContact CH2-CD1 4.4Å; K283-L305 HydrophobicContact CB-CD2 4.17Å; K283-L305 HydrophobicContact CD-CD2 4.41Å; K283-L305 HydrophobicContact CG-CD2 3.9Å; L305-A307 VanDerWaalsContact C-N 3.26Å; L305-A307 PolarHBondContact O-N 3.43Å; L305-S308 WeakPolarHBondContact O-CB 3.43Å; L305-S308 PolarHBondContact O-N 3.25Å; L305-L309 PolarHBondContact O-N 2.9Å
306	S	89.2	Confident	89.2	Confident	51 Å²	51	68.2 Å²	68.2	36%	0.357	37%	0.368	S	S	.	.	H	α-helix	trans	-58.7	-35.1	174.7	160.7	0	0	0	0	112.7	F294 S308 L309 N310	F294-S306 VanDerWaalsContact CD2-N 3.3Å; F294-S306 VanDerWaalsContact CE2-N 3.32Å; S306-S308 PolarHBondContact O-N 2.91Å; S306-L309 PolarHBondContact O-N 3.21Å; S306-N310 WeakPolarHBondContact O-CB 3.4Å; S306-N310 VanDerWaalsContact O-CG 3.29Å; S306-N310 PolarHBondContact O-N 2.88Å; S306-N310 PolarHBondContact O-OD1 3.42Å
307	A	87.3	Confident	89.1	Confident	74 Å²	74	72.9 Å²	72.9	61%	0.612	40%	0.396	S	S	*	.	H	α-helix	trans	-61.9	-32	175.4	0	0	0	0	0	112.9	L305 R311	L305-A307 VanDerWaalsContact C-N 3.26Å; L305-A307 PolarHBondContact O-N 3.43Å; A307-R311 VanDerWaalsContact O-CB 3.29Å; A307-R311 WeakPolarHBondContact O-CB 3.28Å; A307-R311 PolarHBondContact O-N 2.57Å
308	S	89.2	Confident	89	Confident	30 Å²	30	65.7 Å²	65.7	21%	0.21	37%	0.372	C	S	.	.	H	α-helix	trans	-75	-38.3	175.5	-54.9	0	0	0	0	111.8	L305 S306 R311 H312	L305-S308 WeakPolarHBondContact O-CB 3.43Å; L305-S308 PolarHBondContact O-N 3.25Å; S306-S308 PolarHBondContact O-N 2.91Å; S308-R311 WeakPolarHBondContact O-CB 3.45Å; S308-R311 PolarHBondContact O-N 3.09Å; S308-H312 WeakPolarHBondContact O-CB 3.49Å; S308-H312 PolarHBondContact O-N 2.97Å
309	L	90.4	Very high	89.1	Confident	22 Å²	22	65.1 Å²	65.1	12%	0.115	37%	0.366	C	S	.	.	H	α-helix	trans	-60.6	-53.3	170.4	172.8	59.7	0	0	0	110.7	F294 C295 C296 F303 L305 S306 R311 H312 M313	F294-L309 HydrophobicContact CB-CB 4.27Å; F294-L309 HydrophobicContact CB-CD2 3.92Å; C295-L309 VanDerWaalsContact O-CD2 3.25Å; C295-L309 WeakPolarHBondContact O-CD2 3.33Å; C296-L309 HydrophobicContact CB-CD1 3.89Å; F303-L309 HydrophobicContact CB-CB 4.35Å; F303-L309 HydrophobicContact CD2-CB 3.81Å; F303-L309 HydrophobicContact CD2-CD1 3.78Å; F303-L309 HydrophobicContact CD2-CG 4.38Å; F303-L309 HydrophobicContact CE2-CD1 3.83Å; F303-L309 HydrophobicContact CG-CB 4.21Å; L305-L309 PolarHBondContact O-N 2.9Å; S306-L309 PolarHBondContact O-N 3.21Å; L309-R311 PolarHBondContact O-N 3.36Å; L309-H312 CarbonylContact O-C 3.21Å; L309-H312 WeakPolarHBondContact O-CA 3.38Å; L309-H312 WeakPolarHBondContact O-CB 3.41Å; L309-H312 PolarHBondContact O-N 3.11Å; L309-M313 HydrophobicContact CD1-CG 4.11Å; L309-M313 HydrophobicContact CD1-SD 3.64Å; L309-M313 HydrophobicContact CG-CG 4.37Å; L309-M313 HydrophobicContact CG-SD 4.47Å; L309-M313 WeakPolarHBondContact O-CG 3.46Å; L309-M313 PolarHBondContact O-N 3.34Å
310	N	88.6	Confident	89.2	Confident	96 Å²	96	67.6 Å²	67.6	51%	0.513	37%	0.372	S	S	.	.	H	α-helix	trans	-59.8	-31.2	179.5	-66	-0.5	0	0	0	112.5	S306	S306-N310 WeakPolarHBondContact O-CB 3.4Å; S306-N310 VanDerWaalsContact O-CG 3.29Å; S306-N310 PolarHBondContact O-N 2.88Å; S306-N310 PolarHBondContact O-OD1 3.42Å
311	R	89.5	Confident	89.4	Confident	125 Å²	125	67.7 Å²	67.7	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-67.4	-40.6	171.2	177.5	175.7	83.7	172.7	12.3	112.1	A307 S308 L309 R314 L333	A307-R311 VanDerWaalsContact O-CB 3.29Å; A307-R311 WeakPolarHBondContact O-CB 3.28Å; A307-R311 PolarHBondContact O-N 2.57Å; S308-R311 WeakPolarHBondContact O-CB 3.45Å; S308-R311 PolarHBondContact O-N 3.09Å; L309-R311 PolarHBondContact O-N 3.36Å; R311-R314 WeakPolarHBondContact O-CB 3.31Å; R311-R314 PolarHBondContact O-N 3.08Å; R311-L333 HydrophobicContact CG-CD2 4.1Å
312	H	90.3	Very high	89.6	Confident	46 Å²	46	66.3 Å²	66.3	21%	0.213	36%	0.359	C	S	.	.	H	α-helix	trans	-71.8	-36.9	178.3	162.8	73.6	0	0	0	112.9	C299 F303 S308 L309 R314 G315 H316	C299-H312 PolarHBondContact SG-NE2 3.3Å; F303-H312 HydrophobicContact CE1-CB 4.02Å; F303-H312 HydrophobicContact CE2-CB 4.1Å; F303-H312 AromaticContact CE2-CD2 3.42Å; F303-H312 VanDerWaalsContact CE2-CD2 3.42Å; F303-H312 WeakPolarHBondContact CE2-CD2 3.42Å; F303-H312 AromaticContact CE2-CG 3.85Å; F303-H312 HydrophobicContact CZ-CB 3.53Å; F303-H312 AromaticContact CZ-CD2 3.39Å; F303-H312 WeakPolarHBondContact CZ-CD2 3.34Å; F303-H312 AromaticContact CZ-CG 3.35Å; F303-H312 AromaticContact CZ-ND1 3.93Å; F303-H312 AromaticContact CZ-NE2 3.95Å; S308-H312 WeakPolarHBondContact O-CB 3.49Å; S308-H312 PolarHBondContact O-N 2.97Å; L309-H312 CarbonylContact O-C 3.21Å; L309-H312 WeakPolarHBondContact O-CA 3.38Å; L309-H312 WeakPolarHBondContact O-CB 3.41Å; L309-H312 PolarHBondContact O-N 3.11Å; H312-R314 PolarHBondContact O-N 2.88Å; H312-G315 PolarHBondContact O-N 2.96Å; H312-H316 AromaticContact CE1-NE2 3.53Å; H312-H316 AromaticContact NE2-NE2 3.34Å; H312-H316 PolarHBondContact NE2-NE2 2.84Å
313	M	89.3	Confident	89.7	Confident	49 Å²	49	61 Å²	61	24%	0.241	35%	0.348	C	S	.	.	H	α-helix	trans	-58.9	-18.2	174.6	-57.2	-47.7	-69.4	0	0	113.5	C296 D298 L309 G315 H316 T317	C296-M313 HydrophobicContact CB-SD 4.19Å; D298-M313 WeakPolarHBondContact OD2-CE 3.46Å; L309-M313 HydrophobicContact CD1-CG 4.11Å; L309-M313 HydrophobicContact CD1-SD 3.64Å; L309-M313 HydrophobicContact CG-CG 4.37Å; L309-M313 HydrophobicContact CG-SD 4.47Å; L309-M313 WeakPolarHBondContact O-CG 3.46Å; L309-M313 PolarHBondContact O-N 3.34Å; M313-G315 PolarHBondContact O-N 2.91Å; M313-H316 PolarHBondContact O-N 2.85Å; M313-T317 WeakPolarHBondContact O-CB 3.3Å; M313-T317 WeakPolarHBondContact O-CG2 3.46Å; M313-T317 PolarHBondContact O-N 3.15Å; M313-T317 PolarHBondContact O-OG1 2.87Å
314	R	90.9	Very high	90	Very high	63 Å²	63	59.1 Å²	59.1	24%	0.238	34%	0.34	C	S	.	.	H	α-helix	trans	-68.5	-16.7	170.5	-63.1	-167	165	134.1	11.7	114.3	R311 H312 T317 G318 E319 T332	R311-R314 WeakPolarHBondContact O-CB 3.31Å; R311-R314 PolarHBondContact O-N 3.08Å; H312-R314 PolarHBondContact O-N 2.88Å; R314-T317 WeakPolarHBondContact CA-OG1 3.43Å; R314-G318 CarbonylContact O-C 3.59Å; R314-G318 WeakPolarHBondContact O-CA 3.35Å; R314-G318 PolarHBondContact O-N 3.21Å; R314-E319 HydrophobicContact CB-CB 4.38Å; R314-E319 WeakPolarHBondContact CB-O 3.37Å; R314-E319 HydrophobicContact CG-CB 4.15Å; R314-E319 IonicContact CZ-OE2 3.48Å; R314-E319 IonicContact NE-OE2 2.69Å; R314-E319 PolarHBondContact NE-OE2 3.11Å; R314-E319 IonicContact NH2-OE2 3.41Å; R314-E319 PolarHBondContact NH2-OE2 2.89Å; R314-E319 PolarHBondContact O-N 3.05Å; R314-T332 HydrophobicContact CB-CG2 4.02Å; R314-T332 PolarHBondContact NH1-O 2.56Å
315	G	87.4	Confident	90.2	Very high	54 Å²	54	65.1 Å²	65.1	56%	0.557	37%	0.369	S	S	*	.	H	α-helix	trans	-66.3	-66.1	166.8	0	0	0	0	0	109.7	H312 M313 T317 G318	H312-G315 PolarHBondContact O-N 2.96Å; M313-G315 PolarHBondContact O-N 2.91Å; G315-T317 PolarHBondContact O-N 2.91Å; G315-G318 PolarHBondContact O-N 2.87Å
316	H	88.3	Confident	90.4	Very high	88 Å²	88	67.5 Å²	67.5	41%	0.407	39%	0.385	S	S	.	.	H	α-helix	trans	-55.5	-46.4	-179	-57.6	-54.8	0	0	0	113.5	C296 D298 C299 H312 M313 G318	C296-H316 PolarHBondContact SG-NE2 3.08Å; C296-H316 VanDerWaalsContact SG-NE2 3.44Å; D298-H316 WeakPolarHBondContact OD2-CB 3.43Å; D298-H316 IonicContact OD2-CD2 2.71Å; D298-H316 PolarHBondContact OD2-CD2 3.23Å; D298-H316 VanDerWaalsContact OD2-CD2 3.24Å; D298-H316 IonicContact OD2-CG 3.09Å; C299-H316 PolarHBondContact SG-NE2 3.03Å; H312-H316 AromaticContact CE1-NE2 3.53Å; H312-H316 AromaticContact NE2-NE2 3.34Å; H312-H316 PolarHBondContact NE2-NE2 2.84Å; M313-H316 PolarHBondContact O-N 2.85Å; H316-G318 VanDerWaalsContact C-N 3.28Å; H316-G318 PolarHBondContact O-N 3.42Å
317	T	88.9	Confident	90.6	Very high	99 Å²	99	67.2 Å²	67.2	61%	0.607	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-9.3	177.8	57.4	0	0	0	0	114.2	M313 R314 G315 E319	M313-T317 WeakPolarHBondContact O-CB 3.3Å; M313-T317 WeakPolarHBondContact O-CG2 3.46Å; M313-T317 PolarHBondContact O-N 3.15Å; M313-T317 PolarHBondContact O-OG1 2.87Å; R314-T317 WeakPolarHBondContact CA-OG1 3.43Å; G315-T317 PolarHBondContact O-N 2.91Å; T317-E319 PolarHBondContact O-N 2.87Å; T317-E319 VanDerWaalsContact O-N 3.12Å
318	G	89	Confident	90.7	Very high	37 Å²	37	66.5 Å²	66.5	38%	0.381	38%	0.383	S	S	.	.			trans	63.5	7.9	-172.3	0	0	0	0	0	115.4	R314 G315 H316 K320	R314-G318 CarbonylContact O-C 3.59Å; R314-G318 WeakPolarHBondContact O-CA 3.35Å; R314-G318 PolarHBondContact O-N 3.21Å; G315-G318 PolarHBondContact O-N 2.87Å; H316-G318 VanDerWaalsContact C-N 3.28Å; H316-G318 PolarHBondContact O-N 3.42Å; G318-K320 WeakPolarHBondContact O-CG 3.35Å; G318-K320 PolarHBondContact O-N 3.46Å; G318-K320 VanDerWaalsContact O-N 3.12Å
319	E	91.1	Very high	90.9	Very high	92 Å²	92	69.7 Å²	69.7	43%	0.43	39%	0.393	S	S	.	.			trans	-61.5	114.1	-173	-165.1	-151.9	-173.2	0	0	111.4	R314 T317 P321	R314-E319 HydrophobicContact CB-CB 4.38Å; R314-E319 WeakPolarHBondContact CB-O 3.37Å; R314-E319 HydrophobicContact CG-CB 4.15Å; R314-E319 IonicContact CZ-OE2 3.48Å; R314-E319 IonicContact NE-OE2 2.69Å; R314-E319 PolarHBondContact NE-OE2 3.11Å; R314-E319 IonicContact NH2-OE2 3.41Å; R314-E319 PolarHBondContact NH2-OE2 2.89Å; R314-E319 PolarHBondContact O-N 3.05Å; T317-E319 PolarHBondContact O-N 2.87Å; T317-E319 VanDerWaalsContact O-N 3.12Å; E319-P321 HydrophobicContact CG-CG 4.1Å; E319-P321 WeakPolarHBondContact O-CD 3.29Å
320	K	91.9	Very high	91	Very high	100 Å²	100	76.2 Å²	76.2	44%	0.435	42%	0.416	S	S	.	.			trans	-121	81.8	178.9	-72.9	161.1	-172.7	171.2	0	109.6	G318 F322 R330 F331 T332	G318-K320 WeakPolarHBondContact O-CG 3.35Å; G318-K320 PolarHBondContact O-N 3.46Å; G318-K320 VanDerWaalsContact O-N 3.12Å; K320-F322 VanDerWaalsContact C-N 3.31Å; K320-F322 PolarHBondContact O-N 2.86Å; K320-R330 HydrophobicContact CB-CB 3.65Å; K320-R330 VanDerWaalsContact O-CZ 3.29Å; K320-R330 PolarHBondContact O-NE 2.85Å; K320-R330 PolarHBondContact O-NH2 3.41Å; K320-F331 CarbonylContact C-O 3.55Å; K320-F331 VanDerWaalsContact C-O 3.26Å; K320-F331 WeakPolarHBondContact CA-O 3.44Å; K320-T332 HydrophobicContact CG-CG2 3.85Å
321	P	90.9	Very high	91.1	Very high	44 Å²	44	73.7 Å²	73.7	29%	0.286	40%	0.401	S	S	.	.			trans	-64.6	-32.2	-172.4	-22.6	33.6	0	0	0	113.9	E319 G323 F331	E319-P321 HydrophobicContact CG-CG 4.1Å; E319-P321 WeakPolarHBondContact O-CD 3.29Å; P321-G323 PolarHBondContact O-N 3.23Å; P321-F331 WeakPolarHBondContact CD-O 3.37Å
322	F	93.9	Very high	91.2	Very high	62 Å²	62	69.5 Å²	69.5	27%	0.272	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	100.1	-165.5	-55.6	-76	0	0	0	110.7	K320 R330 F331 T332 N334 L337	K320-F322 VanDerWaalsContact C-N 3.31Å; K320-F322 PolarHBondContact O-N 2.86Å; F322-R330 CarbonylContact O-C 3.26Å; F322-R330 WeakPolarHBondContact O-CA 3.42Å; F322-F331 HydrophobicContact CB-CB 4.41Å; F322-F331 PolarHBondContact N-O 3.48Å; F322-F331 VanDerWaalsContact N-O 3.1Å; F322-F331 PolarHBondContact O-N 3.28Å; F322-T332 WeakPolarHBondContact CE2-O 3.38Å; F322-N334 HydrophobicContact CD1-CB 3.8Å; F322-N334 HydrophobicContact CD2-CB 4.45Å; F322-N334 HydrophobicContact CE1-CB 3.77Å; F322-N334 HydrophobicContact CE2-CB 4.42Å; F322-N334 HydrophobicContact CG-CB 4.16Å; F322-N334 HydrophobicContact CZ-CB 4.09Å; F322-L337 HydrophobicContact CB-CB 4.1Å; F322-L337 HydrophobicContact CB-CD2 3.85Å
323	G	91.8	Very high	91.2	Very high	30 Å²	30	69 Å²	69	31%	0.309	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	149.2	177.8	0	0	0	0	0	113.8	P321 L337	P321-G323 PolarHBondContact O-N 3.23Å; G323-L337 WeakPolarHBondContact O-CD1 3.31Å; G323-L337 WeakPolarHBondContact O-CD2 3.42Å
324	C	94.1	Very high	91.2	Very high	3 Å²	3	69.9 Å²	69.9	2%	0.02	39%	0.393	C	S	.	.			trans	-98.8	112.4	167.5	175.2	0	0	0	0	109.9	V326 C327 G328 K329 F331 L337 M341 H344	C324-V326 PolarHBondContact O-N 3.42Å; C324-C327 PolarHBondContact O-N 2.68Å; C324-G328 WeakPolarHBondContact O-CA 3.49Å; C324-G328 PolarHBondContact O-N 2.24Å; C324-K329 WeakPolarHBondContact CB-O 3.22Å; C324-K329 PolarHBondContact N-O 2.77Å; C324-F331 HydrophobicContact CB-CE2 4.28Å; C324-L337 HydrophobicContact CB-CD1 3.7Å; C324-M341 HydrophobicContact CB-SD 4.32Å; C324-M341 PolarHBondContact SG-SD 3.38Å; C324-H344 PolarHBondContact SG-NE2 2.92Å
325	D	93.1	Very high	91.1	Very high	160 Å²	160	69.9 Å²	69.9	86%	0.856	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-22	-175.3	-50.4	-51.6	0	0	0	113.5
326	V	93.3	Very high	91.3	Very high	92 Å²	92	71 Å²	71	56%	0.558	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-29.5	-177.1	-177.3	0	0	0	0	112.7	C324 M341 H344	C324-V326 PolarHBondContact O-N 3.42Å; V326-M341 HydrophobicContact CG2-CE 4Å; V326-H344 HydrophobicContact CG1-CB 4.19Å; V326-H344 HydrophobicContact CG2-CB 4.49Å
327	C	92.5	Very high	91.5	Very high	46 Å²	46	67.9 Å²	67.9	31%	0.311	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.1	14	-175.5	76.6	0	0	0	0	115.3	C324 K329 H340 H344	C324-C327 PolarHBondContact O-N 2.68Å; C327-K329 PolarHBondContact O-N 2.84Å; C327-H340 PolarHBondContact SG-NE2 2.95Å; C327-H340 VanDerWaalsContact SG-NE2 3.42Å; C327-H344 WeakPolarHBondContact CB-CE1 3.44Å; C327-H344 PolarHBondContact SG-CE1 2.95Å; C327-H344 PolarHBondContact SG-NE2 3.1Å
328	G	90.5	Very high	91.6	Very high	59 Å²	59	69.6 Å²	69.6	61%	0.608	38%	0.378	S	S	*	.			trans	67.6	-4.5	176.2	0	0	0	0	0	116.3	C324 R330	C324-G328 WeakPolarHBondContact O-CA 3.49Å; C324-G328 PolarHBondContact O-N 2.24Å; G328-R330 PolarHBondContact O-N 2.97Å
329	K	92.7	Very high	91.7	Very high	97 Å²	97	69.8 Å²	69.8	42%	0.422	37%	0.372	S	S	.	.			trans	-65.3	134.3	-179	-72.1	-173.1	179.2	-168.5	0	110.6	C324 C327 F331	C324-K329 WeakPolarHBondContact CB-O 3.22Å; C324-K329 PolarHBondContact N-O 2.77Å; C327-K329 PolarHBondContact O-N 2.84Å; K329-F331 HydrophobicContact CB-CE2 4Å; K329-F331 HydrophobicContact CB-CZ 4.07Å; K329-F331 WeakPolarHBondContact O-CE2 3.47Å
330	R	92.5	Very high	91.7	Very high	158 Å²	158	66.6 Å²	66.6	60%	0.596	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	143.7	-176.8	-57.3	-177.2	62.7	150.4	0.4	111.4	K320 F322 G328	K320-R330 HydrophobicContact CB-CB 3.65Å; K320-R330 VanDerWaalsContact O-CZ 3.29Å; K320-R330 PolarHBondContact O-NE 2.85Å; K320-R330 PolarHBondContact O-NH2 3.41Å; F322-R330 CarbonylContact O-C 3.26Å; F322-R330 WeakPolarHBondContact O-CA 3.42Å; G328-R330 PolarHBondContact O-N 2.97Å
331	F	91.3	Very high	91.7	Very high	44 Å²	44	64.6 Å²	64.6	19%	0.193	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	149.1	-174.3	-58	-89.1	0	0	0	111.4	K320 P321 F322 C324 K329 L333 H336 L337 H340	K320-F331 CarbonylContact C-O 3.55Å; K320-F331 VanDerWaalsContact C-O 3.26Å; K320-F331 WeakPolarHBondContact CA-O 3.44Å; P321-F331 WeakPolarHBondContact CD-O 3.37Å; F322-F331 HydrophobicContact CB-CB 4.41Å; F322-F331 PolarHBondContact N-O 3.48Å; F322-F331 VanDerWaalsContact N-O 3.1Å; F322-F331 PolarHBondContact O-N 3.28Å; C324-F331 HydrophobicContact CB-CE2 4.28Å; K329-F331 HydrophobicContact CB-CE2 4Å; K329-F331 HydrophobicContact CB-CZ 4.07Å; K329-F331 WeakPolarHBondContact O-CE2 3.47Å; F331-L333 VanDerWaalsContact C-N 3.26Å; F331-H336 HydrophobicContact CB-CB 4.32Å; F331-H336 HydrophobicContact CD1-CB 3.99Å; F331-H336 HydrophobicContact CG-CB 4.41Å; F331-L337 HydrophobicContact CB-CB 4.45Å; F331-L337 HydrophobicContact CD2-CB 3.94Å; F331-L337 HydrophobicContact CD2-CD1 3.93Å; F331-L337 HydrophobicContact CE2-CD1 4.04Å; F331-L337 HydrophobicContact CG-CB 4.35Å; F331-H340 HydrophobicContact CE1-CB 4.04Å; F331-H340 HydrophobicContact CE2-CB 4.02Å; F331-H340 AromaticContact CE2-CD2 3.5Å; F331-H340 AromaticContact CE2-CG 3.84Å; F331-H340 HydrophobicContact CZ-CB 3.54Å; F331-H340 AromaticContact CZ-CD2 3.41Å; F331-H340 VanDerWaalsContact CZ-CD2 3.41Å; F331-H340 WeakPolarHBondContact CZ-CD2 3.08Å; F331-H340 AromaticContact CZ-CG 3.33Å; F331-H340 AromaticContact CZ-ND1 3.99Å
332	T	91.1	Very high	91.8	Very high	37 Å²	37	65.4 Å²	65.4	23%	0.227	35%	0.348	C	S	.	.	S	Bend	trans	-71.4	-21.5	173.3	52.2	0	0	0	0	112.5	R314 K320 F322	R314-T332 HydrophobicContact CB-CG2 4.02Å; R314-T332 PolarHBondContact NH1-O 2.56Å; K320-T332 HydrophobicContact CG-CG2 3.85Å; F322-T332 WeakPolarHBondContact CE2-O 3.38Å
333	L	90.1	Very high	91.7	Very high	35 Å²	35	65.3 Å²	65.3	18%	0.183	35%	0.352	C	S	.	.			trans	-134.2	141.7	-176.4	-67.9	177.4	0	0	0	113.8	R311 F331 S335 H336 L337	R311-L333 HydrophobicContact CG-CD2 4.1Å; F331-L333 VanDerWaalsContact C-N 3.26Å; L333-S335 VanDerWaalsContact C-N 3.34Å; L333-S335 PolarHBondContact O-N 3Å; L333-H336 HydrophobicContact CB-CB 4.33Å; L333-H336 PolarHBondContact O-N 3.27Å; L333-L337 PolarHBondContact O-N 3.24Å; L333-L337 VanDerWaalsContact O-N 3.12Å
334	N	89.9	Confident	91.7	Very high	68 Å²	68	67.5 Å²	67.5	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-67	-31.3	174.7	-167.1	4	0	0	0	112.6	F322 H336 L337 K338	F322-N334 HydrophobicContact CD1-CB 3.8Å; F322-N334 HydrophobicContact CD2-CB 4.45Å; F322-N334 HydrophobicContact CE1-CB 3.77Å; F322-N334 HydrophobicContact CE2-CB 4.42Å; F322-N334 HydrophobicContact CG-CB 4.16Å; F322-N334 HydrophobicContact CZ-CB 4.09Å; N334-H336 VanDerWaalsContact C-N 3.29Å; N334-H336 PolarHBondContact O-N 2.8Å; N334-L337 PolarHBondContact O-N 3.35Å; N334-K338 WeakPolarHBondContact O-CB 3.4Å; N334-K338 WeakPolarHBondContact O-CG 3.41Å; N334-K338 PolarHBondContact O-N 3.37Å
335	S	89.2	Confident	91.5	Very high	62 Å²	62	71.2 Å²	71.2	43%	0.434	38%	0.377	S	S	.	.	H	α-helix	trans	-60.4	-39.4	172	46.6	0	0	0	0	111.9	L333 T339	L333-S335 VanDerWaalsContact C-N 3.34Å; L333-S335 PolarHBondContact O-N 3Å; S335-T339 WeakPolarHBondContact O-CB 3.31Å; S335-T339 PolarHBondContact O-N 2.93Å; S335-T339 PolarHBondContact O-OG1 3.4Å
336	H	91.4	Very high	91.4	Very high	77 Å²	77	66 Å²	66	36%	0.356	36%	0.361	S	S	.	.	H	α-helix	trans	-74.7	-40.3	-179	-63.6	-164	0	0	0	110	F331 L333 N334 T339 H340	F331-H336 HydrophobicContact CB-CB 4.32Å; F331-H336 HydrophobicContact CD1-CB 3.99Å; F331-H336 HydrophobicContact CG-CB 4.41Å; L333-H336 HydrophobicContact CB-CB 4.33Å; L333-H336 PolarHBondContact O-N 3.27Å; N334-H336 VanDerWaalsContact C-N 3.29Å; N334-H336 PolarHBondContact O-N 2.8Å; H336-T339 PolarHBondContact O-N 3.4Å; H336-H340 VanDerWaalsContact O-CB 3.28Å; H336-H340 WeakPolarHBondContact O-CB 3.39Å; H336-H340 PolarHBondContact O-N 2.92Å
337	L	92.4	Very high	91.3	Very high	23 Å²	23	66.7 Å²	66.7	12%	0.12	36%	0.358	C	S	.	.	H	α-helix	trans	-57.6	-52.9	168.8	174.3	60.7	0	0	0	111.8	F322 G323 C324 F331 L333 N334 T339 H340 M341	F322-L337 HydrophobicContact CB-CB 4.1Å; F322-L337 HydrophobicContact CB-CD2 3.85Å; G323-L337 WeakPolarHBondContact O-CD1 3.31Å; G323-L337 WeakPolarHBondContact O-CD2 3.42Å; C324-L337 HydrophobicContact CB-CD1 3.7Å; F331-L337 HydrophobicContact CB-CB 4.45Å; F331-L337 HydrophobicContact CD2-CB 3.94Å; F331-L337 HydrophobicContact CD2-CD1 3.93Å; F331-L337 HydrophobicContact CE2-CD1 4.04Å; F331-L337 HydrophobicContact CG-CB 4.35Å; L333-L337 PolarHBondContact O-N 3.24Å; L333-L337 VanDerWaalsContact O-N 3.12Å; N334-L337 PolarHBondContact O-N 3.35Å; L337-T339 VanDerWaalsContact C-N 3.26Å; L337-T339 PolarHBondContact O-N 3.41Å; L337-H340 CarbonylContact O-C 3.53Å; L337-H340 WeakPolarHBondContact O-CA 3.49Å; L337-H340 WeakPolarHBondContact O-CB 3.24Å; L337-H340 PolarHBondContact O-N 2.75Å; L337-M341 HydrophobicContact CD1-CG 4.22Å; L337-M341 HydrophobicContact CD1-SD 4.06Å; L337-M341 WeakPolarHBondContact O-CG 3.17Å; L337-M341 PolarHBondContact O-N 3.48Å
338	K	90.7	Very high	91.3	Very high	135 Å²	135	67.9 Å²	67.9	59%	0.587	36%	0.358	S	S	*	.	H	α-helix	trans	-57.7	-38.2	179.1	-76	178.9	179.1	-174.1	0	112.7	N334	N334-K338 WeakPolarHBondContact O-CB 3.4Å; N334-K338 WeakPolarHBondContact O-CG 3.41Å; N334-K338 PolarHBondContact O-N 3.37Å
339	T	91.2	Very high	91.3	Very high	41 Å²	41	68.1 Å²	68.1	25%	0.252	35%	0.349	S	S	.	.	H	α-helix	trans	-72.1	-37.6	176.2	-56.9	0	0	0	0	111.3	S335 H336 L337 R342 Q361	S335-T339 WeakPolarHBondContact O-CB 3.31Å; S335-T339 PolarHBondContact O-N 2.93Å; S335-T339 PolarHBondContact O-OG1 3.4Å; H336-T339 PolarHBondContact O-N 3.4Å; L337-T339 VanDerWaalsContact C-N 3.26Å; L337-T339 PolarHBondContact O-N 3.41Å; T339-R342 WeakPolarHBondContact O-CB 3.22Å; T339-R342 PolarHBondContact O-N 3.23Å; T339-Q361 HydrophobicContact CG2-CG 3.75Å
340	H	91.9	Very high	91.4	Very high	26 Å²	26	66.1 Å²	66.1	12%	0.12	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-35.9	173.1	174.9	60.1	0	0	0	112.9	C327 F331 H336 L337 R342 V343 H344	C327-H340 PolarHBondContact SG-NE2 2.95Å; C327-H340 VanDerWaalsContact SG-NE2 3.42Å; F331-H340 HydrophobicContact CE1-CB 4.04Å; F331-H340 HydrophobicContact CE2-CB 4.02Å; F331-H340 AromaticContact CE2-CD2 3.5Å; F331-H340 AromaticContact CE2-CG 3.84Å; F331-H340 HydrophobicContact CZ-CB 3.54Å; F331-H340 AromaticContact CZ-CD2 3.41Å; F331-H340 VanDerWaalsContact CZ-CD2 3.41Å; F331-H340 WeakPolarHBondContact CZ-CD2 3.08Å; F331-H340 AromaticContact CZ-CG 3.33Å; F331-H340 AromaticContact CZ-ND1 3.99Å; H336-H340 VanDerWaalsContact O-CB 3.28Å; H336-H340 WeakPolarHBondContact O-CB 3.39Å; H336-H340 PolarHBondContact O-N 2.92Å; L337-H340 CarbonylContact O-C 3.53Å; L337-H340 WeakPolarHBondContact O-CA 3.49Å; L337-H340 WeakPolarHBondContact O-CB 3.24Å; L337-H340 PolarHBondContact O-N 2.75Å; H340-R342 PolarHBondContact O-N 2.05Å; H340-V343 WeakPolarHBondContact O-CB 3.32Å; H340-V343 WeakPolarHBondContact O-CG2 3.49Å; H340-V343 PolarHBondContact O-N 2.85Å; H340-H344 AromaticContact CD2-NE2 3.18Å; H340-H344 PolarHBondContact CD2-NE2 3.41Å; H340-H344 AromaticContact CE1-NE2 3.02Å; H340-H344 PolarHBondContact CE1-NE2 3.11Å; H340-H344 AromaticContact NE2-CD2 3.94Å; H340-H344 AromaticContact NE2-NE2 2.28Å; H340-H344 PolarHBondContact NE2-NE2 3.09Å
341	M	92.3	Very high	91.4	Very high	57 Å²	57	65.3 Å²	65.3	28%	0.281	34%	0.337	S	S	.	.	H	α-helix	trans	-58	-25.3	178.4	-68.9	-52.7	-66.3	0	0	113.2	C324 V326 L337 V343 H344 T345	C324-M341 HydrophobicContact CB-SD 4.32Å; C324-M341 PolarHBondContact SG-SD 3.38Å; V326-M341 HydrophobicContact CG2-CE 4Å; L337-M341 HydrophobicContact CD1-CG 4.22Å; L337-M341 HydrophobicContact CD1-SD 4.06Å; L337-M341 WeakPolarHBondContact O-CG 3.17Å; L337-M341 PolarHBondContact O-N 3.48Å; M341-V343 PolarHBondContact O-N 2.92Å; M341-H344 PolarHBondContact O-N 3.22Å; M341-T345 PolarHBondContact O-N 2.94Å; M341-T345 VanDerWaalsContact O-N 3.08Å; M341-T345 PolarHBondContact O-OG1 2.89Å
342	R	92.5	Very high	91.5	Very high	62 Å²	62	63.2 Å²	63.2	23%	0.234	33%	0.328	C	S	.	.	H	α-helix	trans	-61.8	-20.8	172.7	-59.3	-173.7	-177.7	131.1	12.5	113.9	T339 H340 H344 G346 E347 S360	T339-R342 WeakPolarHBondContact O-CB 3.22Å; T339-R342 PolarHBondContact O-N 3.23Å; H340-R342 PolarHBondContact O-N 2.05Å; R342-H344 VanDerWaalsContact C-N 3.31Å; R342-G346 CarbonylContact O-C 3.26Å; R342-G346 WeakPolarHBondContact O-CA 3.48Å; R342-G346 PolarHBondContact O-N 3.21Å; R342-E347 HydrophobicContact CB-CB 4.19Å; R342-E347 HydrophobicContact CG-CB 4.02Å; R342-E347 PolarHBondContact O-N 2.15Å; R342-S360 WeakPolarHBondContact CD-O 3.36Å; R342-S360 PolarHBondContact NH1-O 3.25Å
343	V	91.6	Very high	91.6	Very high	60 Å²	60	68 Å²	68	36%	0.364	35%	0.352	S	S	.	.	H	α-helix	trans	-63.1	-39.7	170.2	170.6	0	0	0	0	111.3	S146 H340 M341	S146-V343 VanDerWaalsContact CB-CG2 3.48Å; H340-V343 WeakPolarHBondContact O-CB 3.32Å; H340-V343 WeakPolarHBondContact O-CG2 3.49Å; H340-V343 PolarHBondContact O-N 2.85Å; M341-V343 PolarHBondContact O-N 2.92Å
344	H	91.5	Very high	91.7	Very high	75 Å²	75	71.1 Å²	71.1	35%	0.347	37%	0.369	S	S	.	.	H	α-helix	trans	-88	-34.2	-175.2	-57.1	-62	0	0	0	112.2	C324 V326 C327 H340 M341 R342	C324-H344 PolarHBondContact SG-NE2 2.92Å; V326-H344 HydrophobicContact CG1-CB 4.19Å; V326-H344 HydrophobicContact CG2-CB 4.49Å; C327-H344 WeakPolarHBondContact CB-CE1 3.44Å; C327-H344 PolarHBondContact SG-CE1 2.95Å; C327-H344 PolarHBondContact SG-NE2 3.1Å; H340-H344 AromaticContact CD2-NE2 3.18Å; H340-H344 PolarHBondContact CD2-NE2 3.41Å; H340-H344 AromaticContact CE1-NE2 3.02Å; H340-H344 PolarHBondContact CE1-NE2 3.11Å; H340-H344 AromaticContact NE2-CD2 3.94Å; H340-H344 AromaticContact NE2-NE2 2.28Å; H340-H344 PolarHBondContact NE2-NE2 3.09Å; M341-H344 PolarHBondContact O-N 3.22Å; R342-H344 VanDerWaalsContact C-N 3.31Å
345	T	90.8	Very high	91.8	Very high	82 Å²	82	69.3 Å²	69.3	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-82.9	-14.6	175	63.1	0	0	0	0	113.6	M341 E347	M341-T345 PolarHBondContact O-N 2.94Å; M341-T345 VanDerWaalsContact O-N 3.08Å; M341-T345 PolarHBondContact O-OG1 2.89Å; T345-E347 PolarHBondContact O-N 3.31Å; T345-E347 WeakPolarHBondContact OG1-CB 3.06Å; T345-E347 WeakPolarHBondContact OG1-CG 3.37Å; T345-E347 PolarHBondContact OG1-N 3.38Å
346	G	90.1	Very high	91.9	Very high	50 Å²	50	74.9 Å²	74.9	52%	0.515	38%	0.38	S	S	.	.			trans	70.6	8.3	-172.9	0	0	0	0	0	114.3	R342 K348	R342-G346 CarbonylContact O-C 3.26Å; R342-G346 WeakPolarHBondContact O-CA 3.48Å; R342-G346 PolarHBondContact O-N 3.21Å; G346-K348 PolarHBondContact O-N 2.93Å
347	E	91.6	Very high	91.8	Very high	106 Å²	106	73.3 Å²	73.3	50%	0.495	38%	0.376	S	S	.	.			trans	-60.5	122.5	-176	-86.5	176.5	-151.2	0	0	112.8	R342 T345 P349	R342-E347 HydrophobicContact CB-CB 4.19Å; R342-E347 HydrophobicContact CG-CB 4.02Å; R342-E347 PolarHBondContact O-N 2.15Å; T345-E347 PolarHBondContact O-N 3.31Å; T345-E347 WeakPolarHBondContact OG1-CB 3.06Å; T345-E347 WeakPolarHBondContact OG1-CG 3.37Å; T345-E347 PolarHBondContact OG1-N 3.38Å; E347-P349 WeakPolarHBondContact O-CD 3.28Å
348	K	91.9	Very high	91.9	Very high	72 Å²	72	78.3 Å²	78.3	31%	0.313	39%	0.393	S	S	.	.			trans	-124.5	79	175.5	-73.6	153.2	165.9	-88.1	0	110.2	D148 G346 F350 R358 F359	D148-K348 WeakPolarHBondContact OD1-CE 3.38Å; D148-K348 IonicContact OD1-NZ 2.68Å; D148-K348 PolarHBondContact OD1-NZ 2.83Å; G346-K348 PolarHBondContact O-N 2.93Å; K348-F350 VanDerWaalsContact C-N 3.3Å; K348-F350 PolarHBondContact O-N 3.14Å; K348-R358 HydrophobicContact CB-CB 3.62Å; K348-R358 HydrophobicContact CD-CB 4.43Å; K348-R358 WeakPolarHBondContact CD-O 3.42Å; K348-R358 HydrophobicContact CG-CB 4.45Å; K348-R358 PolarHBondContact NZ-O 2.97Å; K348-R358 PolarHBondContact O-NE 2.94Å; K348-R358 PolarHBondContact O-NH2 2.8Å; K348-F359 CarbonylContact C-O 3.58Å; K348-F359 VanDerWaalsContact CA-O 3.25Å; K348-F359 WeakPolarHBondContact CA-O 3.37Å
349	P	91.2	Very high	91.9	Very high	64 Å²	64	72.1 Å²	72.1	42%	0.416	37%	0.367	S	S	.	.			trans	-65.2	-33.8	-174.7	-21.1	33.8	0	0	0	112.8	E347 F359	E347-P349 WeakPolarHBondContact O-CD 3.28Å; P349-F359 WeakPolarHBondContact CD-O 3.44Å
350	F	93.6	Very high	91.9	Very high	55 Å²	55	71.1 Å²	71.1	24%	0.241	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	114.3	-173.3	-51.9	-78.2	0	0	0	109.6	K348 R358 F359 R362 L365	K348-F350 VanDerWaalsContact C-N 3.3Å; K348-F350 PolarHBondContact O-N 3.14Å; F350-R358 CarbonylContact O-C 3.52Å; F350-R358 VanDerWaalsContact O-CA 3.31Å; F350-R358 WeakPolarHBondContact O-CA 3.36Å; F350-F359 HydrophobicContact CB-CB 4.32Å; F350-F359 PolarHBondContact N-O 2.83Å; F350-F359 PolarHBondContact O-N 3.23Å; F350-R362 HydrophobicContact CD1-CB 4.04Å; F350-R362 HydrophobicContact CE1-CB 3.85Å; F350-R362 HydrophobicContact CG-CB 4.47Å; F350-R362 HydrophobicContact CZ-CB 4.1Å; F350-L365 HydrophobicContact CB-CB 4.32Å; F350-L365 HydrophobicContact CB-CD2 3.96Å
351	R	93.5	Very high	91.8	Very high	141 Å²	141	73.8 Å²	73.8	53%	0.532	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	146.9	176.6	166.2	170.1	-178.4	172.7	3.5	109.9	R358 L365	R351-R358 HydrophobicContact CB-CG 4.25Å; R351-L365 VanDerWaalsContact O-CD2 3.25Å; R351-L365 WeakPolarHBondContact O-CD2 3.24Å
352	C	93.5	Very high	91.7	Very high	0 Å²	0	80.1 Å²	80.1	0%	0	40%	0.395	C	S	.	.			trans	-81.8	137	161.5	-175.5	0	0	0	0	110	C355 T357 F359 L365 H368 H372	C352-C355 CarbonylContact C-O 3.56Å; C352-C355 WeakPolarHBondContact CB-O 3.37Å; C352-C355 VanDerWaalsContact SG-SG 3.62Å; C352-T357 PolarHBondContact N-O 2.79Å; C352-F359 HydrophobicContact CB-CE2 4.3Å; C352-L365 HydrophobicContact CB-CD1 3.91Å; C352-H368 VanDerWaalsContact SG-CD2 3.59Å; C352-H368 PolarHBondContact SG-NE2 2.71Å; C352-H368 VanDerWaalsContact SG-NE2 3.38Å; C352-H372 PolarHBondContact SG-NE2 2.89Å
353	D	92.8	Very high	91.5	Very high	136 Å²	136	80.6 Å²	80.6	73%	0.727	41%	0.407	S	S	*	.	S	Bend	trans	-83	-35.3	178.9	-61.6	-47.9	0	0	0	111.1	C355	D353-C355 VanDerWaalsContact C-N 3.33Å; D353-C355 PolarHBondContact O-N 3.32Å
354	D	91.6	Very high	91.4	Very high	102 Å²	102	78.2 Å²	78.2	55%	0.545	39%	0.394	S	S	.	.	S	Bend	trans	-74.2	-15.9	178.1	-59.9	-34.8	0	0	0	114.2	M369 H372	D354-M369 WeakPolarHBondContact OD2-CE 3.34Å; D354-H372 HydrophobicContact CB-CB 4.4Å; D354-H372 WeakPolarHBondContact OD2-CB 3.48Å; D354-H372 IonicContact OD2-CD2 3.71Å; D354-H372 IonicContact OD2-CG 3.74Å
355	C	92.9	Very high	91.5	Very high	30 Å²	30	76 Å²	76	20%	0.203	39%	0.385	C	S	.	.	S	Bend	trans	-158	166.3	177.2	73.9	0	0	0	0	113.5	C352 D353 T357 H368 H372	C352-C355 CarbonylContact C-O 3.56Å; C352-C355 WeakPolarHBondContact CB-O 3.37Å; C352-C355 VanDerWaalsContact SG-SG 3.62Å; D353-C355 VanDerWaalsContact C-N 3.33Å; D353-C355 PolarHBondContact O-N 3.32Å; C355-T357 PolarHBondContact O-N 2.96Å; C355-T357 PolarHBondContact SG-OG1 2.92Å; C355-H368 PolarHBondContact SG-NE2 3.27Å; C355-H372 WeakPolarHBondContact CB-CE1 3.47Å; C355-H372 PolarHBondContact SG-CE1 2.75Å; C355-H372 PolarHBondContact SG-NE2 3.15Å
356	E	90.9	Very high	91.5	Very high	178 Å²	178	79.3 Å²	79.3	83%	0.832	39%	0.392	S	S	*	.	S	Bend	trans	-68.6	-0.2	-175.2	-57	-174.5	147.6	0	0	115.5
357	T	90.1	Very high	91.5	Very high	44 Å²	44	82.1 Å²	82.1	27%	0.27	39%	0.387	S	S	.	.			trans	-72.3	146.1	-177.2	69.6	0	0	0	0	112.7	C352 C355 F359 H368	C352-T357 PolarHBondContact N-O 2.79Å; C355-T357 PolarHBondContact O-N 2.96Å; C355-T357 PolarHBondContact SG-OG1 2.92Å; T357-F359 VanDerWaalsContact OG1-CE2 3.31Å; T357-F359 WeakPolarHBondContact OG1-CE2 3.41Å; T357-F359 WeakPolarHBondContact OG1-CZ 3.24Å; T357-H368 PolarHBondContact OG1-NE2 3.48Å
358	R	93.5	Very high	91.5	Very high	128 Å²	128	77.5 Å²	77.5	48%	0.483	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143.5	-178.3	-55.8	179.5	60.1	156	1.5	111.5	K348 F350 R351	K348-R358 HydrophobicContact CB-CB 3.62Å; K348-R358 HydrophobicContact CD-CB 4.43Å; K348-R358 WeakPolarHBondContact CD-O 3.42Å; K348-R358 HydrophobicContact CG-CB 4.45Å; K348-R358 PolarHBondContact NZ-O 2.97Å; K348-R358 PolarHBondContact O-NE 2.94Å; K348-R358 PolarHBondContact O-NH2 2.8Å; F350-R358 CarbonylContact O-C 3.52Å; F350-R358 VanDerWaalsContact O-CA 3.31Å; F350-R358 WeakPolarHBondContact O-CA 3.36Å; R351-R358 HydrophobicContact CB-CG 4.25Å
359	F	91.3	Very high	91.4	Very high	6 Å²	6	76.5 Å²	76.5	3%	0.026	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.9	-167.5	-58.4	-88.8	0	0	0	112	I150 K348 P349 F350 C352 T357 Q361 A364 L365 H368	I150-F359 HydrophobicContact CD1-CE1 3.87Å; I150-F359 HydrophobicContact CG1-CE1 3.93Å; K348-F359 CarbonylContact C-O 3.58Å; K348-F359 VanDerWaalsContact CA-O 3.25Å; K348-F359 WeakPolarHBondContact CA-O 3.37Å; P349-F359 WeakPolarHBondContact CD-O 3.44Å; F350-F359 HydrophobicContact CB-CB 4.32Å; F350-F359 PolarHBondContact N-O 2.83Å; F350-F359 PolarHBondContact O-N 3.23Å; C352-F359 HydrophobicContact CB-CE2 4.3Å; T357-F359 VanDerWaalsContact OG1-CE2 3.31Å; T357-F359 WeakPolarHBondContact OG1-CE2 3.41Å; T357-F359 WeakPolarHBondContact OG1-CZ 3.24Å; F359-Q361 VanDerWaalsContact C-N 3.28Å; F359-A364 HydrophobicContact CB-CB 4.27Å; F359-A364 HydrophobicContact CD1-CB 3.86Å; F359-A364 HydrophobicContact CG-CB 4.38Å; F359-L365 HydrophobicContact CB-CB 4.36Å; F359-L365 HydrophobicContact CD2-CB 3.89Å; F359-L365 HydrophobicContact CD2-CD1 3.77Å; F359-L365 HydrophobicContact CD2-CG 4.4Å; F359-L365 HydrophobicContact CE2-CD1 3.83Å; F359-L365 HydrophobicContact CG-CB 4.17Å; F359-H368 HydrophobicContact CE1-CB 3.81Å; F359-H368 HydrophobicContact CE2-CB 4.04Å; F359-H368 AromaticContact CE2-CD2 3.69Å; F359-H368 AromaticContact CE2-CG 3.84Å; F359-H368 HydrophobicContact CZ-CB 3.42Å; F359-H368 VanDerWaalsContact CZ-CB 3.42Å; F359-H368 AromaticContact CZ-CD2 3.59Å; F359-H368 AromaticContact CZ-CG 3.27Å; F359-H368 AromaticContact CZ-ND1 3.72Å
360	S	90.5	Very high	91.5	Very high	20 Å²	20	76.1 Å²	76.1	14%	0.14	35%	0.353	C	S	.	.	S	Bend	trans	-71.9	-19.9	173.3	53.7	0	0	0	0	113.1	D148 R342	D148-S360 PolarHBondContact OD2-OG 3.21Å; R342-S360 WeakPolarHBondContact CD-O 3.36Å; R342-S360 PolarHBondContact NH1-O 3.25Å
361	Q	90.6	Very high	91.4	Very high	82 Å²	82	77.5 Å²	77.5	38%	0.383	36%	0.362	S	S	.	.	S	Bend	trans	-139.7	150.4	-175	-59	-179.2	0.7	0	0	112.7	T339 F359 S363 A364 L365	T339-Q361 HydrophobicContact CG2-CG 3.75Å; F359-Q361 VanDerWaalsContact C-N 3.28Å; Q361-S363 PolarHBondContact OE1-OG 3.46Å; Q361-S363 VanDerWaalsContact OE1-OG 3.06Å; Q361-A364 HydrophobicContact CB-CB 4.26Å; Q361-L365 PolarHBondContact O-N 3.14Å
362	R	89.6	Confident	91.2	Very high	190 Å²	190	74.9 Å²	74.9	72%	0.717	36%	0.355	S	S	*	.	H	α-helix	trans	-68.8	-38.2	175.9	-178.6	-176.1	-83.3	173.1	-7	112.4	F350 A364 L365 K366	F350-R362 HydrophobicContact CD1-CB 4.04Å; F350-R362 HydrophobicContact CE1-CB 3.85Å; F350-R362 HydrophobicContact CG-CB 4.47Å; F350-R362 HydrophobicContact CZ-CB 4.1Å; R362-A364 VanDerWaalsContact C-N 3.35Å; R362-A364 PolarHBondContact O-N 3.33Å; R362-L365 PolarHBondContact O-N 2.86Å; R362-K366 PolarHBondContact O-N 3.04Å
363	S	88.6	Confident	91.1	Very high	71 Å²	71	78.7 Å²	78.7	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-56	-46.9	174.2	50.3	0	0	0	0	111.7	Q361 L365 K366 R367	Q361-S363 PolarHBondContact OE1-OG 3.46Å; Q361-S363 VanDerWaalsContact OE1-OG 3.06Å; S363-L365 PolarHBondContact O-N 3.01Å; S363-K366 PolarHBondContact O-N 2.87Å; S363-R367 WeakPolarHBondContact O-CB 3.44Å; S363-R367 PolarHBondContact O-N 3.45Å
364	A	90.4	Very high	90.9	Very high	11 Å²	11	74.3 Å²	74.3	9%	0.091	37%	0.366	C	S	.	.	H	α-helix	trans	-62.5	-38.5	176.6	0	0	0	0	0	112.6	F359 Q361 R362 H368	F359-A364 HydrophobicContact CB-CB 4.27Å; F359-A364 HydrophobicContact CD1-CB 3.86Å; F359-A364 HydrophobicContact CG-CB 4.38Å; Q361-A364 HydrophobicContact CB-CB 4.26Å; R362-A364 VanDerWaalsContact C-N 3.35Å; R362-A364 PolarHBondContact O-N 3.33Å; A364-H368 WeakPolarHBondContact O-CB 3.39Å; A364-H368 PolarHBondContact O-N 3.27Å
365	L	92.3	Very high	90.9	Very high	29 Å²	29	74 Å²	74	15%	0.152	36%	0.362	C	S	.	.	H	α-helix	trans	-65.1	-50.4	171.9	175	61.3	0	0	0	111.7	F350 R351 C352 F359 Q361 R362 S363 R367 H368 M369	F350-L365 HydrophobicContact CB-CB 4.32Å; F350-L365 HydrophobicContact CB-CD2 3.96Å; R351-L365 VanDerWaalsContact O-CD2 3.25Å; R351-L365 WeakPolarHBondContact O-CD2 3.24Å; C352-L365 HydrophobicContact CB-CD1 3.91Å; F359-L365 HydrophobicContact CB-CB 4.36Å; F359-L365 HydrophobicContact CD2-CB 3.89Å; F359-L365 HydrophobicContact CD2-CD1 3.77Å; F359-L365 HydrophobicContact CD2-CG 4.4Å; F359-L365 HydrophobicContact CE2-CD1 3.83Å; F359-L365 HydrophobicContact CG-CB 4.17Å; Q361-L365 PolarHBondContact O-N 3.14Å; R362-L365 PolarHBondContact O-N 2.86Å; S363-L365 PolarHBondContact O-N 3.01Å; L365-R367 PolarHBondContact O-N 2.75Å; L365-H368 CarbonylContact O-C 3.46Å; L365-H368 WeakPolarHBondContact O-CA 3.1Å; L365-H368 WeakPolarHBondContact O-CB 3.38Å; L365-H368 PolarHBondContact O-N 3.06Å; L365-M369 HydrophobicContact CD1-CG 4.36Å; L365-M369 HydrophobicContact CD1-SD 3.69Å; L365-M369 HydrophobicContact CG-SD 4.46Å; L365-M369 WeakPolarHBondContact O-CG 3.07Å; L365-M369 PolarHBondContact O-N 2.64Å
366	K	91.1	Very high	90.9	Very high	151 Å²	151	78.1 Å²	78.1	66%	0.657	38%	0.376	S	S	*	.	H	α-helix	trans	-54.9	-39.5	177.1	-172.4	179.1	-178.4	-178.4	0	111.5	R362 S363	R362-K366 PolarHBondContact O-N 3.04Å; S363-K366 PolarHBondContact O-N 2.87Å
367	R	90	Very high	90.9	Very high	109 Å²	109	72.2 Å²	72.2	41%	0.411	35%	0.353	S	S	.	.	H	α-helix	trans	-71.1	-30.9	174.9	-170.1	166	69.4	-173.7	-0.2	113.3	S363 L365 I389	S363-R367 WeakPolarHBondContact O-CB 3.44Å; S363-R367 PolarHBondContact O-N 3.45Å; L365-R367 PolarHBondContact O-N 2.75Å; R367-I389 HydrophobicContact CG-CD1 4.08Å; R367-I389 HydrophobicContact CG-CG1 4.07Å
368	H	91.3	Very high	91.1	Very high	9 Å²	9	72.4 Å²	72.4	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-72.8	-37.9	174.2	168.9	74.5	0	0	0	112.9	C352 C355 T357 F359 A364 L365 R370 I371 H372	C352-H368 VanDerWaalsContact SG-CD2 3.59Å; C352-H368 PolarHBondContact SG-NE2 2.71Å; C352-H368 VanDerWaalsContact SG-NE2 3.38Å; C355-H368 PolarHBondContact SG-NE2 3.27Å; T357-H368 PolarHBondContact OG1-NE2 3.48Å; F359-H368 HydrophobicContact CE1-CB 3.81Å; F359-H368 HydrophobicContact CE2-CB 4.04Å; F359-H368 AromaticContact CE2-CD2 3.69Å; F359-H368 AromaticContact CE2-CG 3.84Å; F359-H368 HydrophobicContact CZ-CB 3.42Å; F359-H368 VanDerWaalsContact CZ-CB 3.42Å; F359-H368 AromaticContact CZ-CD2 3.59Å; F359-H368 AromaticContact CZ-CG 3.27Å; F359-H368 AromaticContact CZ-ND1 3.72Å; A364-H368 WeakPolarHBondContact O-CB 3.39Å; A364-H368 PolarHBondContact O-N 3.27Å; L365-H368 CarbonylContact O-C 3.46Å; L365-H368 WeakPolarHBondContact O-CA 3.1Å; L365-H368 WeakPolarHBondContact O-CB 3.38Å; L365-H368 PolarHBondContact O-N 3.06Å; H368-R370 PolarHBondContact O-N 3.28Å; H368-R370 VanDerWaalsContact O-N 3.08Å; H368-I371 VanDerWaalsContact O-CB 3.28Å; H368-I371 WeakPolarHBondContact O-CB 3.43Å; H368-I371 PolarHBondContact O-N 3.26Å; H368-H372 AromaticContact CD2-NE2 3.14Å; H368-H372 PolarHBondContact CD2-NE2 2.79Å; H368-H372 AromaticContact CE1-NE2 2.93Å; H368-H372 PolarHBondContact CE1-NE2 2.69Å; H368-H372 AromaticContact NE2-CD2 3.78Å; H368-H372 AromaticContact NE2-NE2 2.15Å; H368-H372 PolarHBondContact NE2-NE2 2.52Å
369	M	91.1	Very high	91	Very high	50 Å²	50	67.6 Å²	67.6	25%	0.246	34%	0.34	C	S	.	.	H	α-helix	trans	-56.8	-28.3	179.9	-59.5	-46.2	-68.2	0	0	113.1	D354 L365 I371 H372 T373	D354-M369 WeakPolarHBondContact OD2-CE 3.34Å; L365-M369 HydrophobicContact CD1-CG 4.36Å; L365-M369 HydrophobicContact CD1-SD 3.69Å; L365-M369 HydrophobicContact CG-SD 4.46Å; L365-M369 WeakPolarHBondContact O-CG 3.07Å; L365-M369 PolarHBondContact O-N 2.64Å; M369-I371 PolarHBondContact O-N 3.42Å; M369-H372 PolarHBondContact O-N 2.62Å; M369-T373 PolarHBondContact O-N 2.83Å
370	R	92.1	Very high	91.1	Very high	57 Å²	57	67.4 Å²	67.4	22%	0.215	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-15.8	172.3	-62.4	-175.4	175.2	154	2.8	114.6	H368 G374 E375 S388	H368-R370 PolarHBondContact O-N 3.28Å; H368-R370 VanDerWaalsContact O-N 3.08Å; R370-G374 CarbonylContact O-C 3.57Å; R370-G374 WeakPolarHBondContact O-CA 3.46Å; R370-G374 PolarHBondContact O-N 3.3Å; R370-G374 VanDerWaalsContact O-N 3.14Å; R370-E375 HydrophobicContact CB-CB 4.09Å; R370-E375 HydrophobicContact CG-CB 3.95Å; R370-E375 PolarHBondContact O-N 3.1Å; R370-S388 WeakPolarHBondContact CD-O 3.46Å; R370-S388 PolarHBondContact NH1-O 3.09Å
371	I	90.8	Very high	91.2	Very high	84 Å²	84	73.7 Å²	73.7	43%	0.431	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-36.2	172.6	-64.6	161.9	0	0	0	110.7	I150 A152 H368 M369	I150-I371 HydrophobicContact CG2-CD1 4.24Å; A152-I371 HydrophobicContact CB-CD1 3.95Å; H368-I371 VanDerWaalsContact O-CB 3.28Å; H368-I371 WeakPolarHBondContact O-CB 3.43Å; H368-I371 PolarHBondContact O-N 3.26Å; M369-I371 PolarHBondContact O-N 3.42Å
372	H	91.2	Very high	91.2	Very high	85 Å²	85	74.3 Å²	74.3	39%	0.394	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-41.4	178.5	-57.1	-58.8	0	0	0	111.8	C352 D354 C355 H368 M369 G374	C352-H372 PolarHBondContact SG-NE2 2.89Å; D354-H372 HydrophobicContact CB-CB 4.4Å; D354-H372 WeakPolarHBondContact OD2-CB 3.48Å; D354-H372 IonicContact OD2-CD2 3.71Å; D354-H372 IonicContact OD2-CG 3.74Å; C355-H372 WeakPolarHBondContact CB-CE1 3.47Å; C355-H372 PolarHBondContact SG-CE1 2.75Å; C355-H372 PolarHBondContact SG-NE2 3.15Å; H368-H372 AromaticContact CD2-NE2 3.14Å; H368-H372 PolarHBondContact CD2-NE2 2.79Å; H368-H372 AromaticContact CE1-NE2 2.93Å; H368-H372 PolarHBondContact CE1-NE2 2.69Å; H368-H372 AromaticContact NE2-CD2 3.78Å; H368-H372 AromaticContact NE2-NE2 2.15Å; H368-H372 PolarHBondContact NE2-NE2 2.52Å; M369-H372 PolarHBondContact O-N 2.62Å; H372-G374 VanDerWaalsContact C-N 3.28Å; H372-G374 PolarHBondContact O-N 2.94Å
373	T	90.6	Very high	91.3	Very high	80 Å²	80	67 Å²	67	49%	0.491	36%	0.358	S	S	.	.	S	Bend	trans	-77.1	-13.6	175.2	66.8	0	0	0	0	113.6	M369 E375	M369-T373 PolarHBondContact O-N 2.83Å; T373-E375 WeakPolarHBondContact CB-OE1 3.42Å; T373-E375 PolarHBondContact O-N 2.93Å; T373-E375 WeakPolarHBondContact OG1-CB 3.46Å; T373-E375 VanDerWaalsContact OG1-CD 3.26Å; T373-E375 VanDerWaalsContact OG1-CG 3.3Å; T373-E375 WeakPolarHBondContact OG1-CG 3.47Å; T373-E375 PolarHBondContact OG1-N 2.82Å; T373-E375 PolarHBondContact OG1-OE1 3.31Å
374	G	89.5	Confident	91.4	Very high	45 Å²	45	66.5 Å²	66.5	46%	0.464	36%	0.364	S	S	.	.			trans	71.6	3.3	-175	0	0	0	0	0	114.8	R370 H372 K376	R370-G374 CarbonylContact O-C 3.57Å; R370-G374 WeakPolarHBondContact O-CA 3.46Å; R370-G374 PolarHBondContact O-N 3.3Å; R370-G374 VanDerWaalsContact O-N 3.14Å; H372-G374 VanDerWaalsContact C-N 3.28Å; H372-G374 PolarHBondContact O-N 2.94Å; G374-K376 PolarHBondContact O-N 3.12Å
375	E	91.4	Very high	91.4	Very high	96 Å²	96	72 Å²	72	45%	0.449	39%	0.386	S	S	.	.			trans	-54.3	124	-176.9	-87.1	167.9	-123.4	0	0	113.5	R370 T373 S388	R370-E375 HydrophobicContact CB-CB 4.09Å; R370-E375 HydrophobicContact CG-CB 3.95Å; R370-E375 PolarHBondContact O-N 3.1Å; T373-E375 WeakPolarHBondContact CB-OE1 3.42Å; T373-E375 PolarHBondContact O-N 2.93Å; T373-E375 WeakPolarHBondContact OG1-CB 3.46Å; T373-E375 VanDerWaalsContact OG1-CD 3.26Å; T373-E375 VanDerWaalsContact OG1-CG 3.3Å; T373-E375 WeakPolarHBondContact OG1-CG 3.47Å; T373-E375 PolarHBondContact OG1-N 2.82Å; T373-E375 PolarHBondContact OG1-OE1 3.31Å; E375-S388 WeakPolarHBondContact O-CB 3.26Å
376	K	92	Very high	91.3	Very high	116 Å²	116	77.9 Å²	77.9	50%	0.504	41%	0.406	S	S	.	.			trans	-129.9	77.1	174.3	-69.5	165.3	-178.2	176.2	0	109.7	G374 F378 R386 F387	G374-K376 PolarHBondContact O-N 3.12Å; K376-F378 VanDerWaalsContact C-N 3.35Å; K376-F378 PolarHBondContact O-N 3.3Å; K376-R386 HydrophobicContact CB-CB 3.58Å; K376-R386 HydrophobicContact CD-CB 4.41Å; K376-R386 PolarHBondContact O-NE 3.45Å; K376-R386 PolarHBondContact O-NH2 3.3Å; K376-F387 CarbonylContact C-O 3.57Å; K376-F387 VanDerWaalsContact CA-O 3.24Å; K376-F387 WeakPolarHBondContact CA-O 3.28Å
377	P	91.3	Very high	91.3	Very high	54 Å²	54	72.5 Å²	72.5	35%	0.351	38%	0.383	S	S	.	.			trans	-58.4	-46.3	-173.4	-24.8	35.3	0	0	0	112.3	G379 R386	P377-G379 PolarHBondContact O-N 2.85Å; P377-R386 PolarHBondContact O-NH2 3.48Å
378	F	93.7	Very high	91.2	Very high	48 Å²	48	68.8 Å²	68.8	21%	0.211	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	111.5	-169.1	-47.9	-76.5	0	0	0	111.1	K376 R386 F387 I389 K390 L393	K376-F378 VanDerWaalsContact C-N 3.35Å; K376-F378 PolarHBondContact O-N 3.3Å; F378-R386 CarbonylContact O-C 3.59Å; F378-R386 VanDerWaalsContact O-CA 3.31Å; F378-R386 WeakPolarHBondContact O-CA 3.39Å; F378-F387 WeakPolarHBondContact CD2-O 3.36Å; F378-F387 PolarHBondContact N-O 3.21Å; F378-F387 PolarHBondContact O-N 3.19Å; F378-I389 VanDerWaalsContact CD2-C 3.47Å; F378-K390 HydrophobicContact CD1-CB 3.94Å; F378-K390 HydrophobicContact CD1-CD 4.47Å; F378-K390 HydrophobicContact CD1-CG 4.13Å; F378-K390 HydrophobicContact CD2-CB 4.39Å; F378-K390 HydrophobicContact CE1-CB 3.75Å; F378-K390 HydrophobicContact CE1-CD 4.02Å; F378-K390 HydrophobicContact CE1-CG 4.08Å; F378-K390 HydrophobicContact CE2-CB 4.22Å; F378-K390 HydrophobicContact CG-CB 4.26Å; F378-K390 HydrophobicContact CZ-CB 3.9Å; F378-L393 HydrophobicContact CB-CB 4.27Å; F378-L393 HydrophobicContact CB-CD2 3.92Å
379	G	91.9	Very high	91.2	Very high	27 Å²	27	69.7 Å²	69.7	28%	0.278	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	154.9	175.6	0	0	0	0	0	112.7	P377 L393	P377-G379 PolarHBondContact O-N 2.85Å; G379-L393 WeakPolarHBondContact O-CD1 3.4Å; G379-L393 WeakPolarHBondContact O-CD2 3.23Å
380	C	93	Very high	91	Very high	2 Å²	2	71 Å²	71	1%	0.014	38%	0.383	C	S	.	.			trans	-106.7	111.3	167.5	171.5	0	0	0	0	109.2	V382 C383 G384 K385 F387 L393 M397 H400	C380-V382 VanDerWaalsContact C-N 3.29Å; C380-V382 PolarHBondContact O-N 3.04Å; C380-C383 PolarHBondContact O-N 2.97Å; C380-G384 WeakPolarHBondContact O-CA 3.19Å; C380-G384 PolarHBondContact O-N 2.93Å; C380-K385 WeakPolarHBondContact CB-O 3.47Å; C380-K385 PolarHBondContact N-O 3.09Å; C380-F387 HydrophobicContact CB-CE2 4.19Å; C380-L393 HydrophobicContact CB-CD1 3.6Å; C380-M397 HydrophobicContact CB-SD 4.31Å; C380-M397 PolarHBondContact SG-SD 3Å; C380-H400 PolarHBondContact SG-NE2 3.03Å
381	D	92.1	Very high	90.8	Very high	152 Å²	152	70.2 Å²	70.2	81%	0.813	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-31.3	-170.2	-46.5	-70.3	0	0	0	112.4	C383	D381-C383 VanDerWaalsContact C-N 3.3Å; D381-C383 PolarHBondContact O-N 3.15Å
382	V	92.1	Very high	90.7	Very high	94 Å²	94	68.7 Å²	68.7	57%	0.57	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-25.5	178.4	-176.7	0	0	0	0	113.1	C380 M397 H400	C380-V382 VanDerWaalsContact C-N 3.29Å; C380-V382 PolarHBondContact O-N 3.04Å; V382-M397 HydrophobicContact CG2-CE 4.03Å; V382-H400 HydrophobicContact CG1-CB 4.12Å
383	C	91.6	Very high	90.7	Very high	37 Å²	37	66 Å²	66	25%	0.25	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-146.1	7.3	-174	76.7	0	0	0	0	117.2	C380 D381 K385 H396	C380-C383 PolarHBondContact O-N 2.97Å; D381-C383 VanDerWaalsContact C-N 3.3Å; D381-C383 PolarHBondContact O-N 3.15Å; C383-K385 PolarHBondContact O-N 3.18Å; C383-K385 VanDerWaalsContact O-N 3.14Å; C383-H396 PolarHBondContact SG-NE2 2.75Å
384	G	89.6	Confident	90.7	Very high	60 Å²	60	67.3 Å²	67.3	62%	0.619	37%	0.365	S	S	*	.			trans	70.5	-1.8	177.8	0	0	0	0	0	115.8	C380 R386	C380-G384 WeakPolarHBondContact O-CA 3.19Å; C380-G384 PolarHBondContact O-N 2.93Å; G384-R386 PolarHBondContact O-N 3.07Å
385	K	90.7	Very high	90.6	Very high	126 Å²	126	66.8 Å²	66.8	55%	0.548	35%	0.352	S	S	.	.			trans	-67.7	130.3	179.6	-72.8	-176.3	177.8	-175.3	0	110.6	C380 C383 F387	C380-K385 WeakPolarHBondContact CB-O 3.47Å; C380-K385 PolarHBondContact N-O 3.09Å; C383-K385 PolarHBondContact O-N 3.18Å; C383-K385 VanDerWaalsContact O-N 3.14Å; K385-F387 HydrophobicContact CB-CE2 3.9Å; K385-F387 HydrophobicContact CB-CZ 4.03Å; K385-F387 WeakPolarHBondContact O-CE2 3.44Å
386	R	90.9	Very high	90.4	Very high	153 Å²	153	62.6 Å²	62.6	58%	0.577	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	145.7	178.7	-53.7	-171.2	71.4	137.2	8.8	112.5	K376 P377 F378 G384	K376-R386 HydrophobicContact CB-CB 3.58Å; K376-R386 HydrophobicContact CD-CB 4.41Å; K376-R386 PolarHBondContact O-NE 3.45Å; K376-R386 PolarHBondContact O-NH2 3.3Å; P377-R386 PolarHBondContact O-NH2 3.48Å; F378-R386 CarbonylContact O-C 3.59Å; F378-R386 VanDerWaalsContact O-CA 3.31Å; F378-R386 WeakPolarHBondContact O-CA 3.39Å; G384-R386 PolarHBondContact O-N 3.07Å
387	F	89.9	Confident	90.2	Very high	39 Å²	39	59.6 Å²	59.6	17%	0.171	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	149.3	-174.9	-58.1	-90.7	0	0	0	111.1	K376 F378 C380 K385 H392 L393 H396	K376-F387 CarbonylContact C-O 3.57Å; K376-F387 VanDerWaalsContact CA-O 3.24Å; K376-F387 WeakPolarHBondContact CA-O 3.28Å; F378-F387 WeakPolarHBondContact CD2-O 3.36Å; F378-F387 PolarHBondContact N-O 3.21Å; F378-F387 PolarHBondContact O-N 3.19Å; C380-F387 HydrophobicContact CB-CE2 4.19Å; K385-F387 HydrophobicContact CB-CE2 3.9Å; K385-F387 HydrophobicContact CB-CZ 4.03Å; K385-F387 WeakPolarHBondContact O-CE2 3.44Å; F387-H392 HydrophobicContact CB-CB 4.33Å; F387-H392 HydrophobicContact CD1-CB 3.99Å; F387-H392 HydrophobicContact CG-CB 4.42Å; F387-L393 HydrophobicContact CD2-CB 4.1Å; F387-L393 HydrophobicContact CD2-CD1 3.99Å; F387-L393 HydrophobicContact CE2-CD1 4.07Å; F387-L393 HydrophobicContact CG-CB 4.48Å; F387-H396 HydrophobicContact CE1-CB 4.11Å; F387-H396 HydrophobicContact CE2-CB 4.09Å; F387-H396 AromaticContact CE2-CD2 3.46Å; F387-H396 VanDerWaalsContact CE2-CD2 3.46Å; F387-H396 WeakPolarHBondContact CE2-CD2 3.41Å; F387-H396 AromaticContact CE2-CG 3.86Å; F387-H396 HydrophobicContact CZ-CB 3.61Å; F387-H396 AromaticContact CZ-CD2 3.38Å; F387-H396 WeakPolarHBondContact CZ-CD2 3.49Å; F387-H396 AromaticContact CZ-CG 3.36Å
388	S	89.5	Confident	90.1	Very high	31 Å²	31	58.5 Å²	58.5	22%	0.217	31%	0.31	C	S	.	.	S	Bend	trans	-87.3	-4.7	177.4	53	0	0	0	0	113.9	R370 E375	R370-S388 WeakPolarHBondContact CD-O 3.46Å; R370-S388 PolarHBondContact NH1-O 3.09Å; E375-S388 WeakPolarHBondContact O-CB 3.26Å
389	I	89.4	Confident	89.8	Confident	27 Å²	27	60.1 Å²	60.1	14%	0.138	32%	0.32	C	S	.	.	S	Bend	trans	-141.4	134.6	-176.3	-50.1	-177.6	0	0	0	109.2	R367 F378 S391 H392 L393	R367-I389 HydrophobicContact CG-CD1 4.08Å; R367-I389 HydrophobicContact CG-CG1 4.07Å; F378-I389 VanDerWaalsContact CD2-C 3.47Å; I389-S391 WeakPolarHBondContact CG2-OG 3.31Å; I389-H392 HydrophobicContact CB-CB 4.33Å; I389-H392 WeakPolarHBondContact O-CB 3.41Å; I389-H392 PolarHBondContact O-N 3.21Å; I389-L393 PolarHBondContact O-N 3.33Å
390	K	88.4	Confident	89.6	Confident	77 Å²	77	61.7 Å²	61.7	34%	0.335	32%	0.32	S	S	.	.	H	α-helix	trans	-65.4	-43.1	-176.3	-170.4	169.2	165.5	-158.7	0	112.9	D192 E194 F378 H392 L393 K394	D192-K390 HydrophobicContact CB-CD 4.41Å; D192-K390 WeakPolarHBondContact OD1-CD 3.39Å; D192-K390 WeakPolarHBondContact OD1-CE 3.47Å; D192-K390 IonicContact OD1-NZ 3.69Å; D192-K390 PolarHBondContact OD1-NZ 3.31Å; D192-K390 WeakPolarHBondContact OD2-CB 3.38Å; D192-K390 WeakPolarHBondContact OD2-CD 3.39Å; D192-K390 WeakPolarHBondContact OD2-CG 3.41Å; E194-K390 IonicContact OE1-NZ 3.89Å; E194-K390 PolarHBondContact OE1-NZ 2.96Å; F378-K390 HydrophobicContact CD1-CB 3.94Å; F378-K390 HydrophobicContact CD1-CD 4.47Å; F378-K390 HydrophobicContact CD1-CG 4.13Å; F378-K390 HydrophobicContact CD2-CB 4.39Å; F378-K390 HydrophobicContact CE1-CB 3.75Å; F378-K390 HydrophobicContact CE1-CD 4.02Å; F378-K390 HydrophobicContact CE1-CG 4.08Å; F378-K390 HydrophobicContact CE2-CB 4.22Å; F378-K390 HydrophobicContact CG-CB 4.26Å; F378-K390 HydrophobicContact CZ-CB 3.9Å; K390-H392 VanDerWaalsContact C-N 3.26Å; K390-H392 PolarHBondContact O-N 3Å; K390-L393 WeakPolarHBondContact O-CA 3.12Å; K390-L393 VanDerWaalsContact O-CB 3.31Å; K390-L393 WeakPolarHBondContact O-CB 3.28Å; K390-L393 PolarHBondContact O-N 3.49Å; K390-K394 PolarHBondContact O-N 3.37Å
391	S	87.8	Confident	89.4	Confident	41 Å²	41	65.4 Å²	65.4	29%	0.287	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-25.1	173.2	59.9	0	0	0	0	114.5	I389 T395	I389-S391 WeakPolarHBondContact CG2-OG 3.31Å; S391-T395 WeakPolarHBondContact O-CB 3.4Å; S391-T395 WeakPolarHBondContact O-CG2 3.3Å; S391-T395 PolarHBondContact O-N 3.11Å; S391-T395 PolarHBondContact O-OG1 2.89Å
392	H	88.9	Confident	89.1	Confident	52 Å²	52	64.6 Å²	64.6	24%	0.241	33%	0.334	C	S	.	.	H	α-helix	trans	-72.2	-29.7	170	-69.9	-172.3	0	0	0	112.4	F387 I389 K390 T395 H396	F387-H392 HydrophobicContact CB-CB 4.33Å; F387-H392 HydrophobicContact CD1-CB 3.99Å; F387-H392 HydrophobicContact CG-CB 4.42Å; I389-H392 HydrophobicContact CB-CB 4.33Å; I389-H392 WeakPolarHBondContact O-CB 3.41Å; I389-H392 PolarHBondContact O-N 3.21Å; K390-H392 VanDerWaalsContact C-N 3.26Å; K390-H392 PolarHBondContact O-N 3Å; H392-T395 WeakPolarHBondContact CA-OG1 3.46Å; H392-T395 PolarHBondContact O-OG1 2.77Å; H392-H396 VanDerWaalsContact O-CB 3.22Å; H392-H396 WeakPolarHBondContact O-CB 3.46Å; H392-H396 PolarHBondContact O-N 3.12Å; H392-H396 VanDerWaalsContact O-N 3.09Å
393	L	90.8	Very high	88.8	Confident	29 Å²	29	64.2 Å²	64.2	15%	0.152	33%	0.326	C	S	.	.	H	α-helix	trans	-71.5	-50.3	169.1	174.5	63.6	0	0	0	110.6	F378 G379 C380 F387 I389 K390 T395 H396 M397	F378-L393 HydrophobicContact CB-CB 4.27Å; F378-L393 HydrophobicContact CB-CD2 3.92Å; G379-L393 WeakPolarHBondContact O-CD1 3.4Å; G379-L393 WeakPolarHBondContact O-CD2 3.23Å; C380-L393 HydrophobicContact CB-CD1 3.6Å; F387-L393 HydrophobicContact CD2-CB 4.1Å; F387-L393 HydrophobicContact CD2-CD1 3.99Å; F387-L393 HydrophobicContact CE2-CD1 4.07Å; F387-L393 HydrophobicContact CG-CB 4.48Å; I389-L393 PolarHBondContact O-N 3.33Å; K390-L393 WeakPolarHBondContact O-CA 3.12Å; K390-L393 VanDerWaalsContact O-CB 3.31Å; K390-L393 WeakPolarHBondContact O-CB 3.28Å; K390-L393 PolarHBondContact O-N 3.49Å; L393-T395 VanDerWaalsContact C-N 3.28Å; L393-T395 PolarHBondContact O-N 2.8Å; L393-H396 CarbonylContact O-C 3.55Å; L393-H396 WeakPolarHBondContact O-CA 3.38Å; L393-H396 WeakPolarHBondContact O-CB 3.32Å; L393-H396 PolarHBondContact O-N 3.03Å; L393-M397 HydrophobicContact CD1-CG 4.13Å; L393-M397 HydrophobicContact CD1-SD 4.01Å; L393-M397 HydrophobicContact CG-CG 4.42Å; L393-M397 WeakPolarHBondContact O-CG 3.28Å; L393-M397 PolarHBondContact O-N 3.45Å
394	K	89.3	Confident	88.7	Confident	108 Å²	108	66.8 Å²	66.8	47%	0.47	33%	0.333	S	S	.	.	H	α-helix	trans	-50.3	-48.1	176.4	-167.9	-178.7	-174.9	-174.9	0	111.2	D189 K390 M397	D189-K394 IonicContact OD1-NZ 3.88Å; D189-K394 PolarHBondContact OD1-NZ 2.99Å; K390-K394 PolarHBondContact O-N 3.37Å; K394-M397 PolarHBondContact O-N 3.19Å
395	T	87.4	Confident	88.6	Confident	33 Å²	33	66.8 Å²	66.8	20%	0.202	32%	0.322	C	S	.	.	H	α-helix	trans	-73	-23.7	176.8	51.3	0	0	0	0	114.8	S391 H392 L393 L417	S391-T395 WeakPolarHBondContact O-CB 3.4Å; S391-T395 WeakPolarHBondContact O-CG2 3.3Å; S391-T395 PolarHBondContact O-N 3.11Å; S391-T395 PolarHBondContact O-OG1 2.89Å; H392-T395 WeakPolarHBondContact CA-OG1 3.46Å; H392-T395 PolarHBondContact O-OG1 2.77Å; L393-T395 VanDerWaalsContact C-N 3.28Å; L393-T395 PolarHBondContact O-N 2.8Å; T395-L417 HydrophobicContact CG2-CD2 3.73Å
396	H	88.4	Confident	88.6	Confident	9 Å²	9	63.8 Å²	63.8	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-73.6	-37.6	171.1	174.5	52.7	0	0	0	112.6	C383 F387 H392 L393 R398 I399 H400	C383-H396 PolarHBondContact SG-NE2 2.75Å; F387-H396 HydrophobicContact CE1-CB 4.11Å; F387-H396 HydrophobicContact CE2-CB 4.09Å; F387-H396 AromaticContact CE2-CD2 3.46Å; F387-H396 VanDerWaalsContact CE2-CD2 3.46Å; F387-H396 WeakPolarHBondContact CE2-CD2 3.41Å; F387-H396 AromaticContact CE2-CG 3.86Å; F387-H396 HydrophobicContact CZ-CB 3.61Å; F387-H396 AromaticContact CZ-CD2 3.38Å; F387-H396 WeakPolarHBondContact CZ-CD2 3.49Å; F387-H396 AromaticContact CZ-CG 3.36Å; H392-H396 VanDerWaalsContact O-CB 3.22Å; H392-H396 WeakPolarHBondContact O-CB 3.46Å; H392-H396 PolarHBondContact O-N 3.12Å; H392-H396 VanDerWaalsContact O-N 3.09Å; L393-H396 CarbonylContact O-C 3.55Å; L393-H396 WeakPolarHBondContact O-CA 3.38Å; L393-H396 WeakPolarHBondContact O-CB 3.32Å; L393-H396 PolarHBondContact O-N 3.03Å; H396-R398 PolarHBondContact O-N 3.43Å; H396-I399 VanDerWaalsContact O-CB 3.31Å; H396-I399 WeakPolarHBondContact O-CB 3.45Å; H396-I399 WeakPolarHBondContact O-CG1 3.32Å; H396-I399 PolarHBondContact O-N 2.89Å; H396-H400 AromaticContact CD2-NE2 3.87Å; H396-H400 AromaticContact CE1-NE2 3.55Å; H396-H400 AromaticContact NE2-CE1 3.88Å; H396-H400 AromaticContact NE2-NE2 3.11Å; H396-H400 PolarHBondContact NE2-NE2 2.81Å; H396-H400 VanDerWaalsContact NE2-NE2 3.11Å
397	M	87.9	Confident	88.7	Confident	53 Å²	53	59.1 Å²	59.1	26%	0.261	30%	0.299	S	S	.	.	H	α-helix	trans	-59	-30.4	-178.7	-67.7	-55.2	-71.9	0	0	112.8	C380 V382 L393 K394 I399 H400 T401	C380-M397 HydrophobicContact CB-SD 4.31Å; C380-M397 PolarHBondContact SG-SD 3Å; V382-M397 HydrophobicContact CG2-CE 4.03Å; L393-M397 HydrophobicContact CD1-CG 4.13Å; L393-M397 HydrophobicContact CD1-SD 4.01Å; L393-M397 HydrophobicContact CG-CG 4.42Å; L393-M397 WeakPolarHBondContact O-CG 3.28Å; L393-M397 PolarHBondContact O-N 3.45Å; K394-M397 PolarHBondContact O-N 3.19Å; M397-I399 PolarHBondContact O-N 2.79Å; M397-H400 PolarHBondContact O-N 2.7Å; M397-T401 PolarHBondContact O-N 3.39Å; M397-T401 VanDerWaalsContact O-N 3.13Å; M397-T401 PolarHBondContact O-OG1 2.87Å
398	R	88.9	Confident	88.8	Confident	30 Å²	30	57.3 Å²	57.3	11%	0.113	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-13.7	171.3	-61.5	-169.8	175.1	152.5	6.6	115.1	H396 T401 Q402 E403 S416	H396-R398 PolarHBondContact O-N 3.43Å; R398-T401 WeakPolarHBondContact CA-OG1 3.22Å; R398-Q402 CarbonylContact O-C 3.55Å; R398-Q402 WeakPolarHBondContact O-CA 3.43Å; R398-Q402 PolarHBondContact O-N 2.74Å; R398-E403 HydrophobicContact CB-CB 4.16Å; R398-E403 HydrophobicContact CG-CB 4.06Å; R398-E403 IonicContact NE-OE2 3.16Å; R398-E403 PolarHBondContact NE-OE2 3.27Å; R398-E403 PolarHBondContact O-N 3.26Å; R398-S416 PolarHBondContact NH1-O 2.83Å
399	I	87.6	Confident	88.9	Confident	83 Å²	83	62.3 Å²	62.3	43%	0.426	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-36.2	170.7	-61.6	-176.8	0	0	0	111.1	I158 H396 M397	I158-I399 HydrophobicContact CG1-CD1 4.36Å; I158-I399 HydrophobicContact CG2-CD1 4.15Å; I158-I399 HydrophobicContact CG2-CG1 4.09Å; H396-I399 VanDerWaalsContact O-CB 3.31Å; H396-I399 WeakPolarHBondContact O-CB 3.45Å; H396-I399 WeakPolarHBondContact O-CG1 3.32Å; H396-I399 PolarHBondContact O-N 2.89Å; M397-I399 PolarHBondContact O-N 2.79Å
400	H	87.4	Confident	88.8	Confident	60 Å²	60	65.5 Å²	65.5	28%	0.278	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-44.6	-176.6	-53	-56.9	0	0	0	111.7	C380 V382 H396 M397 Q402	C380-H400 PolarHBondContact SG-NE2 3.03Å; V382-H400 HydrophobicContact CG1-CB 4.12Å; H396-H400 AromaticContact CD2-NE2 3.87Å; H396-H400 AromaticContact CE1-NE2 3.55Å; H396-H400 AromaticContact NE2-CE1 3.88Å; H396-H400 AromaticContact NE2-NE2 3.11Å; H396-H400 PolarHBondContact NE2-NE2 2.81Å; H396-H400 VanDerWaalsContact NE2-NE2 3.11Å; M397-H400 PolarHBondContact O-N 2.7Å; H400-Q402 PolarHBondContact O-N 3.31Å
401	T	88.1	Confident	89	Confident	79 Å²	79	64 Å²	64	49%	0.485	33%	0.331	S	S	.	.	S	Bend	trans	-71.5	-11.7	172.5	61.9	0	0	0	0	112.9	M397 R398 E403	M397-T401 PolarHBondContact O-N 3.39Å; M397-T401 VanDerWaalsContact O-N 3.13Å; M397-T401 PolarHBondContact O-OG1 2.87Å; R398-T401 WeakPolarHBondContact CA-OG1 3.22Å; T401-E403 VanDerWaalsContact CB-OE1 3.22Å; T401-E403 WeakPolarHBondContact CB-OE1 3.46Å; T401-E403 WeakPolarHBondContact CG2-OE1 3.13Å; T401-E403 PolarHBondContact O-N 2.63Å; T401-E403 VanDerWaalsContact O-N 3.12Å; T401-E403 VanDerWaalsContact OG1-CD 3.28Å; T401-E403 WeakPolarHBondContact OG1-CG 3.34Å; T401-E403 PolarHBondContact OG1-OE1 3.11Å
402	Q	87.1	Confident	89	Confident	136 Å²	136	64.8 Å²	64.8	64%	0.636	35%	0.346	S	S	*	.			trans	60.4	9.4	-175.1	-48.8	-166.3	30	0	0	115.8	R398 H400 K404	R398-Q402 CarbonylContact O-C 3.55Å; R398-Q402 WeakPolarHBondContact O-CA 3.43Å; R398-Q402 PolarHBondContact O-N 2.74Å; H400-Q402 PolarHBondContact O-N 3.31Å; Q402-K404 WeakPolarHBondContact O-CE 3.49Å; Q402-K404 PolarHBondContact O-N 3.06Å; Q402-K404 PolarHBondContact O-NZ 2.69Å
403	E	85.1	Confident	89	Confident	86 Å²	86	67.9 Å²	67.9	40%	0.402	36%	0.358	S	S	.	.			trans	-48.1	126.1	177.1	-81.3	163.2	-111.4	0	0	112.7	R398 T401 S416	R398-E403 HydrophobicContact CB-CB 4.16Å; R398-E403 HydrophobicContact CG-CB 4.06Å; R398-E403 IonicContact NE-OE2 3.16Å; R398-E403 PolarHBondContact NE-OE2 3.27Å; R398-E403 PolarHBondContact O-N 3.26Å; T401-E403 VanDerWaalsContact CB-OE1 3.22Å; T401-E403 WeakPolarHBondContact CB-OE1 3.46Å; T401-E403 WeakPolarHBondContact CG2-OE1 3.13Å; T401-E403 PolarHBondContact O-N 2.63Å; T401-E403 VanDerWaalsContact O-N 3.12Å; T401-E403 VanDerWaalsContact OG1-CD 3.28Å; T401-E403 WeakPolarHBondContact OG1-CG 3.34Å; T401-E403 PolarHBondContact OG1-OE1 3.11Å; E403-S416 WeakPolarHBondContact O-CB 3.31Å
404	K	88.8	Confident	88.9	Confident	91 Å²	91	73.8 Å²	73.8	40%	0.396	38%	0.379	S	S	.	.			trans	-131.8	77.9	174	-69.3	151.7	-166.6	139.1	0	109.3	Q402 Y406 R414 F415	Q402-K404 WeakPolarHBondContact O-CE 3.49Å; Q402-K404 PolarHBondContact O-N 3.06Å; Q402-K404 PolarHBondContact O-NZ 2.69Å; K404-Y406 VanDerWaalsContact C-N 3.26Å; K404-Y406 PolarHBondContact O-N 2.84Å; K404-R414 HydrophobicContact CB-CB 3.53Å; K404-R414 HydrophobicContact CD-CB 4.44Å; K404-R414 HydrophobicContact CG-CB 4.47Å; K404-R414 PolarHBondContact O-NE 3.3Å; K404-R414 PolarHBondContact O-NH2 3.07Å; K404-F415 CarbonylContact C-O 3.25Å; K404-F415 VanDerWaalsContact C-O 3.26Å; K404-F415 VanDerWaalsContact CA-O 3.24Å; K404-F415 WeakPolarHBondContact CA-O 3.45Å
405	P	89.3	Confident	88.8	Confident	60 Å²	60	70.7 Å²	70.7	39%	0.39	37%	0.365	S	S	.	.			trans	-60.7	-35.5	-176.1	-24.3	35.4	0	0	0	112.8	S407	P405-S407 PolarHBondContact O-N 3.11Å
406	Y	90.4	Very high	88.8	Confident	63 Å²	63	70 Å²	70	25%	0.247	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	104.9	-168.7	-46.4	-77.6	0	0	0	111.8	K404 R414 F415 S416 Q418	K404-Y406 VanDerWaalsContact C-N 3.26Å; K404-Y406 PolarHBondContact O-N 2.84Å; Y406-R414 CarbonylContact O-C 3.57Å; Y406-R414 WeakPolarHBondContact O-CA 3.2Å; Y406-F415 WeakPolarHBondContact CD2-O 3.25Å; Y406-F415 PolarHBondContact N-O 2.64Å; Y406-F415 VanDerWaalsContact N-O 3.14Å; Y406-F415 PolarHBondContact O-N 3.09Å; Y406-S416 WeakPolarHBondContact CE2-O 3.44Å; Y406-Q418 HydrophobicContact CD1-CB 3.88Å; Y406-Q418 HydrophobicContact CD1-CG 4.03Å; Y406-Q418 HydrophobicContact CD2-CB 4.37Å; Y406-Q418 HydrophobicContact CE1-CB 3.82Å; Y406-Q418 HydrophobicContact CE1-CG 4.19Å; Y406-Q418 HydrophobicContact CE2-CB 4.3Å; Y406-Q418 VanDerWaalsContact CE2-N 3.3Å; Y406-Q418 HydrophobicContact CG-CB 4.17Å
407	S	92.1	Very high	88.7	Confident	55 Å²	55	70.8 Å²	70.8	39%	0.385	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	156.4	172.6	48.4	0	0	0	0	113.1	P405 K413 L421	P405-S407 PolarHBondContact O-N 3.11Å; S407-K413 CarbonylContact C-O 3.51Å; S407-L421 VanDerWaalsContact O-CD1 3.28Å; S407-L421 WeakPolarHBondContact O-CD1 3.49Å; S407-L421 WeakPolarHBondContact O-CD2 3.25Å
408	C	92.1	Very high	88.6	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.007	38%	0.381	C	S	.	.			trans	-109.1	115.1	165.8	169.5	0	0	0	0	108.8	D410 C411 G412 K413 F415 L421 H424 M425 H428	C408-D410 PolarHBondContact O-N 2.93Å; C408-C411 PolarHBondContact O-N 3.42Å; C408-G412 VanDerWaalsContact O-CA 3.32Å; C408-G412 WeakPolarHBondContact O-CA 3.48Å; C408-G412 PolarHBondContact O-N 3.28Å; C408-K413 HydrophobicContact CB-CB 4.47Å; C408-K413 WeakPolarHBondContact CB-O 3.49Å; C408-K413 PolarHBondContact N-O 3.26Å; C408-F415 HydrophobicContact CB-CE2 4.11Å; C408-L421 HydrophobicContact CB-CD1 3.57Å; C408-H424 PolarHBondContact SG-CD2 3.13Å; C408-M425 HydrophobicContact CB-SD 4.14Å; C408-M425 PolarHBondContact SG-SD 3.27Å; C408-H428 PolarHBondContact SG-NE2 3.15Å
409	D	91.1	Very high	88.5	Confident	136 Å²	136	79 Å²	79	73%	0.727	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-37.6	-171.4	-42	-49.3	0	0	0	111.3	C411	D409-C411 PolarHBondContact O-N 2.86Å
410	D	88.9	Confident	88.5	Confident	94 Å²	94	75.3 Å²	75.3	50%	0.503	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.5	176.5	-59.2	-20.7	0	0	0	114.6	C408 M425 H428	C408-D410 PolarHBondContact O-N 2.93Å; D410-M425 WeakPolarHBondContact OD2-CE 3.48Å; D410-H428 HydrophobicContact CB-CB 4.38Å; D410-H428 VanDerWaalsContact CB-CD2 3.45Å; D410-H428 WeakPolarHBondContact CB-CD2 3.39Å; D410-H428 WeakPolarHBondContact OD2-CB 3.31Å; D410-H428 IonicContact OD2-CD2 2.73Å; D410-H428 PolarHBondContact OD2-CD2 3.33Å; D410-H428 IonicContact OD2-CG 3.24Å; D410-H428 VanDerWaalsContact OD2-CG 3.29Å
411	C	91.1	Very high	88.5	Confident	46 Å²	46	73.8 Å²	73.8	31%	0.311	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.2	14.9	-176.4	71.5	0	0	0	0	117.1	C408 D409 K413 H424 H428	C408-C411 PolarHBondContact O-N 3.42Å; D409-C411 PolarHBondContact O-N 2.86Å; C411-K413 PolarHBondContact O-N 3.35Å; C411-H424 PolarHBondContact SG-NE2 3.43Å; C411-H428 WeakPolarHBondContact CB-CE1 3.41Å; C411-H428 PolarHBondContact SG-CE1 3.44Å; C411-H428 PolarHBondContact SG-NE2 3.41Å
412	G	88.4	Confident	88.5	Confident	57 Å²	57	77 Å²	77	59%	0.588	39%	0.391	S	S	*	.			trans	66.9	-1.3	178.8	0	0	0	0	0	116.7	C408 R414	C408-G412 VanDerWaalsContact O-CA 3.32Å; C408-G412 WeakPolarHBondContact O-CA 3.48Å; C408-G412 PolarHBondContact O-N 3.28Å; G412-R414 PolarHBondContact O-N 3.17Å
413	K	88.6	Confident	88.5	Confident	116 Å²	116	75.5 Å²	75.5	50%	0.504	38%	0.38	S	S	.	.			trans	-71.3	123.9	-174.5	-71.8	175.3	-172.7	162.9	0	111.1	S407 C408 C411 F415	S407-K413 CarbonylContact C-O 3.51Å; C408-K413 HydrophobicContact CB-CB 4.47Å; C408-K413 WeakPolarHBondContact CB-O 3.49Å; C408-K413 PolarHBondContact N-O 3.26Å; C411-K413 PolarHBondContact O-N 3.35Å; K413-F415 HydrophobicContact CB-CE2 4.02Å; K413-F415 HydrophobicContact CB-CZ 4.08Å; K413-F415 WeakPolarHBondContact O-CD2 3.11Å; K413-F415 VanDerWaalsContact O-CE2 3.23Å; K413-F415 WeakPolarHBondContact O-CE2 3.05Å
414	R	89.6	Confident	88.7	Confident	154 Å²	154	72.4 Å²	72.4	58%	0.581	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	144.7	-179.4	-54.2	-176.7	65.5	149.3	2.7	112.1	K404 Y406 G412	K404-R414 HydrophobicContact CB-CB 3.53Å; K404-R414 HydrophobicContact CD-CB 4.44Å; K404-R414 HydrophobicContact CG-CB 4.47Å; K404-R414 PolarHBondContact O-NE 3.3Å; K404-R414 PolarHBondContact O-NH2 3.07Å; Y406-R414 CarbonylContact O-C 3.57Å; Y406-R414 WeakPolarHBondContact O-CA 3.2Å; G412-R414 PolarHBondContact O-N 3.17Å
415	F	87.2	Confident	88.6	Confident	43 Å²	43	70 Å²	70	19%	0.189	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.5	-177.8	-57.6	-87.2	0	0	0	111.5	K404 Y406 C408 K413 C420 L421 H424	K404-F415 CarbonylContact C-O 3.25Å; K404-F415 VanDerWaalsContact C-O 3.26Å; K404-F415 VanDerWaalsContact CA-O 3.24Å; K404-F415 WeakPolarHBondContact CA-O 3.45Å; Y406-F415 WeakPolarHBondContact CD2-O 3.25Å; Y406-F415 PolarHBondContact N-O 2.64Å; Y406-F415 VanDerWaalsContact N-O 3.14Å; Y406-F415 PolarHBondContact O-N 3.09Å; C408-F415 HydrophobicContact CB-CE2 4.11Å; K413-F415 HydrophobicContact CB-CE2 4.02Å; K413-F415 HydrophobicContact CB-CZ 4.08Å; K413-F415 WeakPolarHBondContact O-CD2 3.11Å; K413-F415 VanDerWaalsContact O-CE2 3.23Å; K413-F415 WeakPolarHBondContact O-CE2 3.05Å; F415-C420 HydrophobicContact CB-CB 4.06Å; F415-C420 HydrophobicContact CD1-CB 3.69Å; F415-C420 HydrophobicContact CG-CB 4.11Å; F415-L421 HydrophobicContact CB-CB 4.44Å; F415-L421 HydrophobicContact CD2-CB 3.85Å; F415-L421 HydrophobicContact CD2-CD1 3.92Å; F415-L421 HydrophobicContact CD2-CG 4.49Å; F415-L421 HydrophobicContact CE2-CD1 3.97Å; F415-L421 HydrophobicContact CG-CB 4.3Å; F415-H424 HydrophobicContact CE1-CB 4.19Å; F415-H424 HydrophobicContact CE2-CB 4.02Å; F415-H424 AromaticContact CE2-CD2 3.63Å; F415-H424 AromaticContact CE2-CG 3.91Å; F415-H424 HydrophobicContact CZ-CB 3.57Å; F415-H424 AromaticContact CZ-CD2 3.53Å; F415-H424 AromaticContact CZ-CG 3.41Å; F415-H424 VanDerWaalsContact CZ-CG 3.41Å
416	S	86.3	Confident	88.6	Confident	17 Å²	17	70.2 Å²	70.2	12%	0.119	35%	0.348	C	S	.	.	S	Bend	trans	-78.5	-17.2	176.4	48.7	0	0	0	0	114	I158 R398 E403 Y406	I158-S416 PolarHBondContact O-OG 2.73Å; R398-S416 PolarHBondContact NH1-O 2.83Å; E403-S416 WeakPolarHBondContact O-CB 3.31Å; Y406-S416 WeakPolarHBondContact CE2-O 3.44Å
417	L	87.1	Confident	88.5	Confident	27 Å²	27	71 Å²	71	14%	0.141	36%	0.356	C	S	.	.	S	Bend	trans	-134.6	134.8	178.6	-63.7	177.1	0	0	0	111.8	V156 I158 T395 L419 C420 L421	V156-L417 HydrophobicContact CG1-CD1 3.92Å; I158-L417 HydrophobicContact CB-CD1 3.82Å; I158-L417 HydrophobicContact CG2-CD1 4.07Å; I158-L417 HydrophobicContact CG2-CG 4.31Å; T395-L417 HydrophobicContact CG2-CD2 3.73Å; L417-L419 PolarHBondContact O-N 3.05Å; L417-L419 VanDerWaalsContact O-N 3.15Å; L417-C420 WeakPolarHBondContact O-CB 3.03Å; L417-C420 PolarHBondContact O-N 3.41Å; L417-L421 PolarHBondContact O-N 2.8Å
418	Q	86.3	Confident	88.3	Confident	123 Å²	123	72.5 Å²	72.5	58%	0.575	36%	0.357	S	S	*	.	H	α-helix	trans	-57.9	-29.7	176.8	-159.5	-164.9	49.3	0	0	112.4	Y406 L421 K422	Y406-Q418 HydrophobicContact CD1-CB 3.88Å; Y406-Q418 HydrophobicContact CD1-CG 4.03Å; Y406-Q418 HydrophobicContact CD2-CB 4.37Å; Y406-Q418 HydrophobicContact CE1-CB 3.82Å; Y406-Q418 HydrophobicContact CE1-CG 4.19Å; Y406-Q418 HydrophobicContact CE2-CB 4.3Å; Y406-Q418 VanDerWaalsContact CE2-N 3.3Å; Y406-Q418 HydrophobicContact CG-CB 4.17Å; Q418-L421 WeakPolarHBondContact O-CB 3.5Å; Q418-L421 PolarHBondContact O-N 2.84Å; Q418-K422 WeakPolarHBondContact O-CB 3.38Å; Q418-K422 PolarHBondContact O-N 3.38Å
419	L	85.7	Confident	88.1	Confident	133 Å²	133	81 Å²	81	70%	0.696	39%	0.389	S	S	*	.	H	α-helix	trans	-68.8	-33.9	174.4	-66.8	178.4	0	0	0	113.1	L417 R423	L417-L419 PolarHBondContact O-N 3.05Å; L417-L419 VanDerWaalsContact O-N 3.15Å; L419-R423 WeakPolarHBondContact O-CB 3.27Å; L419-R423 PolarHBondContact O-N 3.25Å; L419-R423 VanDerWaalsContact O-N 3.1Å
420	C	86.9	Confident	87.9	Confident	5 Å²	5	76.6 Å²	76.6	3%	0.034	38%	0.376	C	S	.	.	H	α-helix	trans	-66.4	-40.6	171.9	-53	0	0	0	0	110.1	I158 C159 F415 L417 R423 H424	I158-C420 PolarHBondContact O-SG 2.91Å; I158-C420 VanDerWaalsContact O-SG 3.34Å; C159-C420 HydrophobicContact CB-CB 4.12Å; C159-C420 WeakPolarHBondContact CB-SG 3.5Å; C159-C420 WeakPolarHBondContact SG-CB 3.29Å; C159-C420 CovalentContact SG-SG 2.05Å; C159-C420 PolarHBondContact SG-SG 2.91Å; F415-C420 HydrophobicContact CB-CB 4.06Å; F415-C420 HydrophobicContact CD1-CB 3.69Å; F415-C420 HydrophobicContact CG-CB 4.11Å; L417-C420 WeakPolarHBondContact O-CB 3.03Å; L417-C420 PolarHBondContact O-N 3.41Å; C420-R423 WeakPolarHBondContact O-CB 3.35Å; C420-R423 PolarHBondContact O-N 3.29Å; C420-H424 WeakPolarHBondContact O-CB 3.34Å; C420-H424 PolarHBondContact O-N 2.81Å
421	L	89.1	Confident	87.9	Confident	28 Å²	28	75.7 Å²	75.7	15%	0.147	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-54.9	175.1	172.2	62.4	0	0	0	112.2	S407 C408 F415 L417 Q418 R423 H424 M425	S407-L421 VanDerWaalsContact O-CD1 3.28Å; S407-L421 WeakPolarHBondContact O-CD1 3.49Å; S407-L421 WeakPolarHBondContact O-CD2 3.25Å; C408-L421 HydrophobicContact CB-CD1 3.57Å; F415-L421 HydrophobicContact CB-CB 4.44Å; F415-L421 HydrophobicContact CD2-CB 3.85Å; F415-L421 HydrophobicContact CD2-CD1 3.92Å; F415-L421 HydrophobicContact CD2-CG 4.49Å; F415-L421 HydrophobicContact CE2-CD1 3.97Å; F415-L421 HydrophobicContact CG-CB 4.3Å; L417-L421 PolarHBondContact O-N 2.8Å; Q418-L421 WeakPolarHBondContact O-CB 3.5Å; Q418-L421 PolarHBondContact O-N 2.84Å; L421-R423 PolarHBondContact O-N 2.93Å; L421-R423 VanDerWaalsContact O-N 3.12Å; L421-H424 CarbonylContact O-C 3.54Å; L421-H424 WeakPolarHBondContact O-CA 3.43Å; L421-H424 VanDerWaalsContact O-CB 3.31Å; L421-H424 WeakPolarHBondContact O-CB 3.39Å; L421-H424 PolarHBondContact O-N 3.22Å; L421-M425 HydrophobicContact CD1-CG 4.15Å; L421-M425 HydrophobicContact CD1-SD 3.74Å; L421-M425 HydrophobicContact CG-CG 4.47Å; L421-M425 WeakPolarHBondContact O-CG 3.5Å; L421-M425 PolarHBondContact O-N 3Å
422	K	87.6	Confident	87.7	Confident	146 Å²	146	79 Å²	79	64%	0.635	38%	0.377	S	S	*	.	H	α-helix	trans	-58.5	-29.6	179.3	-171.7	169.4	-174.4	169.2	0	112.3	Q418	Q418-K422 WeakPolarHBondContact O-CB 3.38Å; Q418-K422 PolarHBondContact O-N 3.38Å
423	R	86.8	Confident	87.7	Confident	105 Å²	105	79.2 Å²	79.2	40%	0.396	37%	0.369	S	S	.	.	H	α-helix	trans	-72.5	-36.5	170.7	-176.5	172.3	80.7	178.7	15.3	113	C159 L419 C420 L421 L445	C159-R423 PolarHBondContact SG-NH2 2.89Å; C159-R423 VanDerWaalsContact SG-NH2 3.38Å; L419-R423 WeakPolarHBondContact O-CB 3.27Å; L419-R423 PolarHBondContact O-N 3.25Å; L419-R423 VanDerWaalsContact O-N 3.1Å; C420-R423 WeakPolarHBondContact O-CB 3.35Å; C420-R423 PolarHBondContact O-N 3.29Å; L421-R423 PolarHBondContact O-N 2.93Å; L421-R423 VanDerWaalsContact O-N 3.12Å; R423-L445 HydrophobicContact CG-CD2 3.66Å
424	H	88.6	Confident	87.8	Confident	21 Å²	21	76.5 Å²	76.5	10%	0.097	36%	0.357	C	S	.	.	H	α-helix	trans	-70.5	-41	177.3	177.4	62	0	0	0	112.8	C408 C411 F415 C420 L421 R426 I427 H428	C408-H424 PolarHBondContact SG-CD2 3.13Å; C411-H424 PolarHBondContact SG-NE2 3.43Å; F415-H424 HydrophobicContact CE1-CB 4.19Å; F415-H424 HydrophobicContact CE2-CB 4.02Å; F415-H424 AromaticContact CE2-CD2 3.63Å; F415-H424 AromaticContact CE2-CG 3.91Å; F415-H424 HydrophobicContact CZ-CB 3.57Å; F415-H424 AromaticContact CZ-CD2 3.53Å; F415-H424 AromaticContact CZ-CG 3.41Å; F415-H424 VanDerWaalsContact CZ-CG 3.41Å; C420-H424 WeakPolarHBondContact O-CB 3.34Å; C420-H424 PolarHBondContact O-N 2.81Å; L421-H424 CarbonylContact O-C 3.54Å; L421-H424 WeakPolarHBondContact O-CA 3.43Å; L421-H424 VanDerWaalsContact O-CB 3.31Å; L421-H424 WeakPolarHBondContact O-CB 3.39Å; L421-H424 PolarHBondContact O-N 3.22Å; H424-R426 PolarHBondContact O-N 3.49Å; H424-I427 VanDerWaalsContact O-CB 3.28Å; H424-I427 WeakPolarHBondContact O-CB 3.29Å; H424-I427 WeakPolarHBondContact O-CG1 3.48Å; H424-I427 PolarHBondContact O-N 3.19Å; H424-H428 AromaticContact CD2-NE2 3.27Å; H424-H428 PolarHBondContact CD2-NE2 2.81Å; H424-H428 VanDerWaalsContact CD2-NE2 3.27Å; H424-H428 AromaticContact CE1-NE2 3.4Å; H424-H428 PolarHBondContact CE1-NE2 2.99Å; H424-H428 AromaticContact NE2-NE2 2.52Å; H424-H428 PolarHBondContact NE2-NE2 3.31Å
425	M	87.9	Confident	87.8	Confident	39 Å²	39	70.6 Å²	70.6	19%	0.192	34%	0.344	C	S	.	.	H	α-helix	trans	-57.1	-24.4	178.5	-58.2	-49.7	-74.8	0	0	113.7	C408 D410 L421 I427 H428 R429	C408-M425 HydrophobicContact CB-SD 4.14Å; C408-M425 PolarHBondContact SG-SD 3.27Å; D410-M425 WeakPolarHBondContact OD2-CE 3.48Å; L421-M425 HydrophobicContact CD1-CG 4.15Å; L421-M425 HydrophobicContact CD1-SD 3.74Å; L421-M425 HydrophobicContact CG-CG 4.47Å; L421-M425 WeakPolarHBondContact O-CG 3.5Å; L421-M425 PolarHBondContact O-N 3Å; M425-I427 PolarHBondContact O-N 3.39Å; M425-H428 PolarHBondContact O-N 3.21Å; M425-R429 PolarHBondContact O-N 2.99Å; M425-R429 VanDerWaalsContact O-N 3.09Å
426	R	89.3	Confident	88	Confident	65 Å²	65	68.7 Å²	68.7	25%	0.245	34%	0.336	C	S	.	.	H	α-helix	trans	-61.1	-22.4	172.2	-62.1	-171.5	-179.8	154.6	5.3	113.9	H424 G430 E431 N444	H424-R426 PolarHBondContact O-N 3.49Å; R426-G430 CarbonylContact O-C 3.42Å; R426-G430 PolarHBondContact O-N 2.98Å; R426-E431 HydrophobicContact CB-CB 3.94Å; R426-E431 HydrophobicContact CG-CB 4.07Å; R426-E431 PolarHBondContact O-N 3.35Å; R426-N444 PolarHBondContact NH1-O 3.44Å; R426-N444 VanDerWaalsContact NH1-O 3.11Å
427	I	88.6	Confident	88.2	Confident	80 Å²	80	75.3 Å²	75.3	41%	0.41	37%	0.37	S	S	.	.	H	α-helix	trans	-71.8	-51.2	177.4	-59.7	178.4	0	0	0	109.2	H424 M425 G430	H424-I427 VanDerWaalsContact O-CB 3.28Å; H424-I427 WeakPolarHBondContact O-CB 3.29Å; H424-I427 WeakPolarHBondContact O-CG1 3.48Å; H424-I427 PolarHBondContact O-N 3.19Å; M425-I427 PolarHBondContact O-N 3.39Å; I427-G430 PolarHBondContact O-N 2.88Å; I427-G430 VanDerWaalsContact O-N 3.15Å
428	H	87.4	Confident	88.3	Confident	86 Å²	86	78.5 Å²	78.5	40%	0.398	39%	0.39	S	S	.	.	H	α-helix	trans	-63.5	-42.7	179.1	-58.1	-53.2	0	0	0	112.1	C408 D410 C411 H424 M425 G430	C408-H428 PolarHBondContact SG-NE2 3.15Å; D410-H428 HydrophobicContact CB-CB 4.38Å; D410-H428 VanDerWaalsContact CB-CD2 3.45Å; D410-H428 WeakPolarHBondContact CB-CD2 3.39Å; D410-H428 WeakPolarHBondContact OD2-CB 3.31Å; D410-H428 IonicContact OD2-CD2 2.73Å; D410-H428 PolarHBondContact OD2-CD2 3.33Å; D410-H428 IonicContact OD2-CG 3.24Å; D410-H428 VanDerWaalsContact OD2-CG 3.29Å; C411-H428 WeakPolarHBondContact CB-CE1 3.41Å; C411-H428 PolarHBondContact SG-CE1 3.44Å; C411-H428 PolarHBondContact SG-NE2 3.41Å; H424-H428 AromaticContact CD2-NE2 3.27Å; H424-H428 PolarHBondContact CD2-NE2 2.81Å; H424-H428 VanDerWaalsContact CD2-NE2 3.27Å; H424-H428 AromaticContact CE1-NE2 3.4Å; H424-H428 PolarHBondContact CE1-NE2 2.99Å; H424-H428 AromaticContact NE2-NE2 2.52Å; H424-H428 PolarHBondContact NE2-NE2 3.31Å; M425-H428 PolarHBondContact O-N 3.21Å; H428-G430 PolarHBondContact O-N 3.02Å
429	R	88.3	Confident	88.5	Confident	180 Å²	180	74.8 Å²	74.8	68%	0.679	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-4.3	176	-62.9	-179.1	173	-159.3	-5.8	114.8	M425 E431	M425-R429 PolarHBondContact O-N 2.99Å; M425-R429 VanDerWaalsContact O-N 3.09Å; R429-E431 HydrophobicContact CB-CG 3.87Å; R429-E431 WeakPolarHBondContact CD-OE1 3.36Å; R429-E431 IonicContact NE-OE1 2.57Å; R429-E431 IonicContact NH1-OE1 3.32Å; R429-E431 PolarHBondContact NH1-OE1 2.97Å; R429-E431 PolarHBondContact O-N 3.49Å
430	G	86.3	Confident	88.6	Confident	44 Å²	44	71.3 Å²	71.3	45%	0.454	37%	0.374	S	S	.	.			trans	63.5	7.8	-173.7	0	0	0	0	0	115.5	R426 I427 H428 K432	R426-G430 CarbonylContact O-C 3.42Å; R426-G430 PolarHBondContact O-N 2.98Å; I427-G430 PolarHBondContact O-N 2.88Å; I427-G430 VanDerWaalsContact O-N 3.15Å; H428-G430 PolarHBondContact O-N 3.02Å; G430-K432 PolarHBondContact O-N 3.27Å
431	E	88.4	Confident	88.7	Confident	75 Å²	75	76.6 Å²	76.6	35%	0.35	40%	0.396	S	S	.	.			trans	-58.2	116.1	-175.1	-75.9	177.9	-153	0	0	111.7	R426 R429 P433	R426-E431 HydrophobicContact CB-CB 3.94Å; R426-E431 HydrophobicContact CG-CB 4.07Å; R426-E431 PolarHBondContact O-N 3.35Å; R429-E431 HydrophobicContact CB-CG 3.87Å; R429-E431 WeakPolarHBondContact CD-OE1 3.36Å; R429-E431 IonicContact NE-OE1 2.57Å; R429-E431 IonicContact NH1-OE1 3.32Å; R429-E431 PolarHBondContact NH1-OE1 2.97Å; R429-E431 PolarHBondContact O-N 3.49Å; E431-P433 WeakPolarHBondContact O-CD 3.49Å
432	K	88.6	Confident	88.8	Confident	114 Å²	114	82.9 Å²	82.9	50%	0.496	42%	0.418	S	S	.	.			trans	-123.8	77.6	175.2	-67.5	162.8	-172.8	169.4	0	110.2	G430 F434 R442 F443	G430-K432 PolarHBondContact O-N 3.27Å; K432-F434 VanDerWaalsContact C-N 3.26Å; K432-F434 PolarHBondContact O-N 3.03Å; K432-R442 HydrophobicContact CB-CB 3.63Å; K432-R442 HydrophobicContact CD-CB 4.41Å; K432-R442 PolarHBondContact O-NE 3.21Å; K432-R442 PolarHBondContact O-NH2 2.8Å; K432-F443 CarbonylContact C-O 3.22Å; K432-F443 VanDerWaalsContact CA-O 3.26Å; K432-F443 WeakPolarHBondContact CA-O 3.24Å
433	P	88.3	Confident	88.8	Confident	63 Å²	63	78 Å²	78	41%	0.409	40%	0.397	S	S	.	.			trans	-65.7	-26.6	-173.4	-22.4	34.9	0	0	0	114	E431 G435	E431-P433 WeakPolarHBondContact O-CD 3.49Å; P433-G435 PolarHBondContact O-N 3.04Å
434	F	90.6	Very high	88.7	Confident	59 Å²	59	75.2 Å²	75.2	26%	0.259	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-98.4	98	-168.9	-53.8	-76.6	0	0	0	110.6	K432 R442 F443 K446 L449	K432-F434 VanDerWaalsContact C-N 3.26Å; K432-F434 PolarHBondContact O-N 3.03Å; F434-R442 CarbonylContact O-C 3.59Å; F434-R442 WeakPolarHBondContact O-CA 3.44Å; F434-F443 HydrophobicContact CB-CB 4.44Å; F434-F443 PolarHBondContact N-O 2.79Å; F434-F443 VanDerWaalsContact N-O 3.09Å; F434-F443 PolarHBondContact O-N 3.11Å; F434-K446 HydrophobicContact CD1-CB 3.96Å; F434-K446 HydrophobicContact CD1-CG 4.35Å; F434-K446 HydrophobicContact CE1-CB 3.85Å; F434-K446 HydrophobicContact CE1-CG 4.39Å; F434-K446 HydrophobicContact CG-CB 4.36Å; F434-K446 HydrophobicContact CZ-CB 4.15Å; F434-L449 HydrophobicContact CB-CB 4.24Å; F434-L449 HydrophobicContact CB-CD2 3.97Å
435	G	88.8	Confident	88.6	Confident	30 Å²	30	75.9 Å²	75.9	31%	0.309	39%	0.394	S	S	.	.			trans	-74.4	160.1	172.4	0	0	0	0	0	112.9	P433 K441 L449	P433-G435 PolarHBondContact O-N 3.04Å; G435-K441 CarbonylContact C-O 3.52Å; G435-L449 VanDerWaalsContact O-CD1 3.28Å; G435-L449 WeakPolarHBondContact O-CD1 3.44Å; G435-L449 WeakPolarHBondContact O-CD2 3.35Å
436	C	92.3	Very high	88.5	Confident	2 Å²	2	81.4 Å²	81.4	1%	0.014	42%	0.417	C	S	.	.			trans	-112.8	114.6	168.3	173.6	0	0	0	0	108.8	V438 C439 G440 K441 F443 L449 H452 M453 H456	C436-V438 PolarHBondContact O-N 2.89Å; C436-C439 PolarHBondContact O-N 3.5Å; C436-G440 WeakPolarHBondContact O-CA 3.48Å; C436-G440 PolarHBondContact O-N 3.41Å; C436-K441 VanDerWaalsContact CB-O 3.3Å; C436-K441 WeakPolarHBondContact CB-O 3.48Å; C436-K441 PolarHBondContact N-O 3.09Å; C436-F443 HydrophobicContact CB-CE2 4.26Å; C436-L449 HydrophobicContact CB-CD1 3.65Å; C436-H452 VanDerWaalsContact SG-CD2 3.59Å; C436-M453 HydrophobicContact CB-SD 4.48Å; C436-H456 PolarHBondContact SG-NE2 3.07Å
437	D	90.3	Very high	88.3	Confident	156 Å²	156	81.6 Å²	81.6	83%	0.834	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-23.8	-168.8	-41.1	-63.3	0	0	0	112.6
438	V	89.4	Confident	88.2	Confident	94 Å²	94	81 Å²	81	57%	0.57	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-23.9	-179.2	-174.7	0	0	0	0	113.1	C436 M453 H456	C436-V438 PolarHBondContact O-N 2.89Å; V438-M453 HydrophobicContact CG2-CE 4.04Å; V438-H456 HydrophobicContact CG1-CB 4.18Å; V438-H456 HydrophobicContact CG2-CB 4.49Å
439	C	90.4	Very high	88.2	Confident	46 Å²	46	78.3 Å²	78.3	31%	0.311	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.1	16.2	-176	73	0	0	0	0	116	C436 K441 H452 H456	C436-C439 PolarHBondContact O-N 3.5Å; C439-K441 PolarHBondContact O-N 2.9Å; C439-H452 PolarHBondContact SG-NE2 3.49Å; C439-H456 WeakPolarHBondContact CB-CE1 3.42Å; C439-H456 PolarHBondContact SG-CE1 3.45Å; C439-H456 PolarHBondContact SG-NE2 3.12Å
440	G	88.1	Confident	88.2	Confident	59 Å²	59	77.2 Å²	77.2	61%	0.608	41%	0.414	S	S	*	.			trans	67.8	-7.7	176.4	0	0	0	0	0	116.5	C436 R442	C436-G440 WeakPolarHBondContact O-CA 3.48Å; C436-G440 PolarHBondContact O-N 3.41Å; G440-R442 WeakPolarHBondContact O-CG 3.35Å; G440-R442 PolarHBondContact O-N 3.16Å
441	K	88.7	Confident	88.1	Confident	117 Å²	117	78 Å²	78	51%	0.509	41%	0.41	S	S	.	.			trans	-64.3	125.7	-175.9	-70.2	174.3	-169.7	160	0	111	G435 C436 C439 F443	G435-K441 CarbonylContact C-O 3.52Å; C436-K441 VanDerWaalsContact CB-O 3.3Å; C436-K441 WeakPolarHBondContact CB-O 3.48Å; C436-K441 PolarHBondContact N-O 3.09Å; C439-K441 PolarHBondContact O-N 2.9Å; K441-F443 HydrophobicContact CB-CE2 3.9Å; K441-F443 HydrophobicContact CB-CZ 4.06Å; K441-F443 WeakPolarHBondContact O-CD2 3.4Å; K441-F443 VanDerWaalsContact O-CE2 3.24Å; K441-F443 WeakPolarHBondContact O-CE2 3.32Å
442	R	89.9	Confident	88.1	Confident	160 Å²	160	75.5 Å²	75.5	60%	0.604	40%	0.398	S	S	*	.			trans	-103.6	141.1	-177.5	-56.9	-177.3	63.4	156.4	3.5	112.3	K432 F434 G440	K432-R442 HydrophobicContact CB-CB 3.63Å; K432-R442 HydrophobicContact CD-CB 4.41Å; K432-R442 PolarHBondContact O-NE 3.21Å; K432-R442 PolarHBondContact O-NH2 2.8Å; F434-R442 CarbonylContact O-C 3.59Å; F434-R442 WeakPolarHBondContact O-CA 3.44Å; G440-R442 WeakPolarHBondContact O-CG 3.35Å; G440-R442 PolarHBondContact O-N 3.16Å
443	F	87.4	Confident	88	Confident	44 Å²	44	72.6 Å²	72.6	19%	0.193	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-125.4	150.6	-176.3	-58.4	-90.1	0	0	0	111.6	K432 F434 C436 K441 L445 N448 L449 H452	K432-F443 CarbonylContact C-O 3.22Å; K432-F443 VanDerWaalsContact CA-O 3.26Å; K432-F443 WeakPolarHBondContact CA-O 3.24Å; F434-F443 HydrophobicContact CB-CB 4.44Å; F434-F443 PolarHBondContact N-O 2.79Å; F434-F443 VanDerWaalsContact N-O 3.09Å; F434-F443 PolarHBondContact O-N 3.11Å; C436-F443 HydrophobicContact CB-CE2 4.26Å; K441-F443 HydrophobicContact CB-CE2 3.9Å; K441-F443 HydrophobicContact CB-CZ 4.06Å; K441-F443 WeakPolarHBondContact O-CD2 3.4Å; K441-F443 VanDerWaalsContact O-CE2 3.24Å; K441-F443 WeakPolarHBondContact O-CE2 3.32Å; F443-L445 VanDerWaalsContact C-N 3.31Å; F443-N448 HydrophobicContact CB-CB 4.21Å; F443-N448 HydrophobicContact CD1-CB 3.92Å; F443-N448 HydrophobicContact CG-CB 4.33Å; F443-L449 HydrophobicContact CD2-CB 4.15Å; F443-L449 HydrophobicContact CD2-CD1 3.99Å; F443-L449 HydrophobicContact CE2-CD1 4.15Å; F443-L449 HydrophobicContact CG-CB 4.49Å; F443-H452 HydrophobicContact CE1-CB 4.11Å; F443-H452 HydrophobicContact CE2-CB 3.98Å; F443-H452 AromaticContact CE2-CD2 3.37Å; F443-H452 WeakPolarHBondContact CE2-CD2 3.26Å; F443-H452 AromaticContact CE2-CG 3.83Å; F443-H452 HydrophobicContact CZ-CB 3.56Å; F443-H452 AromaticContact CZ-CD2 3.36Å; F443-H452 WeakPolarHBondContact CZ-CD2 3.35Å; F443-H452 AromaticContact CZ-CG 3.4Å
444	N	85.3	Confident	87.8	Confident	45 Å²	45	70.4 Å²	70.4	24%	0.241	37%	0.373	C	S	.	.	S	Bend	trans	-77.2	-15.1	174.3	59.9	-11.1	0	0	0	113.5	R426 N448	R426-N444 PolarHBondContact NH1-O 3.44Å; R426-N444 VanDerWaalsContact NH1-O 3.11Å; N444-N448 PolarHBondContact OD1-ND2 3.32Å; N444-N448 VanDerWaalsContact OD1-ND2 3.15Å
445	L	86.6	Confident	87.6	Confident	35 Å²	35	72.5 Å²	72.5	18%	0.183	39%	0.391	C	S	.	.			trans	-137.4	140.6	-176.5	-60.6	177.2	0	0	0	113.4	R423 F443 S447 N448 L449	R423-L445 HydrophobicContact CG-CD2 3.66Å; F443-L445 VanDerWaalsContact C-N 3.31Å; L445-S447 VanDerWaalsContact C-N 3.29Å; L445-S447 PolarHBondContact O-N 2.9Å; L445-N448 HydrophobicContact CB-CB 4.21Å; L445-N448 PolarHBondContact O-N 3.34Å; L445-L449 PolarHBondContact O-N 3.29Å; L445-L449 VanDerWaalsContact O-N 3.1Å
446	K	86.5	Confident	87.5	Confident	156 Å²	156	74.6 Å²	74.6	68%	0.678	39%	0.392	S	S	*	.	H	α-helix	trans	-63.8	-31.1	174.1	-167.2	174.8	-177.8	176.8	0	112.8	F434 L449 K450	F434-K446 HydrophobicContact CD1-CB 3.96Å; F434-K446 HydrophobicContact CD1-CG 4.35Å; F434-K446 HydrophobicContact CE1-CB 3.85Å; F434-K446 HydrophobicContact CE1-CG 4.39Å; F434-K446 HydrophobicContact CG-CB 4.36Å; F434-K446 HydrophobicContact CZ-CB 4.15Å; K446-L449 PolarHBondContact O-N 2.89Å; K446-K450 WeakPolarHBondContact O-CB 3.32Å; K446-K450 PolarHBondContact O-N 2.89Å
447	S	83.9	Confident	87.1	Confident	68 Å²	68	78.1 Å²	78.1	48%	0.476	41%	0.414	S	S	.	.	H	α-helix	trans	-65.2	-45.2	172.6	49.8	0	0	0	0	112	L445 L449 K450 V451	L445-S447 VanDerWaalsContact C-N 3.29Å; L445-S447 PolarHBondContact O-N 2.9Å; S447-L449 VanDerWaalsContact C-N 3.3Å; S447-L449 PolarHBondContact O-N 3.4Å; S447-K450 PolarHBondContact O-N 3.49Å; S447-V451 WeakPolarHBondContact O-CG2 3.31Å; S447-V451 PolarHBondContact O-N 3.04Å
448	N	86.5	Confident	86.7	Confident	69 Å²	69	73.2 Å²	73.2	37%	0.369	40%	0.4	S	S	.	.	H	α-helix	trans	-61.9	-38.7	175.6	-67.8	-10.9	0	0	0	111.4	F443 N444 L445 H452	F443-N448 HydrophobicContact CB-CB 4.21Å; F443-N448 HydrophobicContact CD1-CB 3.92Å; F443-N448 HydrophobicContact CG-CB 4.33Å; N444-N448 PolarHBondContact OD1-ND2 3.32Å; N444-N448 VanDerWaalsContact OD1-ND2 3.15Å; L445-N448 HydrophobicContact CB-CB 4.21Å; L445-N448 PolarHBondContact O-N 3.34Å; N448-H452 WeakPolarHBondContact O-CB 3.43Å; N448-H452 PolarHBondContact O-N 3.46Å
449	L	88.8	Confident	86.3	Confident	28 Å²	28	74.7 Å²	74.7	15%	0.147	40%	0.4	C	S	.	.	H	α-helix	trans	-64.1	-50	171	176.1	62.6	0	0	0	112.1	F434 G435 C436 F443 L445 K446 S447 V451 H452 M453	F434-L449 HydrophobicContact CB-CB 4.24Å; F434-L449 HydrophobicContact CB-CD2 3.97Å; G435-L449 VanDerWaalsContact O-CD1 3.28Å; G435-L449 WeakPolarHBondContact O-CD1 3.44Å; G435-L449 WeakPolarHBondContact O-CD2 3.35Å; C436-L449 HydrophobicContact CB-CD1 3.65Å; F443-L449 HydrophobicContact CD2-CB 4.15Å; F443-L449 HydrophobicContact CD2-CD1 3.99Å; F443-L449 HydrophobicContact CE2-CD1 4.15Å; F443-L449 HydrophobicContact CG-CB 4.49Å; L445-L449 PolarHBondContact O-N 3.29Å; L445-L449 VanDerWaalsContact O-N 3.1Å; K446-L449 PolarHBondContact O-N 2.89Å; S447-L449 VanDerWaalsContact C-N 3.3Å; S447-L449 PolarHBondContact O-N 3.4Å; L449-V451 VanDerWaalsContact C-N 3.27Å; L449-V451 PolarHBondContact O-N 2.92Å; L449-H452 CarbonylContact O-C 3.51Å; L449-H452 WeakPolarHBondContact O-CA 3.21Å; L449-H452 WeakPolarHBondContact O-CB 3.44Å; L449-H452 PolarHBondContact O-N 3.02Å; L449-M453 HydrophobicContact CD1-CG 4.3Å; L449-M453 HydrophobicContact CD1-SD 4.04Å; L449-M453 WeakPolarHBondContact O-CG 3.16Å; L449-M453 PolarHBondContact O-N 3Å
450	K	86.9	Confident	85.9	Confident	158 Å²	158	78.4 Å²	78.4	69%	0.687	41%	0.411	S	S	*	.	H	α-helix	trans	-55.4	-42.9	178.1	-175.1	-177.3	178.7	-174.5	0	111.5	K446 S447 M453	K446-K450 WeakPolarHBondContact O-CB 3.32Å; K446-K450 PolarHBondContact O-N 2.89Å; S447-K450 PolarHBondContact O-N 3.49Å; K450-M453 PolarHBondContact O-N 3.41Å
451	V	85	Confident	85.7	Confident	59 Å²	59	80 Å²	80	36%	0.358	41%	0.411	S	S	.	.	H	α-helix	trans	-64.5	-42.9	173	167.5	0	0	0	0	111.2	S447 L449 M453 S454 I473	S447-V451 WeakPolarHBondContact O-CG2 3.31Å; S447-V451 PolarHBondContact O-N 3.04Å; L449-V451 VanDerWaalsContact C-N 3.27Å; L449-V451 PolarHBondContact O-N 2.92Å; V451-M453 VanDerWaalsContact C-N 3.34Å; V451-M453 PolarHBondContact O-N 3.4Å; V451-S454 WeakPolarHBondContact O-CB 3.41Å; V451-S454 PolarHBondContact O-N 3.26Å; V451-S454 PolarHBondContact O-OG 2.99Å; V451-I473 HydrophobicContact CG1-CD1 3.55Å; V451-I473 HydrophobicContact CG1-CG1 3.81Å
452	H	87.7	Confident	85.5	Confident	23 Å²	23	77.9 Å²	77.9	11%	0.106	40%	0.402	C	S	.	.	H	α-helix	trans	-62.9	-36.6	177.3	177.5	42.7	0	0	0	113.3	C436 C439 F443 N448 L449 S454 V455 H456	C436-H452 VanDerWaalsContact SG-CD2 3.59Å; C439-H452 PolarHBondContact SG-NE2 3.49Å; F443-H452 HydrophobicContact CE1-CB 4.11Å; F443-H452 HydrophobicContact CE2-CB 3.98Å; F443-H452 AromaticContact CE2-CD2 3.37Å; F443-H452 WeakPolarHBondContact CE2-CD2 3.26Å; F443-H452 AromaticContact CE2-CG 3.83Å; F443-H452 HydrophobicContact CZ-CB 3.56Å; F443-H452 AromaticContact CZ-CD2 3.36Å; F443-H452 WeakPolarHBondContact CZ-CD2 3.35Å; F443-H452 AromaticContact CZ-CG 3.4Å; N448-H452 WeakPolarHBondContact O-CB 3.43Å; N448-H452 PolarHBondContact O-N 3.46Å; L449-H452 CarbonylContact O-C 3.51Å; L449-H452 WeakPolarHBondContact O-CA 3.21Å; L449-H452 WeakPolarHBondContact O-CB 3.44Å; L449-H452 PolarHBondContact O-N 3.02Å; H452-S454 PolarHBondContact O-N 3.44Å; H452-S454 VanDerWaalsContact O-N 3.1Å; H452-V455 VanDerWaalsContact O-CB 3.29Å; H452-V455 WeakPolarHBondContact O-CB 3.37Å; H452-V455 WeakPolarHBondContact O-CG2 3.49Å; H452-V455 PolarHBondContact O-N 2.98Å; H452-H456 AromaticContact CD2-NE2 3.11Å; H452-H456 PolarHBondContact CD2-NE2 3.16Å; H452-H456 AromaticContact CE1-NE2 2.84Å; H452-H456 PolarHBondContact CE1-NE2 2.82Å; H452-H456 AromaticContact CG-NE2 3.98Å; H452-H456 AromaticContact ND1-NE2 3.84Å; H452-H456 AromaticContact NE2-CD2 3.98Å; H452-H456 AromaticContact NE2-NE2 2.24Å; H452-H456 PolarHBondContact NE2-NE2 3.38Å
453	M	86	Confident	85.3	Confident	54 Å²	54	71.5 Å²	71.5	27%	0.266	39%	0.386	S	S	.	.	H	α-helix	trans	-59.2	-24.3	179	-64.7	-52	-70.1	0	0	113.4	C436 V438 L449 K450 V451 V455 H456 T457	C436-M453 HydrophobicContact CB-SD 4.48Å; V438-M453 HydrophobicContact CG2-CE 4.04Å; L449-M453 HydrophobicContact CD1-CG 4.3Å; L449-M453 HydrophobicContact CD1-SD 4.04Å; L449-M453 WeakPolarHBondContact O-CG 3.16Å; L449-M453 PolarHBondContact O-N 3Å; K450-M453 PolarHBondContact O-N 3.41Å; V451-M453 VanDerWaalsContact C-N 3.34Å; V451-M453 PolarHBondContact O-N 3.4Å; M453-V455 PolarHBondContact O-N 3.48Å; M453-H456 PolarHBondContact O-N 2.87Å; M453-H456 VanDerWaalsContact O-N 3.08Å; M453-T457 PolarHBondContact O-N 3.11Å; M453-T457 PolarHBondContact O-OG1 3.01Å
454	S	85.6	Confident	85.3	Confident	17 Å²	17	69.5 Å²	69.5	12%	0.119	38%	0.378	C	S	.	.	H	α-helix	trans	-58.2	-25.1	171.9	70.8	0	0	0	0	114.2	V451 H452 G458 Q459 S472	V451-S454 WeakPolarHBondContact O-CB 3.41Å; V451-S454 PolarHBondContact O-N 3.26Å; V451-S454 PolarHBondContact O-OG 2.99Å; H452-S454 PolarHBondContact O-N 3.44Å; H452-S454 VanDerWaalsContact O-N 3.1Å; S454-G458 CarbonylContact O-C 3.59Å; S454-G458 WeakPolarHBondContact O-CA 3.16Å; S454-G458 PolarHBondContact O-N 3.22Å; S454-G458 VanDerWaalsContact O-N 3.1Å; S454-Q459 WeakPolarHBondContact CB-O 3.33Å; S454-Q459 PolarHBondContact O-N 2.84Å; S454-S472 VanDerWaalsContact OG-CB 3.23Å; S454-S472 WeakPolarHBondContact OG-CB 3.28Å
455	V	86.5	Confident	85.3	Confident	103 Å²	103	75 Å²	75	62%	0.624	41%	0.407	S	S	*	.	H	α-helix	trans	-71.6	-34.3	177.5	-177.7	0	0	0	0	110.9	H452 M453	H452-V455 VanDerWaalsContact O-CB 3.29Å; H452-V455 WeakPolarHBondContact O-CB 3.37Å; H452-V455 WeakPolarHBondContact O-CG2 3.49Å; H452-V455 PolarHBondContact O-N 2.98Å; M453-V455 PolarHBondContact O-N 3.48Å
456	H	85.4	Confident	85.1	Confident	74 Å²	74	78.8 Å²	78.8	34%	0.343	42%	0.424	S	S	.	.	H	α-helix	trans	-87	-36.4	-179.6	-57.5	-57.9	0	0	0	112.4	C436 V438 C439 H452 M453 G458	C436-H456 PolarHBondContact SG-NE2 3.07Å; V438-H456 HydrophobicContact CG1-CB 4.18Å; V438-H456 HydrophobicContact CG2-CB 4.49Å; C439-H456 WeakPolarHBondContact CB-CE1 3.42Å; C439-H456 PolarHBondContact SG-CE1 3.45Å; C439-H456 PolarHBondContact SG-NE2 3.12Å; H452-H456 AromaticContact CD2-NE2 3.11Å; H452-H456 PolarHBondContact CD2-NE2 3.16Å; H452-H456 AromaticContact CE1-NE2 2.84Å; H452-H456 PolarHBondContact CE1-NE2 2.82Å; H452-H456 AromaticContact CG-NE2 3.98Å; H452-H456 AromaticContact ND1-NE2 3.84Å; H452-H456 AromaticContact NE2-CD2 3.98Å; H452-H456 AromaticContact NE2-NE2 2.24Å; H452-H456 PolarHBondContact NE2-NE2 3.38Å; M453-H456 PolarHBondContact O-N 2.87Å; M453-H456 VanDerWaalsContact O-N 3.08Å; H456-G458 VanDerWaalsContact C-N 3.32Å
457	T	84.6	Confident	85	Confident	76 Å²	76	73.9 Å²	73.9	47%	0.466	41%	0.408	S	S	.	.	H	α-helix	trans	-84.6	-5.8	178.5	61.2	0	0	0	0	113.6	M453 Q459	M453-T457 PolarHBondContact O-N 3.11Å; M453-T457 PolarHBondContact O-OG1 3.01Å; T457-Q459 PolarHBondContact O-N 3.47Å; T457-Q459 WeakPolarHBondContact OG1-CB 3.43Å; T457-Q459 WeakPolarHBondContact OG1-CG 3.45Å; T457-Q459 PolarHBondContact OG1-N 3.26Å
458	G	81.1	Confident	84.9	Confident	52 Å²	52	73 Å²	73	54%	0.536	41%	0.41	S	S	.	.			trans	64.4	0.6	-172.8	0	0	0	0	0	114.7	S454 H456 K460	S454-G458 CarbonylContact O-C 3.59Å; S454-G458 WeakPolarHBondContact O-CA 3.16Å; S454-G458 PolarHBondContact O-N 3.22Å; S454-G458 VanDerWaalsContact O-N 3.1Å; H456-G458 VanDerWaalsContact C-N 3.32Å; G458-K460 PolarHBondContact O-N 2.8Å
459	Q	80.9	Confident	84.8	Confident	125 Å²	125	74.3 Å²	74.3	58%	0.584	42%	0.417	S	S	*	.			trans	-67.1	121.7	-170.6	-73.5	179.7	-6.6	0	0	111.5	S454 T457	S454-Q459 WeakPolarHBondContact CB-O 3.33Å; S454-Q459 PolarHBondContact O-N 2.84Å; T457-Q459 PolarHBondContact O-N 3.47Å; T457-Q459 WeakPolarHBondContact OG1-CB 3.43Å; T457-Q459 WeakPolarHBondContact OG1-CG 3.45Å; T457-Q459 PolarHBondContact OG1-N 3.26Å
460	K	83.3	Confident	84.7	Confident	125 Å²	125	79.5 Å²	79.5	54%	0.543	44%	0.438	S	S	.	.			trans	-122.6	80.2	176.2	-69.7	164	169.6	-175.9	0	108.8	G458 F462 K470 F471	G458-K460 PolarHBondContact O-N 2.8Å; K460-F462 VanDerWaalsContact C-N 3.25Å; K460-F462 PolarHBondContact O-N 3Å; K460-K470 HydrophobicContact CB-CB 3.57Å; K460-K470 HydrophobicContact CD-CB 4.26Å; K460-K470 WeakPolarHBondContact CD-O 3.4Å; K460-F471 CarbonylContact C-O 3.56Å; K460-F471 VanDerWaalsContact C-O 3.22Å; K460-F471 VanDerWaalsContact CA-O 3.3Å; K460-F471 WeakPolarHBondContact CA-O 3.33Å
461	P	82.6	Confident	84.5	Confident	92 Å²	92	74.1 Å²	74.1	60%	0.597	42%	0.415	S	S	*	.			trans	-70.3	-20.4	-170.7	-19.3	33.6	0	0	0	114
462	F	85.3	Confident	84.3	Confident	72 Å²	72	73.1 Å²	73.1	32%	0.316	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	90.8	-171	-53.6	-73.9	0	0	0	109.7	K460 F471 K474 L477	K460-F462 VanDerWaalsContact C-N 3.25Å; K460-F462 PolarHBondContact O-N 3Å; F462-F471 HydrophobicContact CB-CB 4.4Å; F462-F471 PolarHBondContact N-O 3.18Å; F462-F471 VanDerWaalsContact N-O 3.08Å; F462-F471 PolarHBondContact O-N 3.02Å; F462-K474 HydrophobicContact CD1-CB 3.96Å; F462-K474 HydrophobicContact CD1-CG 4.2Å; F462-K474 HydrophobicContact CD2-CB 4.48Å; F462-K474 HydrophobicContact CE1-CB 3.79Å; F462-K474 HydrophobicContact CE1-CD 4.38Å; F462-K474 HydrophobicContact CE1-CG 4.18Å; F462-K474 HydrophobicContact CE2-CB 4.33Å; F462-K474 HydrophobicContact CG-CB 4.3Å; F462-K474 HydrophobicContact CZ-CB 3.99Å; F462-L477 HydrophobicContact CB-CB 4.2Å; F462-L477 HydrophobicContact CB-CD2 3.9Å
463	G	84.6	Confident	84.1	Confident	27 Å²	27	74.5 Å²	74.5	28%	0.278	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	151.2	172.2	0	0	0	0	0	112.5	L469 L477	G463-L469 CarbonylContact C-O 3.43Å; G463-L477 WeakPolarHBondContact O-CD1 3.44Å; G463-L477 WeakPolarHBondContact O-CD2 3.47Å
464	C	87.6	Confident	83.9	Confident	2 Å²	2	79.1 Å²	79.1	1%	0.014	44%	0.437	C	S	.	.			trans	-95.8	123.1	160.1	174.5	0	0	0	0	108.5	E466 G468 L469 F471 L477 H480 M481 H484	C464-E466 VanDerWaalsContact C-N 3.31Å; C464-E466 PolarHBondContact O-N 2.85Å; C464-G468 WeakPolarHBondContact O-CA 3.45Å; C464-G468 PolarHBondContact O-N 3.03Å; C464-L469 WeakPolarHBondContact CB-O 3.24Å; C464-L469 PolarHBondContact N-O 3.27Å; C464-F471 HydrophobicContact CB-CE2 4.37Å; C464-L477 HydrophobicContact CB-CD1 3.7Å; C464-H480 PolarHBondContact SG-NE2 3.15Å; C464-M481 HydrophobicContact CB-SD 4.13Å; C464-M481 PolarHBondContact SG-SD 3.12Å; C464-H484 VanDerWaalsContact SG-CD2 3.59Å; C464-H484 PolarHBondContact SG-NE2 3.44Å
465	D	85.4	Confident	83.8	Confident	160 Å²	160	80.9 Å²	80.9	86%	0.856	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-24.8	-175.9	-49.8	-64.2	0	0	0	112.6
466	E	81.9	Confident	83.6	Confident	115 Å²	115	78.8 Å²	78.8	54%	0.537	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-24.9	-178	-61.7	-176.6	-109.7	0	0	113.9	C464 M481 H484	C464-E466 VanDerWaalsContact C-N 3.31Å; C464-E466 PolarHBondContact O-N 2.85Å; E466-M481 HydrophobicContact CG-CE 4.24Å; E466-M481 WeakPolarHBondContact OE1-CE 3.44Å; E466-H484 WeakPolarHBondContact OE1-CB 3.39Å; E466-H484 IonicContact OE1-CD2 2.74Å; E466-H484 IonicContact OE1-CG 3.79Å; E466-H484 WeakPolarHBondContact OE2-CB 3.4Å; E466-H484 IonicContact OE2-CG 2.63Å
467	C	84.9	Confident	83.6	Confident	52 Å²	52	76.6 Å²	76.6	35%	0.351	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.4	8.3	-178.3	71.6	0	0	0	0	115.2	L469 H480 H484	C467-L469 PolarHBondContact O-N 3.05Å; C467-H480 PolarHBondContact SG-NE2 3.17Å; C467-H484 WeakPolarHBondContact CB-CE1 3.47Å; C467-H484 WeakPolarHBondContact CB-NE2 3.38Å; C467-H484 PolarHBondContact SG-CE1 3.43Å; C467-H484 PolarHBondContact SG-NE2 3.24Å
468	G	82.3	Confident	83.6	Confident	50 Å²	50	76.6 Å²	76.6	52%	0.515	42%	0.419	S	S	.	.			trans	69.5	-6.2	178.2	0	0	0	0	0	116.1	C464 K470	C464-G468 WeakPolarHBondContact O-CA 3.45Å; C464-G468 PolarHBondContact O-N 3.03Å; G468-K470 WeakPolarHBondContact O-CG 3.38Å; G468-K470 PolarHBondContact O-N 2.28Å
469	L	84.6	Confident	83.5	Confident	97 Å²	97	75 Å²	75	51%	0.508	40%	0.401	S	S	.	.			trans	-62.8	126.3	-178	-73.4	179.7	0	0	0	111.5	G463 C464 C467 F471	G463-L469 CarbonylContact C-O 3.43Å; C464-L469 WeakPolarHBondContact CB-O 3.24Å; C464-L469 PolarHBondContact N-O 3.27Å; C467-L469 PolarHBondContact O-N 3.05Å; L469-F471 HydrophobicContact CB-CE2 3.91Å; L469-F471 HydrophobicContact CB-CZ 4.05Å; L469-F471 WeakPolarHBondContact O-CE2 3.41Å
470	K	86.1	Confident	83.6	Confident	137 Å²	137	70.1 Å²	70.1	60%	0.596	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	135.3	-177.1	-52.8	-170.9	-179	178.3	0	112	K460 G468	K460-K470 HydrophobicContact CB-CB 3.57Å; K460-K470 HydrophobicContact CD-CB 4.26Å; K460-K470 WeakPolarHBondContact CD-O 3.4Å; G468-K470 WeakPolarHBondContact O-CG 3.38Å; G468-K470 PolarHBondContact O-N 2.28Å
471	F	82.3	Confident	83.4	Confident	44 Å²	44	66.2 Å²	66.2	19%	0.193	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.2	-177.8	-57.5	-89.2	0	0	0	111.1	K460 F462 C464 L469 N476 L477 H480	K460-F471 CarbonylContact C-O 3.56Å; K460-F471 VanDerWaalsContact C-O 3.22Å; K460-F471 VanDerWaalsContact CA-O 3.3Å; K460-F471 WeakPolarHBondContact CA-O 3.33Å; F462-F471 HydrophobicContact CB-CB 4.4Å; F462-F471 PolarHBondContact N-O 3.18Å; F462-F471 VanDerWaalsContact N-O 3.08Å; F462-F471 PolarHBondContact O-N 3.02Å; C464-F471 HydrophobicContact CB-CE2 4.37Å; L469-F471 HydrophobicContact CB-CE2 3.91Å; L469-F471 HydrophobicContact CB-CZ 4.05Å; L469-F471 WeakPolarHBondContact O-CE2 3.41Å; F471-N476 HydrophobicContact CB-CB 4.32Å; F471-N476 HydrophobicContact CD1-CB 3.97Å; F471-N476 HydrophobicContact CG-CB 4.39Å; F471-L477 HydrophobicContact CB-CB 4.47Å; F471-L477 HydrophobicContact CD2-CB 4.01Å; F471-L477 HydrophobicContact CD2-CD1 3.87Å; F471-L477 HydrophobicContact CE2-CD1 4.01Å; F471-L477 HydrophobicContact CG-CB 4.4Å; F471-H480 HydrophobicContact CE1-CB 4.17Å; F471-H480 HydrophobicContact CE2-CB 3.96Å; F471-H480 AromaticContact CE2-CD2 3.57Å; F471-H480 AromaticContact CE2-CG 3.75Å; F471-H480 HydrophobicContact CZ-CB 3.56Å; F471-H480 AromaticContact CZ-CD2 3.67Å; F471-H480 AromaticContact CZ-CG 3.38Å; F471-H480 AromaticContact CZ-ND1 3.86Å
472	S	81.7	Confident	83.3	Confident	39 Å²	39	64 Å²	64	27%	0.273	34%	0.342	S	S	.	.	S	Bend	trans	-84.9	-8.2	174.4	50.1	0	0	0	0	114.2	S454	S454-S472 VanDerWaalsContact OG-CB 3.23Å; S454-S472 WeakPolarHBondContact OG-CB 3.28Å
473	I	83.4	Confident	82.9	Confident	52 Å²	52	64.4 Å²	64.4	27%	0.267	35%	0.346	S	S	.	.	S	Bend	trans	-137.1	129.3	-177.1	-43.8	-179.6	0	0	0	110	V451 S475 N476 L477	V451-I473 HydrophobicContact CG1-CD1 3.55Å; V451-I473 HydrophobicContact CG1-CG1 3.81Å; I473-S475 VanDerWaalsContact C-N 3.28Å; I473-S475 WeakPolarHBondContact CG2-OG 3.49Å; I473-S475 PolarHBondContact O-N 2.82Å; I473-N476 HydrophobicContact CB-CB 4.37Å; I473-N476 WeakPolarHBondContact O-CB 3.42Å; I473-N476 PolarHBondContact O-N 3.17Å; I473-L477 PolarHBondContact O-N 3.29Å
474	K	82.7	Confident	82.6	Confident	150 Å²	150	66.7 Å²	66.7	65%	0.652	35%	0.349	S	S	*	.	H	α-helix	trans	-56.7	-36.6	179.8	-168.8	177.8	179.7	-178	0	113.4	F462 L477 K478	F462-K474 HydrophobicContact CD1-CB 3.96Å; F462-K474 HydrophobicContact CD1-CG 4.2Å; F462-K474 HydrophobicContact CD2-CB 4.48Å; F462-K474 HydrophobicContact CE1-CB 3.79Å; F462-K474 HydrophobicContact CE1-CD 4.38Å; F462-K474 HydrophobicContact CE1-CG 4.18Å; F462-K474 HydrophobicContact CE2-CB 4.33Å; F462-K474 HydrophobicContact CG-CB 4.3Å; F462-K474 HydrophobicContact CZ-CB 3.99Å; K474-L477 WeakPolarHBondContact O-CB 3.41Å; K474-L477 PolarHBondContact O-N 2.8Å; K474-K478 PolarHBondContact O-N 3.42Å
475	S	81.9	Confident	81.9	Confident	55 Å²	55	73.1 Å²	73.1	39%	0.385	38%	0.377	S	S	.	.	H	α-helix	trans	-70.6	-28.1	176.5	54.7	0	0	0	0	113.5	I473 K478 A479	I473-S475 VanDerWaalsContact C-N 3.28Å; I473-S475 WeakPolarHBondContact CG2-OG 3.49Å; I473-S475 PolarHBondContact O-N 2.82Å; S475-K478 PolarHBondContact O-N 3.07Å; S475-A479 WeakPolarHBondContact O-CB 3.45Å; S475-A479 PolarHBondContact O-N 2.85Å
476	N	83.8	Confident	81	Confident	58 Å²	58	70.4 Å²	70.4	31%	0.31	36%	0.363	S	S	.	.	H	α-helix	trans	-69.2	-40.4	171.3	-71	-13.1	0	0	0	110.8	F471 I473 A479 H480	F471-N476 HydrophobicContact CB-CB 4.32Å; F471-N476 HydrophobicContact CD1-CB 3.97Å; F471-N476 HydrophobicContact CG-CB 4.39Å; I473-N476 HydrophobicContact CB-CB 4.37Å; I473-N476 WeakPolarHBondContact O-CB 3.42Å; I473-N476 PolarHBondContact O-N 3.17Å; N476-A479 PolarHBondContact O-N 3.45Å; N476-H480 WeakPolarHBondContact O-CB 3.46Å; N476-H480 PolarHBondContact O-N 2.83Å
477	L	85	Confident	80.3	Confident	29 Å²	29	69 Å²	69	15%	0.152	36%	0.356	C	S	.	.	H	α-helix	trans	-60.8	-49.8	170.4	176.1	63.6	0	0	0	111	F462 G463 C464 F471 I473 K474 A479 H480 M481	F462-L477 HydrophobicContact CB-CB 4.2Å; F462-L477 HydrophobicContact CB-CD2 3.9Å; G463-L477 WeakPolarHBondContact O-CD1 3.44Å; G463-L477 WeakPolarHBondContact O-CD2 3.47Å; C464-L477 HydrophobicContact CB-CD1 3.7Å; F471-L477 HydrophobicContact CB-CB 4.47Å; F471-L477 HydrophobicContact CD2-CB 4.01Å; F471-L477 HydrophobicContact CD2-CD1 3.87Å; F471-L477 HydrophobicContact CE2-CD1 4.01Å; F471-L477 HydrophobicContact CG-CB 4.4Å; I473-L477 PolarHBondContact O-N 3.29Å; K474-L477 WeakPolarHBondContact O-CB 3.41Å; K474-L477 PolarHBondContact O-N 2.8Å; L477-A479 PolarHBondContact O-N 3.21Å; L477-A479 VanDerWaalsContact O-N 3.15Å; L477-H480 CarbonylContact O-C 3.57Å; L477-H480 WeakPolarHBondContact O-CA 3.4Å; L477-H480 WeakPolarHBondContact O-CB 3.13Å; L477-H480 PolarHBondContact O-N 3.32Å; L477-M481 HydrophobicContact CD1-CG 4.15Å; L477-M481 HydrophobicContact CD1-SD 3.68Å; L477-M481 HydrophobicContact CG-CG 4.33Å; L477-M481 HydrophobicContact CG-SD 4.44Å; L477-M481 WeakPolarHBondContact O-CG 3.46Å; L477-M481 PolarHBondContact O-N 3.43Å
478	K	83.4	Confident	79.4	Confident	75 Å²	75	70.6 Å²	70.6	33%	0.326	36%	0.357	S	S	.	.	H	α-helix	trans	-62.6	-20	176.8	-168.3	175.5	174.4	-171.1	0	113.7	E163 S164 S165 K474 S475 R482	E163-K478 VanDerWaalsContact OE2-CD 3.27Å; E163-K478 WeakPolarHBondContact OE2-CD 3.36Å; E163-K478 VanDerWaalsContact OE2-CE 3.26Å; E163-K478 WeakPolarHBondContact OE2-CE 3.42Å; E163-K478 IonicContact OE2-NZ 3.74Å; E163-K478 PolarHBondContact OE2-NZ 2.97Å; S164-K478 PolarHBondContact O-NZ 3.31Å; S164-K478 VanDerWaalsContact O-NZ 3.09Å; S165-K478 PolarHBondContact OG-NZ 2.97Å; K474-K478 PolarHBondContact O-N 3.42Å; S475-K478 PolarHBondContact O-N 3.07Å; K478-R482 PolarHBondContact O-NE 3.41Å; K478-R482 PolarHBondContact O-NH2 3.08Å; K478-R482 VanDerWaalsContact O-NH2 3.15Å
479	A	79.5	Confident	78.8	Confident	20 Å²	20	71.3 Å²	71.3	17%	0.165	36%	0.358	C	S	.	.	H	α-helix	trans	-85.1	-30.4	169.8	0	0	0	0	0	112.9	S475 N476 L477 V501	S475-A479 WeakPolarHBondContact O-CB 3.45Å; S475-A479 PolarHBondContact O-N 2.85Å; N476-A479 PolarHBondContact O-N 3.45Å; L477-A479 PolarHBondContact O-N 3.21Å; L477-A479 VanDerWaalsContact O-N 3.15Å; A479-V501 HydrophobicContact CB-CG2 4.16Å
480	H	82.8	Confident	78.4	Confident	22 Å²	22	69.1 Å²	69.1	10%	0.102	35%	0.345	C	S	.	.	H	α-helix	trans	-74.7	-41.2	175.2	171.9	68.4	0	0	0	112.8	C464 C467 F471 N476 L477 R482 I483 H484	C464-H480 PolarHBondContact SG-NE2 3.15Å; C467-H480 PolarHBondContact SG-NE2 3.17Å; F471-H480 HydrophobicContact CE1-CB 4.17Å; F471-H480 HydrophobicContact CE2-CB 3.96Å; F471-H480 AromaticContact CE2-CD2 3.57Å; F471-H480 AromaticContact CE2-CG 3.75Å; F471-H480 HydrophobicContact CZ-CB 3.56Å; F471-H480 AromaticContact CZ-CD2 3.67Å; F471-H480 AromaticContact CZ-CG 3.38Å; F471-H480 AromaticContact CZ-ND1 3.86Å; N476-H480 WeakPolarHBondContact O-CB 3.46Å; N476-H480 PolarHBondContact O-N 2.83Å; L477-H480 CarbonylContact O-C 3.57Å; L477-H480 WeakPolarHBondContact O-CA 3.4Å; L477-H480 WeakPolarHBondContact O-CB 3.13Å; L477-H480 PolarHBondContact O-N 3.32Å; H480-R482 PolarHBondContact O-N 3.36Å; H480-I483 VanDerWaalsContact O-CB 3.24Å; H480-I483 WeakPolarHBondContact O-CB 3.47Å; H480-I483 WeakPolarHBondContact O-CG1 3.41Å; H480-I483 PolarHBondContact O-N 3.34Å; H480-H484 AromaticContact CD2-NE2 3.45Å; H480-H484 PolarHBondContact CD2-NE2 3.31Å; H480-H484 AromaticContact CE1-NE2 3.31Å; H480-H484 PolarHBondContact CE1-NE2 3.03Å; H480-H484 VanDerWaalsContact CE1-NE2 3.31Å; H480-H484 AromaticContact NE2-CD2 3.84Å; H480-H484 AromaticContact NE2-NE2 2.51Å; H480-H484 PolarHBondContact NE2-NE2 3.23Å
481	M	79.5	Confident	78	Confident	43 Å²	43	64.6 Å²	64.6	21%	0.212	33%	0.333	C	S	.	.	H	α-helix	trans	-58.9	-23.1	178.4	-59.3	-46.8	-68.6	0	0	113.7	C464 E466 L477 I483 H484 K485	C464-M481 HydrophobicContact CB-SD 4.13Å; C464-M481 PolarHBondContact SG-SD 3.12Å; E466-M481 HydrophobicContact CG-CE 4.24Å; E466-M481 WeakPolarHBondContact OE1-CE 3.44Å; L477-M481 HydrophobicContact CD1-CG 4.15Å; L477-M481 HydrophobicContact CD1-SD 3.68Å; L477-M481 HydrophobicContact CG-CG 4.33Å; L477-M481 HydrophobicContact CG-SD 4.44Å; L477-M481 WeakPolarHBondContact O-CG 3.46Å; L477-M481 PolarHBondContact O-N 3.43Å; M481-I483 PolarHBondContact O-N 3.33Å; M481-H484 PolarHBondContact O-N 3.5Å; M481-K485 PolarHBondContact O-N 2.85Å
482	R	80.9	Confident	78.1	Confident	46 Å²	46	62.6 Å²	62.6	17%	0.174	32%	0.324	C	S	.	.	H	α-helix	trans	-69.2	-8.8	172.1	-82.1	173	-88.5	163.8	-22.9	114.3	K478 H480 E487 N500	K478-R482 PolarHBondContact O-NE 3.41Å; K478-R482 PolarHBondContact O-NH2 3.08Å; K478-R482 VanDerWaalsContact O-NH2 3.15Å; H480-R482 PolarHBondContact O-N 3.36Å; R482-E487 HydrophobicContact CB-CB 4.26Å; R482-E487 HydrophobicContact CG-CB 3.98Å; R482-E487 PolarHBondContact O-N 3.37Å; R482-N500 HydrophobicContact CB-CB 4.36Å; R482-N500 PolarHBondContact NH1-O 2.79Å
483	I	77.6	Confident	78	Confident	80 Å²	80	67.4 Å²	67.4	41%	0.41	35%	0.347	S	S	.	.	H	α-helix	trans	-78.8	-50.8	169.1	-60.4	171.6	0	0	0	109.1	H480 M481 K485 D486 N500	H480-I483 VanDerWaalsContact O-CB 3.24Å; H480-I483 WeakPolarHBondContact O-CB 3.47Å; H480-I483 WeakPolarHBondContact O-CG1 3.41Å; H480-I483 PolarHBondContact O-N 3.34Å; M481-I483 PolarHBondContact O-N 3.33Å; I483-K485 PolarHBondContact O-N 3.18Å; I483-D486 PolarHBondContact O-N 2.89Å; I483-N500 VanDerWaalsContact CG1-ND2 3.35Å; I483-N500 WeakPolarHBondContact CG1-ND2 3.5Å
484	H	77.6	Confident	77.7	Confident	74 Å²	74	70.2 Å²	70.2	34%	0.343	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-39.8	-178	-64.6	-50	0	0	0	113.4	C464 E466 C467 H480 M481 D486	C464-H484 VanDerWaalsContact SG-CD2 3.59Å; C464-H484 PolarHBondContact SG-NE2 3.44Å; E466-H484 WeakPolarHBondContact OE1-CB 3.39Å; E466-H484 IonicContact OE1-CD2 2.74Å; E466-H484 IonicContact OE1-CG 3.79Å; E466-H484 WeakPolarHBondContact OE2-CB 3.4Å; E466-H484 IonicContact OE2-CG 2.63Å; C467-H484 WeakPolarHBondContact CB-CE1 3.47Å; C467-H484 WeakPolarHBondContact CB-NE2 3.38Å; C467-H484 PolarHBondContact SG-CE1 3.43Å; C467-H484 PolarHBondContact SG-NE2 3.24Å; H480-H484 AromaticContact CD2-NE2 3.45Å; H480-H484 PolarHBondContact CD2-NE2 3.31Å; H480-H484 AromaticContact CE1-NE2 3.31Å; H480-H484 PolarHBondContact CE1-NE2 3.03Å; H480-H484 VanDerWaalsContact CE1-NE2 3.31Å; H480-H484 AromaticContact NE2-CD2 3.84Å; H480-H484 AromaticContact NE2-NE2 2.51Å; H480-H484 PolarHBondContact NE2-NE2 3.23Å; M481-H484 PolarHBondContact O-N 3.5Å; H484-D486 PolarHBondContact O-N 3.2Å
485	K	73.4	Confident	77.6	Confident	138 Å²	138	65.5 Å²	65.5	60%	0.6	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	0.4	175.3	-60.9	-167	173.2	-162.9	0	114.8	M481 I483 E487	M481-K485 PolarHBondContact O-N 2.85Å; I483-K485 PolarHBondContact O-N 3.18Å; K485-E487 HydrophobicContact CB-CB 4.3Å; K485-E487 HydrophobicContact CB-CG 3.74Å; K485-E487 WeakPolarHBondContact CD-OE1 3.25Å; K485-E487 PolarHBondContact O-N 2.88Å
486	D	65.6	Low	77.3	Confident	102 Å²	102	65.4 Å²	65.4	55%	0.545	35%	0.352	S	S	.	.			trans	50.7	21.2	-171	-124	-19	0	0	0	115.1	I483 H484 K488	I483-D486 PolarHBondContact O-N 2.89Å; H484-D486 PolarHBondContact O-N 3.2Å; D486-K488 PolarHBondContact O-N 3.3Å; D486-K488 WeakPolarHBondContact OD1-CE 3.33Å; D486-K488 IonicContact OD1-NZ 2.57Å; D486-K488 PolarHBondContact OD1-NZ 3.49Å; D486-K488 IonicContact OD2-NZ 3.6Å
487	E	67.4	Low	77	Confident	86 Å²	86	68.6 Å²	68.6	40%	0.402	36%	0.363	S	S	.	.			trans	-70.1	69.2	-179.4	-79.4	176.4	-159.8	0	0	111.4	R482 K485 A489	R482-E487 HydrophobicContact CB-CB 4.26Å; R482-E487 HydrophobicContact CG-CB 3.98Å; R482-E487 PolarHBondContact O-N 3.37Å; K485-E487 HydrophobicContact CB-CB 4.3Å; K485-E487 HydrophobicContact CB-CG 3.74Å; K485-E487 WeakPolarHBondContact CD-OE1 3.25Å; K485-E487 PolarHBondContact O-N 2.88Å; E487-A489 PolarHBondContact O-N 2.83Å
488	K	66.1	Low	76.5	Confident	85 Å²	85	74.6 Å²	74.6	37%	0.37	38%	0.384	S	S	.	.			trans	-75.4	65	171.6	-58.2	168.5	-172.9	129.7	0	109.2	D486 F490 R498 F499	D486-K488 PolarHBondContact O-N 3.3Å; D486-K488 WeakPolarHBondContact OD1-CE 3.33Å; D486-K488 IonicContact OD1-NZ 2.57Å; D486-K488 PolarHBondContact OD1-NZ 3.49Å; D486-K488 IonicContact OD2-NZ 3.6Å; K488-F490 PolarHBondContact O-N 3Å; K488-R498 HydrophobicContact CB-CB 3.51Å; K488-R498 HydrophobicContact CD-CB 4.39Å; K488-R498 HydrophobicContact CG-CB 4.5Å; K488-R498 PolarHBondContact O-NE 3.26Å; K488-R498 PolarHBondContact O-NH2 3.1Å; K488-F499 CarbonylContact C-O 3.51Å; K488-F499 VanDerWaalsContact C-O 3.24Å; K488-F499 WeakPolarHBondContact CA-O 3.08Å
489	A	70.6	Confident	76.2	Confident	65 Å²	65	73.3 Å²	73.3	54%	0.537	38%	0.379	S	S	.	.			trans	-67.6	-15.9	-170.5	0	0	0	0	0	114.6	E487 F499	E487-A489 PolarHBondContact O-N 2.83Å; A489-F499 PolarHBondContact N-O 2.99Å
490	F	75.8	Confident	75.9	Confident	51 Å²	51	74.5 Å²	74.5	22%	0.224	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-108.5	90.9	-177.1	-57.1	-74.4	0	0	0	110	K488 R498 F499 K502 L505	K488-F490 PolarHBondContact O-N 3Å; F490-R498 CarbonylContact O-C 3.26Å; F490-R498 WeakPolarHBondContact O-CA 3.37Å; F490-F499 HydrophobicContact CB-CB 4.31Å; F490-F499 PolarHBondContact N-O 3.21Å; F490-F499 PolarHBondContact O-N 2.82Å; F490-K502 HydrophobicContact CD1-CB 3.82Å; F490-K502 HydrophobicContact CD1-CD 4.31Å; F490-K502 HydrophobicContact CD1-CG 3.99Å; F490-K502 HydrophobicContact CD2-CB 4.48Å; F490-K502 HydrophobicContact CE1-CB 3.69Å; F490-K502 HydrophobicContact CE1-CD 3.95Å; F490-K502 HydrophobicContact CE1-CG 4.01Å; F490-K502 HydrophobicContact CE2-CB 4.36Å; F490-K502 HydrophobicContact CG-CB 4.23Å; F490-K502 HydrophobicContact CZ-CB 3.97Å; F490-L505 HydrophobicContact CB-CB 4.13Å; F490-L505 HydrophobicContact CB-CD2 3.94Å
491	A	77.8	Confident	75.6	Confident	43 Å²	43	74.7 Å²	74.7	36%	0.355	39%	0.385	S	S	.	.			trans	-70.5	161.3	172.3	0	0	0	0	0	111.9	K497 R498 L505	A491-K497 CarbonylContact C-O 3.57Å; A491-R498 HydrophobicContact CB-CG 4.29Å; A491-L505 WeakPolarHBondContact O-CD1 3.42Å; A491-L505 WeakPolarHBondContact O-CD2 3.39Å
492	C	83.1	Confident	75.5	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.007	41%	0.406	C	S	.	.			trans	-112.9	115	169.3	168.8	0	0	0	0	108	E494 C495 G496 K497 F499 L505 M509 H512	C492-E494 VanDerWaalsContact C-N 3.27Å; C492-E494 PolarHBondContact O-N 2.74Å; C492-C495 PolarHBondContact O-N 3.38Å; C492-G496 VanDerWaalsContact O-CA 3.31Å; C492-G496 WeakPolarHBondContact O-CA 3.49Å; C492-G496 PolarHBondContact O-N 3.21Å; C492-K497 HydrophobicContact CB-CB 4.41Å; C492-K497 VanDerWaalsContact CB-O 3.23Å; C492-K497 WeakPolarHBondContact CB-O 3.4Å; C492-K497 PolarHBondContact N-O 3.4Å; C492-F499 HydrophobicContact CB-CE2 4.35Å; C492-L505 HydrophobicContact CB-CD1 3.68Å; C492-M509 HydrophobicContact CB-CE 4.43Å; C492-M509 HydrophobicContact CB-SD 4.14Å; C492-M509 PolarHBondContact SG-SD 3Å; C492-H512 PolarHBondContact SG-NE2 3.47Å
493	D	79.4	Confident	75.5	Confident	140 Å²	140	79.5 Å²	79.5	75%	0.749	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-30.8	-169.8	-37.8	-71.9	0	0	0	111.2	C495 M509	D493-C495 PolarHBondContact O-N 3.4Å; D493-M509 WeakPolarHBondContact OD2-CE 3.5Å
494	E	77.7	Confident	75.6	Confident	111 Å²	111	76.3 Å²	76.3	52%	0.519	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-16.2	178.6	-61.7	178.6	-112.1	0	0	114.5	C492 H512	C492-E494 VanDerWaalsContact C-N 3.27Å; C492-E494 PolarHBondContact O-N 2.74Å; E494-H512 IonicContact OE1-CD2 2.83Å; E494-H512 WeakPolarHBondContact OE2-CB 3.49Å; E494-H512 IonicContact OE2-CD2 3.27Å; E494-H512 IonicContact OE2-CG 2.64Å
495	C	81.6	Confident	75.8	Confident	51 Å²	51	73.9 Å²	73.9	35%	0.345	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.4	14.6	-179.1	77.9	0	0	0	0	116.9	C492 D493 K497 H508 H512	C492-C495 PolarHBondContact O-N 3.38Å; D493-C495 PolarHBondContact O-N 3.4Å; C495-K497 PolarHBondContact O-N 2.68Å; C495-K497 VanDerWaalsContact SG-CD 3.6Å; C495-H508 PolarHBondContact SG-NE2 3.41Å; C495-H512 PolarHBondContact SG-CE1 3.42Å; C495-H512 PolarHBondContact SG-NE2 3.05Å
496	G	75.3	Confident	76.1	Confident	54 Å²	54	74 Å²	74	56%	0.557	39%	0.386	S	S	*	.			trans	69.6	-7.6	177.8	0	0	0	0	0	116.6	C492 R498	C492-G496 VanDerWaalsContact O-CA 3.31Å; C492-G496 WeakPolarHBondContact O-CA 3.49Å; C492-G496 PolarHBondContact O-N 3.21Å; G496-R498 WeakPolarHBondContact O-CG 3.34Å; G496-R498 PolarHBondContact O-N 3.12Å
497	K	77.5	Confident	76.7	Confident	124 Å²	124	74.6 Å²	74.6	54%	0.539	38%	0.38	S	S	.	.			trans	-65.7	122.1	-175.6	-71.1	175.4	-171.6	164.9	0	111.5	A491 C492 C495 F499	A491-K497 CarbonylContact C-O 3.57Å; C492-K497 HydrophobicContact CB-CB 4.41Å; C492-K497 VanDerWaalsContact CB-O 3.23Å; C492-K497 WeakPolarHBondContact CB-O 3.4Å; C492-K497 PolarHBondContact N-O 3.4Å; C495-K497 PolarHBondContact O-N 2.68Å; C495-K497 VanDerWaalsContact SG-CD 3.6Å; K497-F499 HydrophobicContact CB-CE2 3.88Å; K497-F499 HydrophobicContact CB-CZ 4.13Å; K497-F499 WeakPolarHBondContact O-CD2 3.36Å; K497-F499 WeakPolarHBondContact O-CE2 3.29Å
498	R	74.7	Confident	77.4	Confident	155 Å²	155	71.6 Å²	71.6	59%	0.585	37%	0.366	S	S	*	.			trans	-100.1	140.3	-176.9	-55	179.9	59.6	176.2	-0.3	112.2	K488 F490 A491 G496	K488-R498 HydrophobicContact CB-CB 3.51Å; K488-R498 HydrophobicContact CD-CB 4.39Å; K488-R498 HydrophobicContact CG-CB 4.5Å; K488-R498 PolarHBondContact O-NE 3.26Å; K488-R498 PolarHBondContact O-NH2 3.1Å; F490-R498 CarbonylContact O-C 3.26Å; F490-R498 WeakPolarHBondContact O-CA 3.37Å; A491-R498 HydrophobicContact CB-CG 4.29Å; G496-R498 WeakPolarHBondContact O-CG 3.34Å; G496-R498 PolarHBondContact O-N 3.12Å
499	F	77.3	Confident	77.9	Confident	48 Å²	48	69.4 Å²	69.4	21%	0.211	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-126.7	151.4	-176.6	-59.3	-92.5	0	0	0	111.7	K488 A489 F490 C492 K497 L505 H508	K488-F499 CarbonylContact C-O 3.51Å; K488-F499 VanDerWaalsContact C-O 3.24Å; K488-F499 WeakPolarHBondContact CA-O 3.08Å; A489-F499 PolarHBondContact N-O 2.99Å; F490-F499 HydrophobicContact CB-CB 4.31Å; F490-F499 PolarHBondContact N-O 3.21Å; F490-F499 PolarHBondContact O-N 2.82Å; C492-F499 HydrophobicContact CB-CE2 4.35Å; K497-F499 HydrophobicContact CB-CE2 3.88Å; K497-F499 HydrophobicContact CB-CZ 4.13Å; K497-F499 WeakPolarHBondContact O-CD2 3.36Å; K497-F499 WeakPolarHBondContact O-CE2 3.29Å; F499-L505 HydrophobicContact CD2-CB 4.14Å; F499-L505 HydrophobicContact CD2-CD1 3.95Å; F499-L505 HydrophobicContact CE2-CD1 4.13Å; F499-L505 HydrophobicContact CG-CB 4.47Å; F499-H508 HydrophobicContact CE1-CB 4.25Å; F499-H508 HydrophobicContact CE2-CB 4.07Å; F499-H508 AromaticContact CE2-CD2 3.34Å; F499-H508 WeakPolarHBondContact CE2-CD2 3.49Å; F499-H508 AromaticContact CE2-CG 3.93Å; F499-H508 HydrophobicContact CZ-CB 3.63Å; F499-H508 AromaticContact CZ-CD2 3.35Å; F499-H508 WeakPolarHBondContact CZ-CD2 3.4Å; F499-H508 AromaticContact CZ-CG 3.53Å
500	N	72.6	Confident	78.2	Confident	45 Å²	45	70 Å²	70	24%	0.241	35%	0.349	C	S	.	.	S	Bend	trans	-80	-20.1	175.6	56	-3.2	0	0	0	114	R482 I483	R482-N500 HydrophobicContact CB-CB 4.36Å; R482-N500 PolarHBondContact NH1-O 2.79Å; I483-N500 VanDerWaalsContact CG1-ND2 3.35Å; I483-N500 WeakPolarHBondContact CG1-ND2 3.5Å
501	V	75.3	Confident	78.1	Confident	27 Å²	27	70.8 Å²	70.8	16%	0.164	36%	0.36	C	S	.	.	S	Bend	trans	-137.2	131.6	-176.9	-168.1	0	0	0	0	112.2	A479 S503 S504 L505	A479-V501 HydrophobicContact CB-CG2 4.16Å; V501-S503 VanDerWaalsContact CG1-OG 3.29Å; V501-S503 WeakPolarHBondContact CG1-OG 3.32Å; V501-S503 PolarHBondContact O-N 3.5Å; V501-S503 VanDerWaalsContact O-N 3.1Å; V501-S504 WeakPolarHBondContact O-CB 3.27Å; V501-S504 PolarHBondContact O-N 3.37Å; V501-L505 PolarHBondContact O-N 2.98Å
502	K	78.9	Confident	77.9	Confident	148 Å²	148	71.8 Å²	71.8	64%	0.643	36%	0.357	S	S	*	.	H	α-helix	trans	-55.2	-27.6	-179.6	-161.6	165.2	-174.6	165.8	0	114.2	F490 K506	F490-K502 HydrophobicContact CD1-CB 3.82Å; F490-K502 HydrophobicContact CD1-CD 4.31Å; F490-K502 HydrophobicContact CD1-CG 3.99Å; F490-K502 HydrophobicContact CD2-CB 4.48Å; F490-K502 HydrophobicContact CE1-CB 3.69Å; F490-K502 HydrophobicContact CE1-CD 3.95Å; F490-K502 HydrophobicContact CE1-CG 4.01Å; F490-K502 HydrophobicContact CE2-CB 4.36Å; F490-K502 HydrophobicContact CG-CB 4.23Å; F490-K502 HydrophobicContact CZ-CB 3.97Å; K502-K506 PolarHBondContact O-N 3.36Å
503	S	79.6	Confident	77.3	Confident	41 Å²	41	77.9 Å²	77.9	29%	0.287	38%	0.384	S	S	.	.	H	α-helix	trans	-70.2	-35.2	173.4	53.9	0	0	0	0	113.1	V501 R507	V501-S503 VanDerWaalsContact CG1-OG 3.29Å; V501-S503 WeakPolarHBondContact CG1-OG 3.32Å; V501-S503 PolarHBondContact O-N 3.5Å; V501-S503 VanDerWaalsContact O-N 3.1Å; S503-R507 WeakPolarHBondContact O-CB 3.49Å; S503-R507 PolarHBondContact O-N 2.89Å
504	S	80.9	Confident	76.6	Confident	13 Å²	13	73.7 Å²	73.7	9%	0.091	37%	0.374	C	S	.	.	H	α-helix	trans	-67	-40.5	173.3	-64.9	0	0	0	0	111	V501 R507 H508	V501-S504 WeakPolarHBondContact O-CB 3.27Å; V501-S504 PolarHBondContact O-N 3.37Å; S504-R507 PolarHBondContact O-N 2.8Å; S504-H508 WeakPolarHBondContact O-CB 3.35Å; S504-H508 PolarHBondContact O-N 2.97Å
505	L	81.6	Confident	76	Confident	23 Å²	23	71.4 Å²	71.4	12%	0.12	36%	0.363	C	S	.	.	H	α-helix	trans	-62.4	-53.4	172	177.1	63.6	0	0	0	111.8	F490 A491 C492 F499 V501 R507 H508 M509	F490-L505 HydrophobicContact CB-CB 4.13Å; F490-L505 HydrophobicContact CB-CD2 3.94Å; A491-L505 WeakPolarHBondContact O-CD1 3.42Å; A491-L505 WeakPolarHBondContact O-CD2 3.39Å; C492-L505 HydrophobicContact CB-CD1 3.68Å; F499-L505 HydrophobicContact CD2-CB 4.14Å; F499-L505 HydrophobicContact CD2-CD1 3.95Å; F499-L505 HydrophobicContact CE2-CD1 4.13Å; F499-L505 HydrophobicContact CG-CB 4.47Å; V501-L505 PolarHBondContact O-N 2.98Å; L505-R507 PolarHBondContact O-N 3.44Å; L505-R507 VanDerWaalsContact O-N 3.16Å; L505-H508 CarbonylContact O-C 3.24Å; L505-H508 WeakPolarHBondContact O-CA 3.49Å; L505-H508 WeakPolarHBondContact O-CB 3.47Å; L505-H508 PolarHBondContact O-N 2.9Å; L505-M509 HydrophobicContact CD1-CE 4.12Å; L505-M509 HydrophobicContact CD1-CG 4.19Å; L505-M509 HydrophobicContact CD1-SD 3.72Å; L505-M509 HydrophobicContact CG-CG 4.36Å; L505-M509 HydrophobicContact CG-SD 4.47Å; L505-M509 WeakPolarHBondContact O-CG 3.45Å; L505-M509 PolarHBondContact O-N 3.39Å
506	K	80.1	Confident	75.6	Confident	141 Å²	141	75.7 Å²	75.7	61%	0.613	37%	0.372	S	S	*	.	H	α-helix	trans	-60.8	-28.3	179	-172.7	161.6	-175.4	162.1	0	112.6	K502	K502-K506 PolarHBondContact O-N 3.36Å
507	R	78.4	Confident	75.5	Confident	115 Å²	115	76.8 Å²	76.8	43%	0.434	37%	0.369	S	S	.	.	H	α-helix	trans	-71.9	-32.5	171	-172.7	174	64.8	-175.4	-1.2	112.8	S503 S504 L505 L529	S503-R507 WeakPolarHBondContact O-CB 3.49Å; S503-R507 PolarHBondContact O-N 2.89Å; S504-R507 PolarHBondContact O-N 2.8Å; L505-R507 PolarHBondContact O-N 3.44Å; L505-R507 VanDerWaalsContact O-N 3.16Å; R507-L529 HydrophobicContact CG-CD1 3.94Å; R507-L529 HydrophobicContact CG-CD2 3.57Å; R507-L529 HydrophobicContact CG-CG 4.43Å
508	H	81.1	Confident	75.4	Confident	23 Å²	23	74 Å²	74	11%	0.106	36%	0.357	C	S	.	.	H	α-helix	trans	-77.8	-39.6	176.4	174.5	42.5	0	0	0	113.2	C495 F499 S504 L505 K510 S511 H512	C495-H508 PolarHBondContact SG-NE2 3.41Å; F499-H508 HydrophobicContact CE1-CB 4.25Å; F499-H508 HydrophobicContact CE2-CB 4.07Å; F499-H508 AromaticContact CE2-CD2 3.34Å; F499-H508 WeakPolarHBondContact CE2-CD2 3.49Å; F499-H508 AromaticContact CE2-CG 3.93Å; F499-H508 HydrophobicContact CZ-CB 3.63Å; F499-H508 AromaticContact CZ-CD2 3.35Å; F499-H508 WeakPolarHBondContact CZ-CD2 3.4Å; F499-H508 AromaticContact CZ-CG 3.53Å; S504-H508 WeakPolarHBondContact O-CB 3.35Å; S504-H508 PolarHBondContact O-N 2.97Å; L505-H508 CarbonylContact O-C 3.24Å; L505-H508 WeakPolarHBondContact O-CA 3.49Å; L505-H508 WeakPolarHBondContact O-CB 3.47Å; L505-H508 PolarHBondContact O-N 2.9Å; H508-K510 PolarHBondContact O-N 2.82Å; H508-K510 VanDerWaalsContact O-N 3.13Å; H508-S511 PolarHBondContact ND1-OG 2.82Å; H508-S511 VanDerWaalsContact ND1-OG 3.07Å; H508-S511 WeakPolarHBondContact O-CA 3.38Å; H508-S511 WeakPolarHBondContact O-CB 3.33Å; H508-S511 PolarHBondContact O-N 3.47Å; H508-S511 PolarHBondContact O-OG 3.14Å; H508-H512 AromaticContact CE1-CE1 3.54Å; H508-H512 AromaticContact CE1-NE2 3.3Å; H508-H512 PolarHBondContact CE1-NE2 2.83Å; H508-H512 VanDerWaalsContact CE1-NE2 3.3Å; H508-H512 AromaticContact NE2-CE1 3.81Å; H508-H512 AromaticContact NE2-NE2 3.21Å; H508-H512 PolarHBondContact NE2-NE2 3.3Å
509	M	77.1	Confident	75.6	Confident	38 Å²	38	69.5 Å²	69.5	19%	0.187	35%	0.349	C	S	.	.	H	α-helix	trans	-57.9	-31.1	177.9	-57.4	-46.7	-127.7	0	0	112.6	C492 D493 L505 S511 H512 K513	C492-M509 HydrophobicContact CB-CE 4.43Å; C492-M509 HydrophobicContact CB-SD 4.14Å; C492-M509 PolarHBondContact SG-SD 3Å; D493-M509 WeakPolarHBondContact OD2-CE 3.5Å; L505-M509 HydrophobicContact CD1-CE 4.12Å; L505-M509 HydrophobicContact CD1-CG 4.19Å; L505-M509 HydrophobicContact CD1-SD 3.72Å; L505-M509 HydrophobicContact CG-CG 4.36Å; L505-M509 HydrophobicContact CG-SD 4.47Å; L505-M509 WeakPolarHBondContact O-CG 3.45Å; L505-M509 PolarHBondContact O-N 3.39Å; M509-S511 PolarHBondContact O-N 3.34Å; M509-H512 PolarHBondContact O-N 3.17Å; M509-H512 VanDerWaalsContact O-N 3.08Å; M509-K513 PolarHBondContact O-N 3.09Å
510	K	76.8	Confident	75.9	Confident	79 Å²	79	67.3 Å²	67.3	34%	0.343	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-18.9	171.7	-73.5	-173.5	172	-73.7	0	114.5	H508 E515	H508-K510 PolarHBondContact O-N 2.82Å; H508-K510 VanDerWaalsContact O-N 3.13Å; K510-E515 IonicContact NZ-OE2 2.73Å; K510-E515 PolarHBondContact NZ-OE2 3.22Å
511	S	72.9	Confident	76.3	Confident	67 Å²	67	74 Å²	74	47%	0.469	37%	0.37	S	S	.	.	H	α-helix	trans	-80.4	-24.2	173.8	64.9	0	0	0	0	113.6	H508 M509	H508-S511 PolarHBondContact ND1-OG 2.82Å; H508-S511 VanDerWaalsContact ND1-OG 3.07Å; H508-S511 WeakPolarHBondContact O-CA 3.38Å; H508-S511 WeakPolarHBondContact O-CB 3.33Å; H508-S511 PolarHBondContact O-N 3.47Å; H508-S511 PolarHBondContact O-OG 3.14Å; M509-S511 PolarHBondContact O-N 3.34Å
512	H	75	Confident	76.6	Confident	64 Å²	64	77.5 Å²	77.5	30%	0.296	39%	0.386	S	S	.	.	H	α-helix	trans	-84.4	-44.7	175.5	-59.2	-49.9	0	0	0	112.3	C492 E494 C495 H508 M509 G514	C492-H512 PolarHBondContact SG-NE2 3.47Å; E494-H512 IonicContact OE1-CD2 2.83Å; E494-H512 WeakPolarHBondContact OE2-CB 3.49Å; E494-H512 IonicContact OE2-CD2 3.27Å; E494-H512 IonicContact OE2-CG 2.64Å; C495-H512 PolarHBondContact SG-CE1 3.42Å; C495-H512 PolarHBondContact SG-NE2 3.05Å; H508-H512 AromaticContact CE1-CE1 3.54Å; H508-H512 AromaticContact CE1-NE2 3.3Å; H508-H512 PolarHBondContact CE1-NE2 2.83Å; H508-H512 VanDerWaalsContact CE1-NE2 3.3Å; H508-H512 AromaticContact NE2-CE1 3.81Å; H508-H512 AromaticContact NE2-NE2 3.21Å; H508-H512 PolarHBondContact NE2-NE2 3.3Å; M509-H512 PolarHBondContact O-N 3.17Å; M509-H512 VanDerWaalsContact O-N 3.08Å; H512-G514 PolarHBondContact O-N 2.6Å
513	K	70.1	Confident	76.8	Confident	129 Å²	129	73.2 Å²	73.2	56%	0.561	38%	0.375	S	S	*	.	S	Bend	trans	-59.8	1.9	175.9	-69.9	-166.7	172.1	-167.4	0	115.2	M509 E515	M509-K513 PolarHBondContact O-N 3.09Å; K513-E515 HydrophobicContact CB-CG 4.04Å; K513-E515 VanDerWaalsContact CD-OE1 3.25Å; K513-E515 WeakPolarHBondContact CD-OE1 3.36Å; K513-E515 PolarHBondContact O-N 3.31Å
514	G	65.1	Low	76.7	Confident	52 Å²	52	73.7 Å²	73.7	54%	0.536	39%	0.385	S	S	.	.			trans	66.4	-1.3	-177.1	0	0	0	0	0	114.8	H512 R516	H512-G514 PolarHBondContact O-N 2.6Å; G514-R516 PolarHBondContact O-N 2.87Å
515	E	65.1	Low	76.7	Confident	63 Å²	63	79.2 Å²	79.2	29%	0.294	41%	0.408	S	S	.	.			trans	-57.9	102.3	-177.2	-74.8	178.5	-136.9	0	0	111	K510 K513 P517 A528	K510-E515 IonicContact NZ-OE2 2.73Å; K510-E515 PolarHBondContact NZ-OE2 3.22Å; K513-E515 HydrophobicContact CB-CG 4.04Å; K513-E515 VanDerWaalsContact CD-OE1 3.25Å; K513-E515 WeakPolarHBondContact CD-OE1 3.36Å; K513-E515 PolarHBondContact O-N 3.31Å; E515-P517 VanDerWaalsContact C-CD 3.48Å; E515-P517 WeakPolarHBondContact O-CD 3.29Å; E515-A528 WeakPolarHBondContact O-CA 3.37Å; E515-A528 WeakPolarHBondContact O-CB 3.11Å
516	R	71.9	Confident	76.5	Confident	141 Å²	141	85.4 Å²	85.4	53%	0.532	43%	0.43	S	S	.	.			trans	-120.3	75.1	169.7	-63.3	174.9	177.8	-151.1	12	109.5	G514 F518 R526 L527	G514-R516 PolarHBondContact O-N 2.87Å; R516-F518 VanDerWaalsContact C-N 3.28Å; R516-F518 PolarHBondContact O-N 3.49Å; R516-R526 HydrophobicContact CB-CB 3.82Å; R516-R526 WeakPolarHBondContact CD-O 3.39Å; R516-R526 PolarHBondContact NH1-O 3.12Å; R516-R526 PolarHBondContact O-NE 3.41Å; R516-R526 PolarHBondContact O-NH2 2.69Å; R516-L527 CarbonylContact C-O 3.57Å; R516-L527 WeakPolarHBondContact CA-O 3.24Å
517	P	73.3	Confident	76.4	Confident	76 Å²	76	80.7 Å²	80.7	49%	0.494	41%	0.411	S	S	.	.			trans	-76.3	-18.2	-175.4	-11.9	29.9	0	0	0	112.6	E515	E515-P517 VanDerWaalsContact C-CD 3.48Å; E515-P517 WeakPolarHBondContact O-CD 3.29Å
518	F	75.1	Confident	76.1	Confident	67 Å²	67	76.4 Å²	76.4	29%	0.294	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	95.1	-173.2	-53.2	-72.3	0	0	0	109.8	R516 L527 L529 K530 L533	R516-F518 VanDerWaalsContact C-N 3.28Å; R516-F518 PolarHBondContact O-N 3.49Å; F518-L527 PolarHBondContact N-O 2.91Å; F518-L527 PolarHBondContact O-N 3.35Å; F518-L529 VanDerWaalsContact CD2-C 3.45Å; F518-K530 HydrophobicContact CD1-CB 3.98Å; F518-K530 HydrophobicContact CD1-CG 4.26Å; F518-K530 HydrophobicContact CD2-CB 4.48Å; F518-K530 HydrophobicContact CE1-CB 3.79Å; F518-K530 HydrophobicContact CE1-CD 4.1Å; F518-K530 HydrophobicContact CE1-CG 4.21Å; F518-K530 HydrophobicContact CE2-CB 4.31Å; F518-K530 HydrophobicContact CG-CB 4.33Å; F518-K530 HydrophobicContact CZ-CB 3.96Å; F518-L533 HydrophobicContact CB-CB 4.15Å; F518-L533 HydrophobicContact CB-CD2 3.89Å
519	S	79.9	Confident	75.8	Confident	59 Å²	59	77.3 Å²	77.3	41%	0.413	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	142.2	170.3	40.6	0	0	0	0	111.7	L533	S519-L533 WeakPolarHBondContact O-CD2 3.49Å
520	C	83.7	Confident	75.8	Confident	2 Å²	2	82.1 Å²	82.1	1%	0.014	43%	0.425	C	S	.	.			trans	-78.1	124.1	158.1	169.2	0	0	0	0	109	C523 G524 K525 L533 M537 H540	C520-C523 PolarHBondContact SG-N 3.47Å; C520-G524 CarbonylContact O-C 3.32Å; C520-G524 WeakPolarHBondContact O-CA 3.19Å; C520-G524 PolarHBondContact O-N 3.08Å; C520-K525 HydrophobicContact CB-CB 4.13Å; C520-K525 WeakPolarHBondContact CB-O 3.4Å; C520-K525 PolarHBondContact N-O 3.28Å; C520-L533 HydrophobicContact CB-CD1 4.05Å; C520-M537 HydrophobicContact CB-CE 4Å; C520-M537 WeakPolarHBondContact SG-CE 3.46Å; C520-H540 PolarHBondContact SG-NE2 3.08Å; C520-H540 VanDerWaalsContact SG-NE2 3.36Å
521	E	80.9	Confident	75.8	Confident	186 Å²	186	80.9 Å²	80.9	87%	0.869	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-33.4	177.5	-72.4	156.5	-148.7	0	0	112
522	I	81.2	Confident	76.2	Confident	100 Å²	100	79.4 Å²	79.4	51%	0.513	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-34.3	-175.3	-54.8	173.1	0	0	0	112.7	M537 H540	I522-M537 HydrophobicContact CD1-CE 4.22Å; I522-M537 HydrophobicContact CD1-SD 4.37Å; I522-M537 HydrophobicContact CG1-CE 4.47Å; I522-H540 HydrophobicContact CD1-CB 3.59Å; I522-H540 HydrophobicContact CG2-CB 4.45Å; I522-H540 WeakPolarHBondContact CG2-ND1 3.1Å
523	C	84.2	Confident	76.4	Confident	59 Å²	59	77.8 Å²	77.8	40%	0.399	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.4	22.4	-179.3	75.3	0	0	0	0	115.3	C520 K525 H536 H540	C520-C523 PolarHBondContact SG-N 3.47Å; C523-K525 PolarHBondContact O-N 2.94Å; C523-H536 PolarHBondContact SG-NE2 3.25Å; C523-H536 VanDerWaalsContact SG-NE2 3.44Å; C523-H540 PolarHBondContact SG-CE1 3.11Å; C523-H540 PolarHBondContact SG-NE2 3.23Å
524	G	77.4	Confident	76.9	Confident	50 Å²	50	78.9 Å²	78.9	52%	0.515	42%	0.415	S	S	.	.			trans	69	-11.6	172.6	0	0	0	0	0	116.7	C520 R526	C520-G524 CarbonylContact O-C 3.32Å; C520-G524 WeakPolarHBondContact O-CA 3.19Å; C520-G524 PolarHBondContact O-N 3.08Å; G524-R526 PolarHBondContact O-N 2.99Å
525	K	80.6	Confident	77.6	Confident	130 Å²	130	85.5 Å²	85.5	57%	0.565	42%	0.423	S	S	*	.			trans	-56.2	109.3	-175.1	-74.6	179.1	-176.3	170.7	0	112	C520 C523	C520-K525 HydrophobicContact CB-CB 4.13Å; C520-K525 WeakPolarHBondContact CB-O 3.4Å; C520-K525 PolarHBondContact N-O 3.28Å; C523-K525 PolarHBondContact O-N 2.94Å
526	R	76.9	Confident	78.4	Confident	152 Å²	152	83.6 Å²	83.6	57%	0.574	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	131.8	177	-63.9	-176.2	63.2	179.6	1.7	111.6	R516 G524	R516-R526 HydrophobicContact CB-CB 3.82Å; R516-R526 WeakPolarHBondContact CD-O 3.39Å; R516-R526 PolarHBondContact NH1-O 3.12Å; R516-R526 PolarHBondContact O-NE 3.41Å; R516-R526 PolarHBondContact O-NH2 2.69Å; G524-R526 PolarHBondContact O-N 2.99Å
527	L	76.9	Confident	78.7	Confident	43 Å²	43	79.3 Å²	79.3	23%	0.225	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	147.8	-173.2	-64.4	168	0	0	0	111.4	R516 F518 L529 L533 H536	R516-L527 CarbonylContact C-O 3.57Å; R516-L527 WeakPolarHBondContact CA-O 3.24Å; F518-L527 PolarHBondContact N-O 2.91Å; F518-L527 PolarHBondContact O-N 3.35Å; L527-L529 VanDerWaalsContact C-N 3.34Å; L527-L529 PolarHBondContact O-N 2.83Å; L527-L533 HydrophobicContact CD1-CB 4.15Å; L527-L533 HydrophobicContact CD1-CD1 4.22Å; L527-H536 HydrophobicContact CD1-CB 3.84Å
528	A	73.7	Confident	79.1	Confident	24 Å²	24	81.6 Å²	81.6	20%	0.198	40%	0.403	C	S	.	.	S	Bend	trans	-76.2	-18	-177.9	0	0	0	0	0	114.1	E515	E515-A528 WeakPolarHBondContact O-CA 3.37Å; E515-A528 WeakPolarHBondContact O-CB 3.11Å
529	L	74.2	Confident	79.3	Confident	43 Å²	43	82.3 Å²	82.3	23%	0.225	41%	0.409	C	S	.	.			trans	-135.9	135.6	-170.9	-55.4	174.3	0	0	0	112.4	R507 F518 L527 S531 S532 L533	R507-L529 HydrophobicContact CG-CD1 3.94Å; R507-L529 HydrophobicContact CG-CD2 3.57Å; R507-L529 HydrophobicContact CG-CG 4.43Å; F518-L529 VanDerWaalsContact CD2-C 3.45Å; L527-L529 VanDerWaalsContact C-N 3.34Å; L527-L529 PolarHBondContact O-N 2.83Å; L529-S531 PolarHBondContact O-N 3.45Å; L529-S532 WeakPolarHBondContact O-CB 3.49Å; L529-S532 PolarHBondContact O-N 3.08Å; L529-S532 VanDerWaalsContact O-N 3.08Å; L529-L533 PolarHBondContact O-N 3.27Å
530	K	77.2	Confident	79.1	Confident	138 Å²	138	81 Å²	81	60%	0.6	40%	0.396	S	S	*	.	H	α-helix	trans	-61.5	-27.6	174.7	-165.3	164.4	-175.6	166.4	0	113.1	F518 K534	F518-K530 HydrophobicContact CD1-CB 3.98Å; F518-K530 HydrophobicContact CD1-CG 4.26Å; F518-K530 HydrophobicContact CD2-CB 4.48Å; F518-K530 HydrophobicContact CE1-CB 3.79Å; F518-K530 HydrophobicContact CE1-CD 4.1Å; F518-K530 HydrophobicContact CE1-CG 4.21Å; F518-K530 HydrophobicContact CE2-CB 4.31Å; F518-K530 HydrophobicContact CG-CB 4.33Å; F518-K530 HydrophobicContact CZ-CB 3.96Å; K530-K534 PolarHBondContact O-N 2.8Å
531	S	77.3	Confident	78.4	Confident	53 Å²	53	87.8 Å²	87.8	37%	0.371	43%	0.43	S	S	.	.	H	α-helix	trans	-71.4	-40.9	172.1	50.8	0	0	0	0	112.5	L529 L533 K534 R535	L529-S531 PolarHBondContact O-N 3.45Å; S531-L533 VanDerWaalsContact C-N 3.33Å; S531-K534 PolarHBondContact O-N 3.21Å; S531-R535 PolarHBondContact O-N 3.34Å
532	S	80.3	Confident	77.4	Confident	37 Å²	37	85 Å²	85	26%	0.259	42%	0.416	S	S	.	.	H	α-helix	trans	-63	-39.8	171.4	-58.4	0	0	0	0	111.4	L529 R535 H536	L529-S532 WeakPolarHBondContact O-CB 3.49Å; L529-S532 PolarHBondContact O-N 3.08Å; L529-S532 VanDerWaalsContact O-N 3.08Å; S532-R535 PolarHBondContact O-N 3.37Å; S532-H536 WeakPolarHBondContact O-CB 3.43Å; S532-H536 PolarHBondContact O-N 3.2Å
533	L	80.2	Confident	76.1	Confident	29 Å²	29	86.1 Å²	86.1	15%	0.152	42%	0.424	C	S	.	.	H	α-helix	trans	-62.4	-48.6	172.7	179.1	60.5	0	0	0	111.3	F518 S519 C520 L527 L529 S531 R535 H536 M537	F518-L533 HydrophobicContact CB-CB 4.15Å; F518-L533 HydrophobicContact CB-CD2 3.89Å; S519-L533 WeakPolarHBondContact O-CD2 3.49Å; C520-L533 HydrophobicContact CB-CD1 4.05Å; L527-L533 HydrophobicContact CD1-CB 4.15Å; L527-L533 HydrophobicContact CD1-CD1 4.22Å; L529-L533 PolarHBondContact O-N 3.27Å; S531-L533 VanDerWaalsContact C-N 3.33Å; L533-R535 VanDerWaalsContact C-N 3.31Å; L533-R535 PolarHBondContact O-N 3.28Å; L533-H536 CarbonylContact O-C 3.51Å; L533-H536 PolarHBondContact O-N 3.23Å; L533-M537 HydrophobicContact CD1-CE 3.99Å; L533-M537 HydrophobicContact CD1-CG 4.13Å; L533-M537 HydrophobicContact CG-CG 4.28Å; L533-M537 VanDerWaalsContact O-CG 3.29Å; L533-M537 WeakPolarHBondContact O-CG 3.08Å; L533-M537 PolarHBondContact O-N 2.61Å
534	K	80	Confident	74.6	Confident	153 Å²	153	88.8 Å²	88.8	67%	0.665	43%	0.43	S	S	*	.	H	α-helix	trans	-57.6	-39.6	176	-80	-162.8	171.1	-158.5	0	113.3	K530 S531 K538	K530-K534 PolarHBondContact O-N 2.8Å; S531-K534 PolarHBondContact O-N 3.21Å; K534-K538 PolarHBondContact O-N 3.11Å
535	R	80.1	Confident	73.1	Confident	191 Å²	191	91.8 Å²	91.8	72%	0.721	44%	0.441	S	S	*	.	H	α-helix	trans	-69.7	-34.8	174.5	-171.9	172.3	68.4	-174.3	4.4	112.3	S531 S532 L533	S531-R535 PolarHBondContact O-N 3.34Å; S532-R535 PolarHBondContact O-N 3.37Å; L533-R535 VanDerWaalsContact C-N 3.31Å; L533-R535 PolarHBondContact O-N 3.28Å
536	H	81.3	Confident	71.5	Confident	22 Å²	22	95.4 Å²	95.4	10%	0.102	45%	0.452	C	S	.	.	H	α-helix	trans	-71.3	-34.9	175.4	179.3	30.1	0	0	0	112.7	C523 L527 S532 L533 K538 I539 H540	C523-H536 PolarHBondContact SG-NE2 3.25Å; C523-H536 VanDerWaalsContact SG-NE2 3.44Å; L527-H536 HydrophobicContact CD1-CB 3.84Å; S532-H536 WeakPolarHBondContact O-CB 3.43Å; S532-H536 PolarHBondContact O-N 3.2Å; L533-H536 CarbonylContact O-C 3.51Å; L533-H536 PolarHBondContact O-N 3.23Å; H536-K538 VanDerWaalsContact C-N 3.29Å; H536-K538 PolarHBondContact O-N 3.14Å; H536-I539 WeakPolarHBondContact O-CB 3.25Å; H536-I539 PolarHBondContact O-N 3.25Å; H536-H540 AromaticContact CE1-CD2 3.78Å; H536-H540 AromaticContact CE1-CE1 3.96Å; H536-H540 AromaticContact CE1-NE2 3.09Å; H536-H540 PolarHBondContact CE1-NE2 3.26Å; H536-H540 AromaticContact ND1-NE2 3.9Å; H536-H540 AromaticContact NE2-NE2 3.29Å; H536-H540 PolarHBondContact NE2-NE2 3.47Å; H536-H540 PolarHBondContact O-CD2 3.07Å
537	M	77.4	Confident	70.1	Confident	52 Å²	52	95.3 Å²	95.3	26%	0.256	46%	0.462	S	S	.	.	H	α-helix	trans	-59.4	-37.4	173.4	-70.7	-73	94.7	0	0	112.4	C520 I522 L533 I539 H540 M541	C520-M537 HydrophobicContact CB-CE 4Å; C520-M537 WeakPolarHBondContact SG-CE 3.46Å; I522-M537 HydrophobicContact CD1-CE 4.22Å; I522-M537 HydrophobicContact CD1-SD 4.37Å; I522-M537 HydrophobicContact CG1-CE 4.47Å; L533-M537 HydrophobicContact CD1-CE 3.99Å; L533-M537 HydrophobicContact CD1-CG 4.13Å; L533-M537 HydrophobicContact CG-CG 4.28Å; L533-M537 VanDerWaalsContact O-CG 3.29Å; L533-M537 WeakPolarHBondContact O-CG 3.08Å; L533-M537 PolarHBondContact O-N 2.61Å; M537-I539 VanDerWaalsContact C-N 3.28Å; M537-I539 PolarHBondContact O-N 3.01Å; M537-H540 PolarHBondContact O-N 2.88Å; M537-H540 VanDerWaalsContact O-N 3.14Å; M537-M541 PolarHBondContact O-N 2.95Å
538	K	82.3	Confident	68.2	Low	124 Å²	124	102.3 Å²	102.3	54%	0.539	49%	0.491	S	S	.	.	H	α-helix	trans	-55.2	-40.9	174.7	-81.8	-167.8	154.5	-131	0	113.4	K534 H536 H540 M541 E542	K534-K538 PolarHBondContact O-N 3.11Å; H536-K538 VanDerWaalsContact C-N 3.29Å; H536-K538 PolarHBondContact O-N 3.14Å; K538-H540 VanDerWaalsContact C-N 3.27Å; K538-H540 PolarHBondContact O-N 3.11Å; K538-M541 CarbonylContact O-C 3.57Å; K538-M541 WeakPolarHBondContact O-CA 3.41Å; K538-M541 WeakPolarHBondContact O-CB 3.45Å; K538-M541 PolarHBondContact O-N 3.44Å; K538-E542 WeakPolarHBondContact O-CB 3.35Å; K538-E542 WeakPolarHBondContact O-CG 3.41Å; K538-E542 PolarHBondContact O-N 3.15Å
539	I	79.8	Confident	66.7	Low	81 Å²	81	108.4 Å²	108.4	42%	0.415	53%	0.526	S	S	.	.	H	α-helix	trans	-57.1	-43.8	179	-53.3	176	0	0	0	110.3	H536 M537 M541 E542 D543	H536-I539 WeakPolarHBondContact O-CB 3.25Å; H536-I539 PolarHBondContact O-N 3.25Å; M537-I539 VanDerWaalsContact C-N 3.28Å; M537-I539 PolarHBondContact O-N 3.01Å; I539-M541 VanDerWaalsContact C-N 3.27Å; I539-M541 PolarHBondContact O-N 3.04Å; I539-E542 PolarHBondContact O-N 3.27Å; I539-D543 WeakPolarHBondContact CG2-OD2 3.35Å; I539-D543 WeakPolarHBondContact O-CB 3.48Å; I539-D543 PolarHBondContact O-N 2.95Å
540	H	76.1	Confident	65.2	Low	31 Å²	31	109.4 Å²	109.4	14%	0.144	55%	0.546	C	S	.	.	H	α-helix	trans	-69.2	-21.6	176.4	-61.4	-77.9	0	0	0	114.1	C520 I522 C523 H536 M537 K538 Q544	C520-H540 PolarHBondContact SG-NE2 3.08Å; C520-H540 VanDerWaalsContact SG-NE2 3.36Å; I522-H540 HydrophobicContact CD1-CB 3.59Å; I522-H540 HydrophobicContact CG2-CB 4.45Å; I522-H540 WeakPolarHBondContact CG2-ND1 3.1Å; C523-H540 PolarHBondContact SG-CE1 3.11Å; C523-H540 PolarHBondContact SG-NE2 3.23Å; H536-H540 AromaticContact CE1-CD2 3.78Å; H536-H540 AromaticContact CE1-CE1 3.96Å; H536-H540 AromaticContact CE1-NE2 3.09Å; H536-H540 PolarHBondContact CE1-NE2 3.26Å; H536-H540 AromaticContact ND1-NE2 3.9Å; H536-H540 AromaticContact NE2-NE2 3.29Å; H536-H540 PolarHBondContact NE2-NE2 3.47Å; H536-H540 PolarHBondContact O-CD2 3.07Å; M537-H540 PolarHBondContact O-N 2.88Å; M537-H540 VanDerWaalsContact O-N 3.14Å; K538-H540 VanDerWaalsContact C-N 3.27Å; K538-H540 PolarHBondContact O-N 3.11Å; H540-Q544 PolarHBondContact O-N 3.14Å
541	M	67.5	Low	63.2	Low	146 Å²	146	111.8 Å²	111.8	72%	0.719	56%	0.557	S	S	*	*	H	α-helix	trans	-87.4	-23.8	174.4	-60.4	-176.9	74.9	0	0	112.4	M537 K538 I539	M537-M541 PolarHBondContact O-N 2.95Å; K538-M541 CarbonylContact O-C 3.57Å; K538-M541 WeakPolarHBondContact O-CA 3.41Å; K538-M541 WeakPolarHBondContact O-CB 3.45Å; K538-M541 PolarHBondContact O-N 3.44Å; I539-M541 VanDerWaalsContact C-N 3.27Å; I539-M541 PolarHBondContact O-N 3.04Å
542	E	61.9	Low	61.4	Low	126 Å²	126	118.3 Å²	118.3	59%	0.589	58%	0.581	S	S	*	*	H	α-helix	trans	-82.5	-36.2	175	-72.2	153	-166.8	0	0	110.2	K538 I539	K538-E542 WeakPolarHBondContact O-CB 3.35Å; K538-E542 WeakPolarHBondContact O-CG 3.41Å; K538-E542 PolarHBondContact O-N 3.15Å; I539-E542 PolarHBondContact O-N 3.27Å
543	D	53.5	Low	59.3	Low	125 Å²	125	124.8 Å²	124.8	67%	0.668	61%	0.612	S	S	*	*	S	Bend	trans	-83.3	-8.7	175.9	-71.3	-33.4	0	0	0	114.8	I539	I539-D543 WeakPolarHBondContact CG2-OD2 3.35Å; I539-D543 WeakPolarHBondContact O-CB 3.48Å; I539-D543 PolarHBondContact O-N 2.95Å
544	Q	53.1	Low	56.9	Low	114 Å²	114	135.3 Å²	135.3	53%	0.533	67%	0.667	S	S	.	*			trans	-133.3	89.5	175.5	-68.3	-157	-44.4	0	0	113.9	H540 Y546	H540-Q544 PolarHBondContact O-N 3.14Å; Q544-Y546 PolarHBondContact O-N 3.33Å
545	P	44.9	Very low	55.8	Low	113 Å²	113	134.4 Å²	134.4	73%	0.734	67%	0.667	S	S	*	*	S	Bend	trans	-65.6	-17.3	173.4	-23.3	35.1	0	0	0	115
546	Y	47.3	Very low	54.5	Low	207 Å²	207	131.4 Å²	131.4	81%	0.812	66%	0.664	S	S	*	*	S	Bend	trans	-141.1	105.9	179.9	-82.4	-92.8	0	0	0	111.4	Q544	Q544-Y546 PolarHBondContact O-N 3.33Å
547	L	46.3	Very low	53	Low	149 Å²	149	137.5 Å²	137.5	78%	0.78	70%	0.696	S	S	*	*			trans	165.7	66.4	137.6	-91.1	167	0	0	0	112.3
548	F	38.6	Very low	51.5	Low	191 Å²	191	142.5 Å²	142.5	84%	0.838	72%	0.721	S	S	*	*			trans	-149.2	60.3	160.4	-132.4	-80.4	0	0	0	113.8
549	V	42	Very low	49.6	Very low	151 Å²	151	143.7 Å²	143.7	92%	0.915	73%	0.733	S	S	*	*			trans	-83	120.5	162.6	177.1	0	0	0	0	108.5
550	G	41.5	Very low	47.6	Very low	64 Å²	64	147.9 Å²	147.9	66%	0.66	75%	0.754	S	S	*	*			trans	76.4	91.6	161.3	0	0	0	0	0	116.6
551	K	36.8	Very low	45.6	Very low	189 Å²	189	156.2 Å²	156.2	82%	0.822	80%	0.798	S	S	*	*				-151.8	119.2	126.9	-114.8	165.1	-171.8	175.6	0	111.2
552	E	39.6	Very low	43.9	Very low	190 Å²	190	157 Å²	157	89%	0.888	80%	0.804	S	S	*	*			trans	-68.7	147.8	167.9	-60.1	169.3	125.2	0	0	109.1
553	L	35	Very low	42.4	Very low	173 Å²	173	159.6 Å²	159.6	91%	0.906	82%	0.822	S	S	*	*			trans	-134.8	118.1	164.4	-75	176.1	0	0	0	108.5
554	L	30.4	Very low	41.4	Very low	249 Å²	249	162.7 Å²	162.7	100%	1.304	84%	0.835	S	S	*	*			trans	-74.5	0	164.5	-74.4	159.3	0	0	0	110.3

Retrieved 554 of 554 residues in 141.8 ms (Link to these results)

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