A0A096MDN2_POEFO Loading...

Dynein axonemal intermediate chain 4

AlphaFold DB , UniProt , Accession A0A096MDN2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 731 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	V	52.5	Low	69.5	Low	172 Å²	172	116.3 Å²	116.3	100%	1.042	60%	0.603	S	S	*	*				0	126.7	0	179.5	0	0	0	0	106	T12	V1-T12 WeakPolarHBondContact O-CG2 3.27Å
2	Q	65.9	Low	70.1	Confident	130 Å²	130	110.1 Å²	110.1	61%	0.607	57%	0.574	S	S	*	*			trans	-88.4	145.1	170.8	-76.1	172.3	-81.6	0	0	109.5	F4 D10 T12	Q2-F4 HydrophobicContact CB-CE2 3.76Å; Q2-F4 HydrophobicContact CB-CZ 4.21Å; Q2-D10 PolarHBondContact NE2-OD2 3.4Å; Q2-T12 WeakPolarHBondContact CA-OG1 3.44Å
3	V	68.6	Low	68.4	Low	74 Å²	74	110.5 Å²	110.5	45%	0.448	59%	0.587	S	S	.	*			trans	-127.6	127.4	179.6	-176.3	0	0	0	0	107.5	V11 T12	V3-V11 HydrophobicContact CB-CG2 4.43Å; V3-V11 HydrophobicContact CG1-CG2 4.12Å; V3-V11 VanDerWaalsContact O-CG2 3.31Å; V3-V11 WeakPolarHBondContact O-CG2 3.48Å; V3-V11 PolarHBondContact O-N 2.92Å; V3-T12 PolarHBondContact N-OG1 3.22Å; V3-T12 PolarHBondContact O-N 3.4Å
4	F	79.3	Confident	66.9	Low	101 Å²	101	114.1 Å²	114.1	44%	0.443	60%	0.6	S	S	.	*	B	Isolated β-bridge	trans	-113.2	150.8	178.9	-61.3	-94.7	0	0	0	109.9	Q2 N9 D10	Q2-F4 HydrophobicContact CB-CE2 3.76Å; Q2-F4 HydrophobicContact CB-CZ 4.21Å; F4-N9 CarbonylContact C-O 3.59Å; F4-N9 WeakPolarHBondContact CA-O 3.44Å; F4-D10 HydrophobicContact CD1-CB 4.01Å; F4-D10 HydrophobicContact CE1-CB 3.66Å; F4-D10 HydrophobicContact CZ-CB 4.37Å
5	D	78.9	Confident	65	Low	62 Å²	62	114.4 Å²	114.4	33%	0.332	61%	0.611	S	S	.	*			trans	-83.7	178.3	171.2	68	18.5	0	0	0	112.3	E7 N8 N9 V11	D5-E7 PolarHBondContact O-N 3.27Å; D5-E7 VanDerWaalsContact OD1-C 3.26Å; D5-E7 WeakPolarHBondContact OD1-CA 3.45Å; D5-E7 PolarHBondContact OD1-N 3.43Å; D5-N8 WeakPolarHBondContact O-CA 3.27Å; D5-N8 PolarHBondContact O-N 2.9Å; D5-N8 PolarHBondContact OD1-N 3.44Å; D5-N9 PolarHBondContact N-O 3.23Å; D5-N9 PolarHBondContact OD1-N 2.9Å; D5-N9 PolarHBondContact OD1-ND2 2.88Å; D5-N9 VanDerWaalsContact OD1-ND2 3.14Å; D5-N9 WeakPolarHBondContact OD2-CB 3.38Å; D5-N9 PolarHBondContact OD2-ND2 3.42Å; D5-V11 HydrophobicContact CB-CG1 4.25Å
6	E	69.4	Low	63.4	Low	208 Å²	208	121.1 Å²	121.1	97%	0.972	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-13.1	179.8	-62.2	-168.3	164.8	0	0	113.5	N8	E6-N8 VanDerWaalsContact C-N 3.32Å
7	E	76	Confident	61.8	Low	165 Å²	165	125.6 Å²	125.6	77%	0.771	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	4.9	169.7	-65.3	-172.9	177.6	0	0	112.2	D5 N9	D5-E7 PolarHBondContact O-N 3.27Å; D5-E7 VanDerWaalsContact OD1-C 3.26Å; D5-E7 WeakPolarHBondContact OD1-CA 3.45Å; D5-E7 PolarHBondContact OD1-N 3.43Å; E7-N9 WeakPolarHBondContact CB-ND2 3.44Å
8	N	58.4	Low	60.1	Low	127 Å²	127	130.8 Å²	130.8	68%	0.679	65%	0.652	S	S	*	*			trans	70	24.1	176.4	-151.6	34.5	0	0	0	114.9	D5 E6	D5-N8 WeakPolarHBondContact O-CA 3.27Å; D5-N8 PolarHBondContact O-N 2.9Å; D5-N8 PolarHBondContact OD1-N 3.44Å; E6-N8 VanDerWaalsContact C-N 3.32Å
9	N	62.6	Low	58.6	Low	83 Å²	83	127.8 Å²	127.8	44%	0.444	65%	0.649	S	S	.	*			trans	-83.4	141.7	173.2	-51.2	-70.4	0	0	0	111.2	F4 D5 E7 V11	F4-N9 CarbonylContact C-O 3.59Å; F4-N9 WeakPolarHBondContact CA-O 3.44Å; D5-N9 PolarHBondContact N-O 3.23Å; D5-N9 PolarHBondContact OD1-N 2.9Å; D5-N9 PolarHBondContact OD1-ND2 2.88Å; D5-N9 VanDerWaalsContact OD1-ND2 3.14Å; D5-N9 WeakPolarHBondContact OD2-CB 3.38Å; D5-N9 PolarHBondContact OD2-ND2 3.42Å; E7-N9 WeakPolarHBondContact CB-ND2 3.44Å; N9-V11 PolarHBondContact O-N 2.89Å
10	D	72.8	Confident	57	Low	81 Å²	81	129.3 Å²	129.3	43%	0.433	66%	0.659	S	S	.	*	B	Isolated β-bridge	trans	-74.9	109.8	175.5	-167.2	-22.8	0	0	0	110.6	Q2 F4 T12	Q2-D10 PolarHBondContact NE2-OD2 3.4Å; F4-D10 HydrophobicContact CD1-CB 4.01Å; F4-D10 HydrophobicContact CE1-CB 3.66Å; F4-D10 HydrophobicContact CZ-CB 4.37Å; D10-T12 WeakPolarHBondContact OD1-CB 3.49Å; D10-T12 PolarHBondContact OD1-N 3.46Å; D10-T12 PolarHBondContact OD1-OG1 3.34Å
11	V	79.7	Confident	55.8	Low	76 Å²	76	131.8 Å²	131.8	46%	0.461	67%	0.673	S	S	.	*			trans	-106.8	21.8	179.7	-64.8	0	0	0	0	112.1	V3 D5 N9 P13	V3-V11 HydrophobicContact CB-CG2 4.43Å; V3-V11 HydrophobicContact CG1-CG2 4.12Å; V3-V11 VanDerWaalsContact O-CG2 3.31Å; V3-V11 WeakPolarHBondContact O-CG2 3.48Å; V3-V11 PolarHBondContact O-N 2.92Å; D5-V11 HydrophobicContact CB-CG1 4.25Å; N9-V11 PolarHBondContact O-N 2.89Å; V11-P13 WeakPolarHBondContact O-CD 3.36Å
12	T	76.7	Confident	54.7	Low	42 Å²	42	127.4 Å²	127.4	26%	0.258	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-63.1	118.2	179.5	-54.5	0	0	0	0	111.3	V1 Q2 V3 D10 Q14	V1-T12 WeakPolarHBondContact O-CG2 3.27Å; Q2-T12 WeakPolarHBondContact CA-OG1 3.44Å; V3-T12 PolarHBondContact N-OG1 3.22Å; V3-T12 PolarHBondContact O-N 3.4Å; D10-T12 WeakPolarHBondContact OD1-CB 3.49Å; D10-T12 PolarHBondContact OD1-N 3.46Å; D10-T12 PolarHBondContact OD1-OG1 3.34Å; T12-Q14 PolarHBondContact O-N 3.27Å
13	P	48.4	Very low	52.8	Low	115 Å²	115	126 Å²	126	75%	0.747	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-68.8	122	-175.7	26.7	-34.1	0	0	0	111.4	V11	V11-P13 WeakPolarHBondContact O-CD 3.36Å
14	Q	47.3	Very low	50.8	Low	162 Å²	162	131 Å²	131	76%	0.757	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-87.8	144.8	179	-61.7	-168.9	14.3	0	0	111.9	T12	T12-Q14 PolarHBondContact O-N 3.27Å
15	P	39	Very low	48.8	Very low	118 Å²	118	131.7 Å²	131.7	77%	0.766	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-70.8	143.2	180	29.2	-35	0	0	0	112.3	Y17	P15-Y17 VanDerWaalsContact C-N 3.26Å; P15-Y17 PolarHBondContact O-N 2.98Å
16	F	38.8	Very low	46.2	Very low	222 Å²	222	132.4 Å²	132.4	97%	0.974	73%	0.728	S	S	*	*	S	Bend	trans	-81.2	54.3	-171.1	-121.2	-85.6	0	0	0	114
17	Y	35.7	Very low	44	Very low	197 Å²	197	127.2 Å²	127.2	77%	0.773	72%	0.715	S	S	*	*			trans	-152.5	131.5	168.9	-155.8	-107.4	0	0	0	112.6	P15 A19	P15-Y17 VanDerWaalsContact C-N 3.26Å; P15-Y17 PolarHBondContact O-N 2.98Å; Y17-A19 HydrophobicContact CE1-CB 4.12Å
18	R	31.7	Very low	41.6	Very low	220 Å²	220	130.2 Å²	130.2	83%	0.83	72%	0.719	S	S	*	*			trans	-120.9	125.8	161.3	-83.9	-172.8	176.7	174.1	0.5	108.4
19	A	31.8	Very low	40	Very low	73 Å²	73	134.5 Å²	134.5	60%	0.603	73%	0.732	S	S	*	*			trans	-97.1	123.6	160.5	0	0	0	0	0	107.6	Y17	Y17-A19 HydrophobicContact CE1-CB 4.12Å
20	D	27.5	Very low	38.2	Very low	157 Å²	157	137.7 Å²	137.7	84%	0.84	75%	0.748	S	S	*	*			trans	-75.1	128.5	174	-74	-38.2	0	0	0	110.3
21	L	30.7	Very low	35.9	Very low	183 Å²	183	139.1 Å²	139.1	96%	0.958	76%	0.76	S	S	*	*			trans	-99.4	106.8	174.7	-76.1	166.3	0	0	0	108.8
22	G	29.7	Very low	33.3	Very low	80 Å²	80	142.2 Å²	142.2	83%	0.825	77%	0.773	S	S	*	*			trans	-162	15.8	-168.1	0	0	0	0	0	118.8
23	A	26.2	Very low	30.7	Very low	99 Å²	99	147.3 Å²	147.3	82%	0.818	79%	0.794	S	S	*	*			trans	-154.3	135.9	170	0	0	0	0	0	112.8
24	E	27.2	Very low	29.6	Very low	181 Å²	181	148.5 Å²	148.5	85%	0.846	79%	0.794	S	S	*	*			trans	-99.5	170	175.3	-92.6	-78.9	108.9	0	0	110.9
25	P	37.3	Very low	28.4	Very low	114 Å²	114	145.5 Å²	145.5	74%	0.74	79%	0.791	S	S	*	*				-115.7	172.1	-127.1	42.6	-40.5	0	0	0	116.8
26	G	23	Very low	27.7	Very low	77 Å²	77	144.6 Å²	144.6	79%	0.794	79%	0.793	S	S	*	*			trans	121.3	153.1	165.5	0	0	0	0	0	113.1
27	S	24.6	Very low	26.9	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	79%	0.786	S	S	*	*			cis	-161	151.6	-8.7	74	0	0	0	0	109.9
28	R	25.3	Very low	26.3	Very low	229 Å²	229	134.2 Å²	134.2	86%	0.864	79%	0.789	S	S	*	*			trans	51.8	122.3	163.7	-56.7	172.6	179	172.3	-0.3	117.5
29	F	23.5	Very low	25.9	Very low	217 Å²	217	130.1 Å²	130.1	95%	0.952	79%	0.789	S	S	*	*			trans	-143.9	145.2	132	-101.1	-72.8	0	0	0	110.8
30	L	25.5	Very low	25.5	Very low	150 Å²	150	131.9 Å²	131.9	79%	0.785	80%	0.797	S	S	*	*			trans	-104.7	138.8	170	-85.6	166.1	0	0	0	107.8
31	V	25.1	Very low	25.2	Very low	111 Å²	111	131.6 Å²	131.6	67%	0.673	79%	0.791	S	S	*	*				36.5	139.6	120.5	-179.1	0	0	0	0	118.5
32	D	24.3	Very low	24.8	Very low	140 Å²	140	130 Å²	130	75%	0.749	78%	0.778	S	S	*	*			trans	72.9	144.3	166.5	-68.5	-9.3	0	0	0	117.8
33	E	22.9	Very low	24.3	Very low	149 Å²	149	131.2 Å²	131.2	70%	0.696	77%	0.77	S	S	*	*			cis	-162	176.1	-20.9	-137.5	-165.1	154.4	0	0	110.4
34	L	23.9	Very low	24.2	Very low	140 Å²	140	133 Å²	133	73%	0.733	76%	0.763	S	S	*	*			trans	64.7	127.7	145.7	-76.1	167.7	0	0	0	123.8
35	S	22.4	Very low	24	Very low	100 Å²	100	132.6 Å²	132.6	70%	0.699	76%	0.759	S	S	*	*				86.6	96.1	121	-173.3	0	0	0	0	121.8
36	A	23.8	Very low	23.3	Very low	99 Å²	99	132.7 Å²	132.7	82%	0.818	76%	0.757	S	S	*	*				54.2	147.9	114.5	0	0	0	0	0	123
37	G	23.8	Very low	23.4	Very low	79 Å²	79	132.5 Å²	132.5	81%	0.814	76%	0.755	S	S	*	*			trans	110.8	100.6	145.8	0	0	0	0	0	116.1
38	S	23.4	Very low	23.3	Very low	121 Å²	121	132.8 Å²	132.8	85%	0.846	76%	0.757	S	S	*	*			trans	-125.5	99.2	167.4	60	0	0	0	0	110.7
39	T	22.3	Very low	23.3	Very low	134 Å²	134	129.7 Å²	129.7	82%	0.822	75%	0.75	S	S	*	*			trans	-135.3	109.7	174.5	51.4	0	0	0	0	112
40	S	22.4	Very low	23.4	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	74%	0.742	S	S	*	*			trans	65.1	147	143	-120	0	0	0	0	122.2
41	E	21.5	Very low	23.4	Very low	151 Å²	151	125.2 Å²	125.2	71%	0.706	74%	0.739	S	S	*	*			trans	71.8	121.6	154.1	-63.6	-167.4	148.4	0	0	118.6
42	Q	22.3	Very low	24.1	Very low	149 Å²	149	124 Å²	124	70%	0.696	73%	0.734	S	S	*	*				69.3	143	97.1	-61.3	-172.7	52	0	0	113.8
43	T	20.8	Very low	24.1	Very low	106 Å²	106	126.6 Å²	126.6	65%	0.65	74%	0.738	S	S	*	*			cis	-164.6	-178.7	-8	30.6	0	0	0	0	106.9
44	M	22.8	Very low	24.2	Very low	136 Å²	136	124.6 Å²	124.6	67%	0.67	74%	0.741	S	S	*	*			cis	-163	177.4	4.4	-130.6	178.5	-70.1	0	0	109.8
45	F	22.7	Very low	24.4	Very low	173 Å²	173	129.3 Å²	129.3	76%	0.759	75%	0.749	S	S	*	*			trans	71.8	148.7	148	-90.5	-139.1	0	0	0	119.5
46	T	22.8	Very low	24.5	Very low	116 Å²	116	129.4 Å²	129.4	71%	0.712	75%	0.75	S	S	*	*			cis	-161.5	159.4	-14.8	5.9	0	0	0	0	112.1
47	G	25.2	Very low	24.7	Very low	72 Å²	72	130.7 Å²	130.7	74%	0.742	75%	0.747	S	S	*	*			trans	152.5	90.7	165.6	0	0	0	0	0	113.1
48	S	23.7	Very low	24.8	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	75%	0.752	S	S	*	*			cis	86.8	120.8	37.3	-161.6	0	0	0	0	113.2
49	F	24	Very low	24.8	Very low	163 Å²	163	132.4 Å²	132.4	72%	0.715	74%	0.743	S	S	*	*			cis	-163.1	-173.8	-6.3	-135.5	-93.3	0	0	0	111.2	M51	F49-M51 HydrophobicContact CD1-CG 4.11Å; F49-M51 HydrophobicContact CE1-CE 4.05Å; F49-M51 HydrophobicContact CE1-CG 4.09Å
50	T	26.7	Very low	25	Very low	128 Å²	128	131.6 Å²	131.6	79%	0.785	74%	0.742	S	S	*	*			trans	92.5	123.6	168.8	71.1	0	0	0	0	117.7
51	M	25.6	Very low	25.2	Very low	146 Å²	146	131.8 Å²	131.8	72%	0.719	74%	0.743	S	S	*	*			cis	95.4	154	11.8	-63.3	-68.3	-169.6	0	0	116.9	F49	F49-M51 HydrophobicContact CD1-CG 4.11Å; F49-M51 HydrophobicContact CE1-CE 4.05Å; F49-M51 HydrophobicContact CE1-CG 4.09Å
52	P	38.2	Very low	25.4	Very low	86 Å²	86	135.9 Å²	135.9	56%	0.558	75%	0.752	S	S	*	*			cis	-146.1	177.7	-27.9	37.1	-17.5	0	0	0	117.8
53	F	24.3	Very low	25.7	Very low	193 Å²	193	137.1 Å²	137.1	85%	0.846	76%	0.762	S	S	*	*			trans	69	152	157.3	-58.2	-51	0	0	0	119.3
54	S	25.6	Very low	25.9	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	77%	0.768	S	S	*	*			cis	-132.1	-169.7	16.3	-52	0	0	0	0	111.9
55	R	27.3	Very low	26.1	Very low	238 Å²	238	136.7 Å²	136.7	90%	0.898	78%	0.777	S	S	*	*			cis	-155.6	-167.4	6.2	-147.9	-178.8	-169.9	-163.5	2.9	110.3
56	S	25.1	Very low	26.2	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	78%	0.781	S	S	*	*			trans	-149.7	-152.9	173.9	64.3	0	0	0	0	111
57	V	27.4	Very low	26.4	Very low	127 Å²	127	137.6 Å²	137.6	77%	0.77	79%	0.789	S	S	*	*			trans	84.9	129	-167.7	-177.1	0	0	0	0	111.2
58	L	27.1	Very low	26.3	Very low	172 Å²	172	140 Å²	140	90%	0.901	79%	0.789	S	S	*	*			cis	-131.2	-170.3	2.2	-112.7	158.3	0	0	0	108.4
59	G	23.7	Very low	26.6	Very low	64 Å²	64	142.5 Å²	142.5	66%	0.66	79%	0.793	S	S	*	*			cis	-174.3	173.2	0.9	0	0	0	0	0	111.7
60	S	25.4	Very low	26.6	Very low	117 Å²	117	142.3 Å²	142.3	82%	0.818	79%	0.794	S	S	*	*			trans	-129.7	163.9	-164.5	-174.4	0	0	0	0	114.5
61	S	26.4	Very low	26.5	Very low	114 Å²	114	141.6 Å²	141.6	80%	0.797	80%	0.795	S	S	*	*			trans	126	160.8	141	76.5	0	0	0	0	117.6
62	R	26.6	Very low	26.5	Very low	237 Å²	237	140.7 Å²	140.7	89%	0.894	80%	0.797	S	S	*	*			trans	-91.1	161.4	-175	-52.1	163.1	178	163.1	-3.9	110.3
63	I	28.3	Very low	26	Very low	176 Å²	176	143.6 Å²	143.6	90%	0.903	81%	0.808	S	S	*	*			trans	-153.7	153.1	138	-105.5	149.6	0	0	0	109.6
64	S	24.6	Very low	26.1	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	81%	0.805	S	S	*	*			trans	-107.3	150.9	-175.5	52.8	0	0	0	0	112.5
65	S	28.1	Very low	26.2	Very low	123 Å²	123	146.9 Å²	146.9	86%	0.86	81%	0.814	S	S	*	*			trans	-146.6	125.7	153	47.2	0	0	0	0	110.8
66	Q	24.7	Very low	26.1	Very low	184 Å²	184	143.2 Å²	143.2	86%	0.86	81%	0.809	S	S	*	*			trans	-92.1	148.1	166.6	-68.2	166.3	-93.6	0	0	109
67	S	27.4	Very low	26.1	Very low	125 Å²	125	146.6 Å²	146.6	87%	0.874	81%	0.813	S	S	*	*			trans	-152.9	99.8	155.2	58.5	0	0	0	0	109.5
68	T	22.9	Very low	26	Very low	122 Å²	122	149.9 Å²	149.9	75%	0.748	82%	0.82	S	S	*	*			trans	-110.2	126.9	176.2	44.3	0	0	0	0	110.1
69	I	29.9	Very low	25.7	Very low	158 Å²	158	146.5 Å²	146.5	81%	0.81	81%	0.807	S	S	*	*			trans	-176.1	143.7	167	-102.1	150.3	0	0	0	105.7
70	E	23.8	Very low	25.6	Very low	160 Å²	160	152.6 Å²	152.6	75%	0.748	82%	0.816	S	S	*	*			cis	-172.2	138.5	-29.5	-131.2	176.3	165.6	0	0	107.1
71	S	24.7	Very low	25.5	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	81%	0.807	S	S	*	*			trans	62.3	169.1	162.2	75.9	0	0	0	0	117.8
72	V	25.9	Very low	25.3	Very low	127 Å²	127	155.8 Å²	155.8	77%	0.77	81%	0.805	S	S	*	*			cis	-130.1	159.7	2.4	-161	0	0	0	0	109.3
73	N	25.9	Very low	25.2	Very low	146 Å²	146	155.9 Å²	155.9	78%	0.781	81%	0.806	S	S	*	*			trans	-64.2	156.4	161.8	-62.4	-13.3	0	0	0	110.9
74	E	27.2	Very low	24.9	Very low	171 Å²	171	153.4 Å²	153.4	80%	0.799	79%	0.794	S	S	*	*				-166.9	122.8	122.3	-110.3	167	-158.1	0	0	111.4
75	E	26.7	Very low	24.9	Very low	199 Å²	199	157.3 Å²	157.3	93%	0.93	80%	0.798	S	S	*	*			trans	-96.1	124	154.8	-69.9	-176.3	144.4	0	0	106.8
76	M	26.8	Very low	25.4	Very low	161 Å²	161	155.9 Å²	155.9	79%	0.793	79%	0.786	S	S	*	*			trans	-147.8	130.1	166.3	-165.4	87.8	78.8	0	0	109.2
77	E	24.8	Very low	25.3	Very low	173 Å²	173	156.2 Å²	156.2	81%	0.808	79%	0.785	S	S	*	*			trans	-76.2	143.6	166.5	-56.7	-178.5	127.2	0	0	109.9
78	E	24.6	Very low	25.1	Very low	197 Å²	197	156.5 Å²	156.5	92%	0.921	78%	0.777	S	S	*	*			trans	-125.5	147.4	146.8	-81.2	-152.4	138.8	0	0	110.3
79	T	22	Very low	25.3	Very low	101 Å²	101	157.6 Å²	157.6	62%	0.62	78%	0.777	S	S	*	*			trans	-126.1	-178.6	-169.7	41.6	0	0	0	0	110.6
80	F	20.9	Very low	25.7	Very low	192 Å²	192	155.8 Å²	155.8	84%	0.842	78%	0.776	S	S	*	*			trans	76	140.6	175.1	-61.2	-86.8	0	0	0	116.5
81	C	23.6	Very low	25.8	Very low	94 Å²	94	155.5 Å²	155.5	64%	0.635	78%	0.779	S	S	*	*			cis	-162.9	151	-20.3	-152	0	0	0	0	112.3
82	R	22.7	Very low	25.9	Very low	203 Å²	203	159 Å²	159	77%	0.766	78%	0.783	S	S	*	*			trans	34	127.9	148.9	-78.4	173.7	164.8	173.1	-4	120.5
83	R	24.8	Very low	26.1	Very low	240 Å²	240	162.4 Å²	162.4	91%	0.906	79%	0.787	S	S	*	*				-165.6	163	89.2	-99.6	-174.1	-170.4	89.1	-5.5	112.5
84	D	21.9	Very low	26.3	Very low	123 Å²	123	167.3 Å²	167.3	66%	0.658	80%	0.795	S	S	*	*			trans	-112.8	141.1	-165.2	-67.9	-82.1	0	0	0	114.4
85	F	23.7	Very low	26.4	Very low	191 Å²	191	169 Å²	169	84%	0.838	80%	0.8	S	S	*	*			trans	59.2	171.8	145.8	-76.3	-54.1	0	0	0	120.9
86	P	38.9	Very low	26.7	Very low	93 Å²	93	169.6 Å²	169.6	60%	0.604	80%	0.799	S	S	*	*			cis	-133.3	172.6	-29.3	29.5	-10	0	0	0	114.4
87	F	22.3	Very low	26.8	Very low	192 Å²	192	165.5 Å²	165.5	84%	0.842	80%	0.799	S	S	*	*				-174.4	173	113.8	-117.6	-91.4	0	0	0	115.2
88	N	23.7	Very low	27.3	Very low	131 Å²	131	162.8 Å²	162.8	70%	0.701	80%	0.799	S	S	*	*			trans	-133.3	167.5	-168.5	-86	-64.1	0	0	0	109.2
89	L	26.5	Very low	27.9	Very low	145 Å²	145	159.5 Å²	159.5	76%	0.759	79%	0.792	S	S	*	*			cis	-156.9	-157.2	3.9	-113.7	162.7	0	0	0	104.7
90	P	38.5	Very low	28.8	Very low	120 Å²	120	163.9 Å²	163.9	78%	0.779	80%	0.802	S	S	*	*			cis	-130.3	179	-1.2	43.1	-25.3	0	0	0	116.5
91	D	26.1	Very low	30	Very low	154 Å²	154	163 Å²	163	82%	0.824	80%	0.801	S	S	*	*			trans	-118.9	134.9	170.3	-172.9	12.3	0	0	0	109.2
92	E	26.7	Very low	31	Very low	185 Å²	185	167.2 Å²	167.2	86%	0.864	81%	0.811	S	S	*	*			trans	-113.5	129.4	-168	-166	176.4	-136.9	0	0	115
93	K	29.3	Very low	31.9	Very low	199 Å²	199	163.9 Å²	163.9	87%	0.865	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-88.1	118	-173.5	-61.5	169.1	-177.3	170.9	0	112.6
94	R	30.1	Very low	33.5	Very low	250 Å²	250	157 Å²	157	94%	0.943	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-99.5	117	160	-93.3	-173.3	172.4	-166.4	-2.1	112.6
95	K	29.9	Very low	35.1	Very low	206 Å²	206	159.5 Å²	159.5	90%	0.896	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.3	131.6	173.1	-62.2	173.2	179.9	174.3	0	110.4
96	K	33.4	Very low	36.7	Very low	211 Å²	211	154.4 Å²	154.4	92%	0.917	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-95.1	123.4	148.7	-86.2	-173.1	173.4	-178.9	0	107.9
97	G	29.2	Very low	37.5	Very low	76 Å²	76	155.4 Å²	155.4	78%	0.784	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-82.4	126.4	176.8	0	0	0	0	0	111.1	V99	G97-V99 PolarHBondContact O-N 3.48Å
98	S	34.2	Very low	39.1	Very low	116 Å²	116	152.1 Å²	152.1	81%	0.811	78%	0.782	S	S	*	*			trans	-84.6	93.2	171.4	39.7	0	0	0	0	110.3	K100	S98-K100 PolarHBondContact O-N 3.06Å; S98-K100 VanDerWaalsContact O-N 3.15Å
99	V	37.1	Very low	40.5	Very low	127 Å²	127	155.3 Å²	155.3	77%	0.77	79%	0.789	S	S	*	*			trans	-67.3	110.4	168	-179.2	0	0	0	0	108.1	G97 E101	G97-V99 PolarHBondContact O-N 3.48Å; V99-E101 HydrophobicContact CG1-CG 4.21Å; V99-E101 PolarHBondContact O-N 3.38Å
100	K	42.1	Very low	41.7	Very low	193 Å²	193	151 Å²	151	84%	0.839	78%	0.78	S	S	*	*			trans	-83.1	93.7	168.9	-76.3	-171.7	175.3	-175	0	109.2	S98	S98-K100 PolarHBondContact O-N 3.06Å; S98-K100 VanDerWaalsContact O-N 3.15Å
101	E	45.1	Very low	42.4	Very low	175 Å²	175	152.6 Å²	152.6	82%	0.818	78%	0.78	S	S	*	*			trans	-68.1	136.1	162	-65.1	-170.7	139.5	0	0	109.6	V99	V99-E101 HydrophobicContact CG1-CG 4.21Å; V99-E101 PolarHBondContact O-N 3.38Å
102	Q	44.5	Very low	43.4	Very low	182 Å²	182	153.8 Å²	153.8	85%	0.85	78%	0.778	S	S	*	*			trans	-86.1	113.7	176.5	-72.5	-177.5	-23.2	0	0	109.3	T104	Q102-T104 PolarHBondContact O-N 2.87Å; Q102-T104 VanDerWaalsContact O-N 3.08Å
103	M	41.9	Very low	44.5	Very low	133 Å²	133	151.8 Å²	151.8	66%	0.655	77%	0.773	S	S	*	*			trans	-77.1	96.8	-171.9	-163.6	172	-166.9	0	0	111.8	L108	M103-L108 HydrophobicContact CE-CD2 3.57Å; M103-L108 HydrophobicContact CE-CG 4.04Å
104	T	59.1	Low	45.8	Very low	95 Å²	95	149.2 Å²	149.2	58%	0.583	77%	0.767	S	S	*	*			trans	-76	147.5	171.3	34.1	0	0	0	0	111.7	Q102 A106 L107	Q102-T104 PolarHBondContact O-N 2.87Å; Q102-T104 VanDerWaalsContact O-N 3.08Å; T104-A106 PolarHBondContact O-N 3.25Å; T104-L107 PolarHBondContact O-N 3.38Å
105	Q	55.7	Low	46.8	Very low	176 Å²	176	145 Å²	145	82%	0.822	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-58.9	-18.6	-172.2	-71.2	-179.4	-20.6	0	0	115.1	L107 L108	Q105-L107 VanDerWaalsContact C-N 3.28Å; Q105-L107 PolarHBondContact O-N 2.96Å; Q105-L108 PolarHBondContact O-N 3.01Å
106	A	56.3	Low	48	Very low	84 Å²	84	142.5 Å²	142.5	69%	0.694	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-61.9	-32.7	174.2	0	0	0	0	0	113.1	T104 L108 K109	T104-A106 PolarHBondContact O-N 3.25Å; A106-L108 PolarHBondContact O-N 2.7Å; A106-K109 PolarHBondContact O-N 3.3Å
107	L	55.1	Low	49.3	Very low	113 Å²	113	137.8 Å²	137.8	59%	0.592	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-74.5	-5.8	-177.3	-73.5	166.8	0	0	0	114.2	T104 Q105	T104-L107 PolarHBondContact O-N 3.38Å; Q105-L107 VanDerWaalsContact C-N 3.28Å; Q105-L107 PolarHBondContact O-N 2.96Å
108	L	55.9	Low	50.6	Low	124 Å²	124	143.7 Å²	143.7	65%	0.649	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-94.3	-1.9	179.1	-71.9	168.7	0	0	0	114	M103 Q105 A106	M103-L108 HydrophobicContact CE-CD2 3.57Å; M103-L108 HydrophobicContact CE-CG 4.04Å; Q105-L108 PolarHBondContact O-N 3.01Å; A106-L108 PolarHBondContact O-N 2.7Å
109	K	54.1	Low	52	Low	198 Å²	198	144.2 Å²	144.2	86%	0.861	75%	0.752	S	S	*	*	S	Bend	trans	-101.4	-2.3	179.1	-80.8	-169.6	171.5	-174.5	0	115.2	A106	A106-K109 PolarHBondContact O-N 3.3Å
110	G	51.8	Low	53.2	Low	54 Å²	54	145.6 Å²	145.6	56%	0.557	76%	0.755	S	S	*	*	S	Bend	trans	-84.1	125.4	172.6	0	0	0	0	0	111.2	K112	G110-K112 PolarHBondContact O-N 2.9Å
111	I	53.7	Low	54.3	Low	154 Å²	154	142.9 Å²	142.9	79%	0.79	76%	0.755	S	S	*	*			trans	-60.5	132.6	163.6	-61	174.1	0	0	0	107.3
112	K	47.2	Very low	55.4	Low	179 Å²	179	141 Å²	141	78%	0.778	75%	0.749	S	S	*	*			trans	-111.1	104.4	174.2	-78.3	-169.5	174.1	-174.1	0	109.3	G110 I114	G110-K112 PolarHBondContact O-N 2.9Å; K112-I114 PolarHBondContact O-N 3.43Å
113	D	48.4	Very low	56.3	Low	143 Å²	143	137.4 Å²	137.4	77%	0.765	75%	0.745	S	S	*	*			trans	-70.9	115.7	173.9	-56.6	-43.3	0	0	0	109.5	L115	D113-L115 PolarHBondContact O-N 3.44Å
114	I	57.5	Low	57.2	Low	144 Å²	144	138.6 Å²	138.6	74%	0.738	75%	0.752	S	S	*	*			trans	-94.7	92.5	177.6	-56.9	178.8	0	0	0	107.9	K112 I116	K112-I114 PolarHBondContact O-N 3.43Å; I114-I116 HydrophobicContact CG2-CG1 4.22Å; I114-I116 PolarHBondContact O-N 3.03Å
115	L	50.4	Low	57.1	Low	161 Å²	161	140.9 Å²	140.9	84%	0.843	76%	0.761	S	S	*	*			trans	-72.6	113.7	169.1	-84.2	160.8	0	0	0	109.7	D113	D113-L115 PolarHBondContact O-N 3.44Å
116	I	56.3	Low	57.4	Low	154 Å²	154	139.7 Å²	139.7	79%	0.79	76%	0.76	S	S	*	*			trans	-95	122.4	170.2	-56.9	175.6	0	0	0	107.5	I114	I114-I116 HydrophobicContact CG2-CG1 4.22Å; I114-I116 PolarHBondContact O-N 3.03Å
117	T	58.8	Low	58	Low	112 Å²	112	141.7 Å²	141.7	69%	0.687	76%	0.758	S	S	*	*			trans	-117.8	136.3	172.4	54.2	0	0	0	0	108.8
118	E	57.3	Low	58.4	Low	200 Å²	200	141.3 Å²	141.3	94%	0.935	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-61.9	147	172.5	-67.9	-173.7	118.2	0	0	111.1
119	T	63.1	Low	59	Low	128 Å²	128	140.3 Å²	140.3	79%	0.785	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-97.7	142.3	177.5	51	0	0	0	0	110.8	T121	T119-T121 PolarHBondContact O-N 3.49Å
120	D	62.7	Low	59.6	Low	155 Å²	155	137.6 Å²	137.6	83%	0.829	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-46.1	130.7	-176.2	-59.7	-40.6	0	0	0	114.3	I122	D120-I122 PolarHBondContact O-N 3.32Å
121	T	65.1	Low	60.6	Low	136 Å²	136	142.2 Å²	142.2	83%	0.834	77%	0.774	S	S	*	*			trans	-76	111.5	179.4	-50	0	0	0	0	111.1	T119	T119-T121 PolarHBondContact O-N 3.49Å
122	I	69.3	Low	61.6	Low	135 Å²	135	138.2 Å²	138.2	69%	0.692	76%	0.757	S	S	*	*			trans	-93.2	103	-178.4	-50.5	176.9	0	0	0	110.7	D120 L124	D120-I122 PolarHBondContact O-N 3.32Å; I122-L124 HydrophobicContact CG2-CD2 4.14Å; I122-L124 HydrophobicContact CG2-CG 4.19Å; I122-L124 PolarHBondContact O-N 3.19Å; I122-L124 VanDerWaalsContact O-N 3.07Å
123	S	62.2	Low	62.9	Low	108 Å²	108	133.4 Å²	133.4	76%	0.755	75%	0.745	S	S	*	*			trans	-70.9	97.3	173.9	-60.1	0	0	0	0	111.5
124	L	60.7	Low	64.1	Low	157 Å²	157	132.4 Å²	132.4	82%	0.822	74%	0.744	S	S	*	*			trans	-84.6	-8.6	-176.4	-74.5	168.9	0	0	0	115.1	I122	I122-L124 HydrophobicContact CG2-CD2 4.14Å; I122-L124 HydrophobicContact CG2-CG 4.19Å; I122-L124 PolarHBondContact O-N 3.19Å; I122-L124 VanDerWaalsContact O-N 3.07Å
125	L	56.8	Low	64.9	Low	144 Å²	144	132.7 Å²	132.7	75%	0.754	75%	0.747	S	S	*	*			trans	-152.6	130.4	175.9	-152.3	78.6	0	0	0	109.6	I127	L125-I127 HydrophobicContact CD2-CD1 3.85Å; L125-I127 HydrophobicContact CD2-CG1 4.33Å; L125-I127 HydrophobicContact CG-CD1 4.42Å; L125-I127 HydrophobicContact CG-CG1 4.4Å
126	D	62.5	Low	66.2	Low	151 Å²	151	126.8 Å²	126.8	81%	0.807	72%	0.722	S	S	*	*			trans	-128.3	133.1	171.8	-171.7	6.5	0	0	0	108.6
127	I	68.8	Low	67.2	Low	126 Å²	126	127.4 Å²	127.4	65%	0.646	73%	0.726	S	S	*	*			trans	-140.8	111.2	-176.9	-59.9	-178.5	0	0	0	107.4	L125	L125-I127 HydrophobicContact CD2-CD1 3.85Å; L125-I127 HydrophobicContact CD2-CG1 4.33Å; L125-I127 HydrophobicContact CG-CD1 4.42Å; L125-I127 HydrophobicContact CG-CG1 4.4Å
128	P	63.8	Low	68.1	Low	105 Å²	105	127.4 Å²	127.4	68%	0.682	72%	0.723	S	S	*	*			trans	-66.3	136.3	-179.2	26.6	-33.9	0	0	0	110.8	T130	P128-T130 PolarHBondContact O-N 2.92Å
129	P	67.6	Low	69.2	Low	102 Å²	102	118.3 Å²	118.3	66%	0.662	68%	0.681	S	S	*	*			trans	-70.7	132.1	-177.2	28.6	-34.8	0	0	0	111.5	L131	P129-L131 PolarHBondContact O-N 3.43Å
130	T	66.8	Low	70.1	Confident	142 Å²	142	118.4 Å²	118.4	87%	0.871	68%	0.677	S	S	*	*	S	Bend	trans	-80.5	-2.8	174.5	49	0	0	0	0	113.7	P128	P128-T130 PolarHBondContact O-N 2.92Å
131	L	73.6	Confident	71.1	Confident	151 Å²	151	115.2 Å²	115.2	79%	0.791	66%	0.663	S	S	*	*			trans	-132.9	125.8	-179.9	-67.9	167.4	0	0	0	108.2	P129	P129-L131 PolarHBondContact O-N 3.43Å
132	V	75.3	Confident	71.9	Confident	70 Å²	70	111.5 Å²	111.5	42%	0.424	64%	0.638	S	S	.	*			trans	-113.4	141.8	177.3	176.4	0	0	0	0	109	A136 I142	V132-A136 HydrophobicContact CG1-CB 3.66Å; V132-I142 HydrophobicContact CB-CD1 3.92Å; V132-I142 HydrophobicContact CG1-CD1 3.96Å; V132-I142 HydrophobicContact CG2-CD1 3.7Å
133	S	73.8	Confident	72.5	Confident	77 Å²	77	109.6 Å²	109.6	54%	0.538	63%	0.628	S	S	.	*			trans	-65.4	143.6	178.3	-175.3	0	0	0	0	111	N135 A136	S133-N135 PolarHBondContact O-N 3.22Å; S133-N135 VanDerWaalsContact O-N 3.13Å; S133-N135 PolarHBondContact OG-N 3.16Å; S133-A136 WeakPolarHBondContact O-CB 3.3Å; S133-A136 PolarHBondContact O-N 3.02Å; S133-A136 VanDerWaalsContact O-N 3.12Å
134	V	74	Confident	73.6	Confident	122 Å²	122	109.8 Å²	109.8	74%	0.739	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-22.4	175	-175.5	0	0	0	0	111.8
135	N	74.4	Confident	74.7	Confident	151 Å²	151	110.7 Å²	110.7	81%	0.807	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	18	-179.3	-55.9	-1.5	0	0	0	113.1	S133	S133-N135 PolarHBondContact O-N 3.22Å; S133-N135 VanDerWaalsContact O-N 3.13Å; S133-N135 PolarHBondContact OG-N 3.16Å
136	A	77.2	Confident	76.1	Confident	37 Å²	37	108.4 Å²	108.4	31%	0.306	60%	0.598	S	S	.	*	S	Bend	trans	-90.3	147.6	175	0	0	0	0	0	111	V132 S133 D138 A139	V132-A136 HydrophobicContact CG1-CB 3.66Å; S133-A136 WeakPolarHBondContact O-CB 3.3Å; S133-A136 PolarHBondContact O-N 3.02Å; S133-A136 VanDerWaalsContact O-N 3.12Å; A136-D138 PolarHBondContact O-N 2.91Å; A136-D138 VanDerWaalsContact O-N 3.16Å; A136-A139 WeakPolarHBondContact O-CB 3.08Å; A136-A139 PolarHBondContact O-N 3.29Å
137	D	78.3	Confident	77.2	Confident	166 Å²	166	106.9 Å²	106.9	89%	0.888	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-31.1	-175	-55.7	-37.8	0	0	0	113.4	A139	D137-A139 VanDerWaalsContact C-N 3.35Å
138	D	76.9	Confident	77.9	Confident	113 Å²	113	106.3 Å²	106.3	60%	0.604	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-2.2	176.3	-69.6	-39.4	0	0	0	114.3	A136 D140 V141 I142	A136-D138 PolarHBondContact O-N 2.91Å; A136-D138 VanDerWaalsContact O-N 3.16Å; D138-D140 PolarHBondContact O-N 3.19Å; D138-V141 PolarHBondContact O-N 2.87Å; D138-I142 HydrophobicContact CB-CD1 4.29Å; D138-I142 WeakPolarHBondContact O-CG1 3.45Å; D138-I142 PolarHBondContact O-N 3.12Å; D138-I142 VanDerWaalsContact O-N 3.1Å
139	A	80.1	Confident	78.8	Confident	8 Å²	8	108.8 Å²	108.8	7%	0.066	58%	0.575	C	S	.	*	H	α-helix	trans	-61.4	-43.6	-169.3	0	0	0	0	0	113.1	A136 D137 V141 I142 I143	A136-A139 WeakPolarHBondContact O-CB 3.08Å; A136-A139 PolarHBondContact O-N 3.29Å; D137-A139 VanDerWaalsContact C-N 3.35Å; A139-V141 VanDerWaalsContact C-N 3.33Å; A139-V141 PolarHBondContact O-N 3.38Å; A139-I142 PolarHBondContact O-N 3.38Å; A139-I143 VanDerWaalsContact O-CG1 3.27Å; A139-I143 WeakPolarHBondContact O-CG1 3.41Å; A139-I143 PolarHBondContact O-N 2.86Å
140	D	82.4	Confident	79.4	Confident	130 Å²	130	107 Å²	107	70%	0.695	57%	0.565	S	S	*	*	H	α-helix	trans	-62.6	-39.6	178.5	-76.3	-30.2	0	0	0	112.1	D138 I142 I143 E144	D138-D140 PolarHBondContact O-N 3.19Å; D140-I142 VanDerWaalsContact C-N 3.3Å; D140-I142 PolarHBondContact O-N 3.1Å; D140-I143 PolarHBondContact O-N 3.25Å; D140-E144 PolarHBondContact O-N 3.5Å
141	V	84.4	Confident	80	Confident	88 Å²	88	104.5 Å²	104.5	53%	0.533	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-38.4	176.7	-176.6	0	0	0	0	110.8	D138 A139 R145	D138-V141 PolarHBondContact O-N 2.87Å; A139-V141 VanDerWaalsContact C-N 3.33Å; A139-V141 PolarHBondContact O-N 3.38Å; V141-R145 VanDerWaalsContact O-CB 3.3Å; V141-R145 WeakPolarHBondContact O-CB 3.32Å; V141-R145 PolarHBondContact O-N 3.35Å
142	I	80.1	Confident	80.2	Confident	59 Å²	59	100.7 Å²	100.7	30%	0.303	53%	0.526	S	S	.	.	H	α-helix	trans	-71.3	-40	176.3	-67	167.8	0	0	0	111	V132 D138 A139 D140 R145 N146	V132-I142 HydrophobicContact CB-CD1 3.92Å; V132-I142 HydrophobicContact CG1-CD1 3.96Å; V132-I142 HydrophobicContact CG2-CD1 3.7Å; D138-I142 HydrophobicContact CB-CD1 4.29Å; D138-I142 WeakPolarHBondContact O-CG1 3.45Å; D138-I142 PolarHBondContact O-N 3.12Å; D138-I142 VanDerWaalsContact O-N 3.1Å; A139-I142 PolarHBondContact O-N 3.38Å; D140-I142 VanDerWaalsContact C-N 3.3Å; D140-I142 PolarHBondContact O-N 3.1Å; I142-R145 PolarHBondContact O-N 3.43Å; I142-N146 WeakPolarHBondContact O-CB 3.49Å; I142-N146 PolarHBondContact O-N 3.13Å; I142-N146 PolarHBondContact O-ND2 2.67Å
143	I	82.3	Confident	80	Confident	95 Å²	95	100 Å²	100	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-61.5	-46.5	175.5	-71.2	163.3	0	0	0	110.6	A139 D140 N146 K147	A139-I143 VanDerWaalsContact O-CG1 3.27Å; A139-I143 WeakPolarHBondContact O-CG1 3.41Å; A139-I143 PolarHBondContact O-N 2.86Å; D140-I143 PolarHBondContact O-N 3.25Å; I143-N146 PolarHBondContact O-N 3.44Å; I143-K147 WeakPolarHBondContact O-CB 3.39Å; I143-K147 PolarHBondContact O-N 3.25Å
144	E	85.5	Confident	80.1	Confident	112 Å²	112	106 Å²	106	52%	0.523	54%	0.535	S	S	.	.	H	α-helix	trans	-67.1	-38.9	177.6	-176.1	151.1	-124	0	0	112.2	D140 N146 K147 Q148	D140-E144 PolarHBondContact O-N 3.5Å; E144-N146 PolarHBondContact O-N 3.39Å; E144-K147 WeakPolarHBondContact O-CB 3.46Å; E144-K147 PolarHBondContact O-N 3.07Å; E144-Q148 WeakPolarHBondContact O-CG 3.11Å; E144-Q148 PolarHBondContact O-N 2.93Å
145	R	83.9	Confident	79.8	Confident	175 Å²	175	104.1 Å²	104.1	66%	0.66	52%	0.521	S	S	*	.	H	α-helix	trans	-61.6	-42	173.4	-162.1	-173.9	-148	102.7	-0.8	112.2	V141 I142 Q148 Y149	V141-R145 VanDerWaalsContact O-CB 3.3Å; V141-R145 WeakPolarHBondContact O-CB 3.32Å; V141-R145 PolarHBondContact O-N 3.35Å; I142-R145 PolarHBondContact O-N 3.43Å; R145-Q148 PolarHBondContact O-N 2.96Å; R145-Y149 WeakPolarHBondContact O-CB 3.44Å; R145-Y149 PolarHBondContact O-N 3.02Å
146	N	85.8	Confident	79.4	Confident	97 Å²	97	103.2 Å²	103.2	52%	0.519	51%	0.506	S	S	.	.	H	α-helix	trans	-66.8	-37	175.8	-73.9	-23.1	0	0	0	111.8	I142 I143 E144 Y149 S150	I142-N146 WeakPolarHBondContact O-CB 3.49Å; I142-N146 PolarHBondContact O-N 3.13Å; I142-N146 PolarHBondContact O-ND2 2.67Å; I143-N146 PolarHBondContact O-N 3.44Å; E144-N146 PolarHBondContact O-N 3.39Å; N146-Y149 PolarHBondContact O-N 3.46Å; N146-S150 WeakPolarHBondContact O-CB 3.49Å; N146-S150 PolarHBondContact O-N 3.31Å
147	K	86.8	Confident	78.6	Confident	118 Å²	118	104.4 Å²	104.4	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-49.6	173.1	-175.1	-174.5	171.8	-166.8	0	111.3	I143 E144 Y149 S150 E151	I143-K147 WeakPolarHBondContact O-CB 3.39Å; I143-K147 PolarHBondContact O-N 3.25Å; E144-K147 WeakPolarHBondContact O-CB 3.46Å; E144-K147 PolarHBondContact O-N 3.07Å; K147-Y149 VanDerWaalsContact C-N 3.31Å; K147-Y149 PolarHBondContact O-N 3.31Å; K147-S150 WeakPolarHBondContact O-CB 3.18Å; K147-S150 PolarHBondContact O-N 3.18Å; K147-S150 PolarHBondContact O-OG 2.99Å; K147-E151 PolarHBondContact O-N 2.53Å
148	Q	83.1	Confident	77.6	Confident	115 Å²	115	104.7 Å²	104.7	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-56.7	-44.1	174.7	-70.2	174.1	13.6	0	0	111.7	E144 R145 S150 E151 V152	E144-Q148 WeakPolarHBondContact O-CG 3.11Å; E144-Q148 PolarHBondContact O-N 2.93Å; R145-Q148 PolarHBondContact O-N 2.96Å; Q148-S150 PolarHBondContact O-N 2.76Å; Q148-E151 PolarHBondContact O-N 2.95Å; Q148-V152 WeakPolarHBondContact O-CG2 3.31Å; Q148-V152 PolarHBondContact O-N 3.14Å
149	Y	81.8	Confident	77	Confident	156 Å²	156	102.5 Å²	102.5	61%	0.612	51%	0.512	S	S	*	.	H	α-helix	trans	-61.4	-42	174.4	-177.2	-106.1	0	0	0	112.2	R145 N146 K147 E151 V152 C153	R145-Y149 WeakPolarHBondContact O-CB 3.44Å; R145-Y149 PolarHBondContact O-N 3.02Å; N146-Y149 PolarHBondContact O-N 3.46Å; K147-Y149 VanDerWaalsContact C-N 3.31Å; K147-Y149 PolarHBondContact O-N 3.31Å; Y149-E151 VanDerWaalsContact C-N 3.32Å; Y149-E151 PolarHBondContact O-N 3.5Å; Y149-V152 PolarHBondContact O-N 2.84Å; Y149-C153 VanDerWaalsContact CE1-SG 3.56Å; Y149-C153 PolarHBondContact O-N 3.05Å; Y149-C153 PolarHBondContact O-SG 3.25Å; Y149-C153 VanDerWaalsContact O-SG 3.38Å
150	S	81.1	Confident	76.2	Confident	65 Å²	65	111.4 Å²	111.4	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-63.1	-35.7	176.4	81.2	0	0	0	0	112.9	N146 K147 Q148 C153 R154	N146-S150 WeakPolarHBondContact O-CB 3.49Å; N146-S150 PolarHBondContact O-N 3.31Å; K147-S150 WeakPolarHBondContact O-CB 3.18Å; K147-S150 PolarHBondContact O-N 3.18Å; K147-S150 PolarHBondContact O-OG 2.99Å; Q148-S150 PolarHBondContact O-N 2.76Å; S150-C153 PolarHBondContact O-N 3.46Å; S150-R154 WeakPolarHBondContact O-CB 3.22Å; S150-R154 PolarHBondContact O-N 2.88Å
151	E	79.6	Confident	75.5	Confident	90 Å²	90	114.1 Å²	114.1	42%	0.421	56%	0.558	S	S	.	*	H	α-helix	trans	-69.4	-40.3	175	-70.8	180	-160.5	0	0	111.7	K147 Q148 Y149 R154 N155	K147-E151 PolarHBondContact O-N 2.53Å; Q148-E151 PolarHBondContact O-N 2.95Å; Y149-E151 VanDerWaalsContact C-N 3.32Å; Y149-E151 PolarHBondContact O-N 3.5Å; E151-R154 PolarHBondContact O-N 3.5Å; E151-N155 VanDerWaalsContact O-CB 3.27Å; E151-N155 WeakPolarHBondContact O-CB 3.39Å; E151-N155 PolarHBondContact O-N 2.96Å; E151-N155 PolarHBondContact O-ND2 3.21Å
152	V	77.5	Confident	74.5	Confident	70 Å²	70	115.3 Å²	115.3	42%	0.424	55%	0.554	S	S	.	*	H	α-helix	trans	-61.2	-45.5	171.2	172.1	0	0	0	0	111.1	Q148 Y149 R154 N155 R156	Q148-V152 WeakPolarHBondContact O-CG2 3.31Å; Q148-V152 PolarHBondContact O-N 3.14Å; Y149-V152 PolarHBondContact O-N 2.84Å; V152-R154 VanDerWaalsContact C-N 3.35Å; V152-R154 PolarHBondContact O-N 3.44Å; V152-N155 PolarHBondContact O-N 3.27Å; V152-R156 PolarHBondContact O-N 3.31Å
153	C	71.2	Confident	73.6	Confident	57 Å²	57	118.5 Å²	118.5	39%	0.385	58%	0.576	S	S	.	*	H	α-helix	trans	-59.7	-42.3	175.1	-72.1	0	0	0	0	112.4	Y149 S150	Y149-C153 VanDerWaalsContact CE1-SG 3.56Å; Y149-C153 PolarHBondContact O-N 3.05Å; Y149-C153 PolarHBondContact O-SG 3.25Å; Y149-C153 VanDerWaalsContact O-SG 3.38Å; S150-C153 PolarHBondContact O-N 3.46Å
154	R	74.9	Confident	72.6	Confident	202 Å²	202	119.6 Å²	119.6	76%	0.762	58%	0.583	S	S	*	*	H	α-helix	trans	-68.8	-36.4	178.2	-163	-179.8	73.7	172.5	1.5	112.4	S150 E151 V152	S150-R154 WeakPolarHBondContact O-CB 3.22Å; S150-R154 PolarHBondContact O-N 2.88Å; E151-R154 PolarHBondContact O-N 3.5Å; V152-R154 VanDerWaalsContact C-N 3.35Å; V152-R154 PolarHBondContact O-N 3.44Å
155	N	68.7	Low	71.6	Confident	83 Å²	83	125.3 Å²	125.3	44%	0.444	60%	0.599	S	S	.	*	H	α-helix	trans	-83.5	-9.1	-177.8	-64	-16.8	0	0	0	113.7	E151 V152 G157 N159	E151-N155 VanDerWaalsContact O-CB 3.27Å; E151-N155 WeakPolarHBondContact O-CB 3.39Å; E151-N155 PolarHBondContact O-N 2.96Å; E151-N155 PolarHBondContact O-ND2 3.21Å; V152-N155 PolarHBondContact O-N 3.27Å; N155-G157 VanDerWaalsContact C-N 3.35Å; N155-G157 PolarHBondContact O-N 3.17Å; N155-N159 WeakPolarHBondContact O-CB 3.47Å
156	R	64.8	Low	70.7	Confident	131 Å²	131	122.4 Å²	122.4	49%	0.494	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-65.9	-31	178	-175.7	177.3	177.4	-177.9	-1.6	113.7	V152 N158 D164	V152-R156 PolarHBondContact O-N 3.31Å; R156-N158 VanDerWaalsContact C-N 3.32Å; R156-N158 PolarHBondContact O-N 2.92Å; R156-D164 IonicContact CZ-OD1 3.27Å; R156-D164 IonicContact NE-OD1 3.35Å; R156-D164 PolarHBondContact NE-OD1 3.45Å; R156-D164 IonicContact NH2-OD1 2.69Å; R156-D164 PolarHBondContact NH2-OD1 3.41Å; R156-D164 IonicContact NH2-OD2 3.31Å
157	G	60.5	Low	69.7	Low	63 Å²	63	125.8 Å²	125.8	65%	0.649	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-68.3	-16.7	-163.6	0	0	0	0	0	117.5	N155	N155-G157 VanDerWaalsContact C-N 3.35Å; N155-G157 PolarHBondContact O-N 3.17Å
158	N	58.3	Low	68.5	Low	171 Å²	171	128.5 Å²	128.5	91%	0.914	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-147.5	36.7	-174.9	-79.9	-45	0	0	0	112.3	R156	R156-N158 VanDerWaalsContact C-N 3.32Å; R156-N158 PolarHBondContact O-N 2.92Å
159	N	64.8	Low	67.3	Low	68 Å²	68	128 Å²	128	36%	0.364	65%	0.647	S	S	.	*			trans	-135.7	108	-169.2	-166.6	-14.1	0	0	0	112.4	N155 K161 Y162	N155-N159 WeakPolarHBondContact O-CB 3.47Å; N159-K161 PolarHBondContact O-N 3.45Å; N159-Y162 HydrophobicContact CB-CD2 4.15Å; N159-Y162 HydrophobicContact CB-CE2 4.29Å; N159-Y162 PolarHBondContact O-N 3.4Å
160	E	62.5	Low	66.2	Low	194 Å²	194	128 Å²	128	91%	0.907	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-8.1	-170.7	-58.7	-177.5	147.7	0	0	115.3	Y162	E160-Y162 VanDerWaalsContact C-N 3.25Å; E160-Y162 PolarHBondContact O-N 3.33Å
161	K	67.1	Low	65.3	Low	187 Å²	187	132 Å²	132	81%	0.813	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-6.3	177.5	-65.4	-173.1	178.7	-178.6	0	114.3	N159	N159-K161 PolarHBondContact O-N 3.45Å
162	Y	63.5	Low	64.7	Low	113 Å²	113	131.2 Å²	131.2	44%	0.443	69%	0.689	S	S	.	*			trans	-113.5	127	-179.9	-58.6	-78.5	0	0	0	110.9	N159 E160	N159-Y162 HydrophobicContact CB-CD2 4.15Å; N159-Y162 HydrophobicContact CB-CE2 4.29Å; N159-Y162 PolarHBondContact O-N 3.4Å; E160-Y162 VanDerWaalsContact C-N 3.25Å; E160-Y162 PolarHBondContact O-N 3.33Å
163	V	62.9	Low	64.4	Low	126 Å²	126	132.7 Å²	132.7	76%	0.764	71%	0.708	S	S	*	*			trans	-110.7	113.1	178.8	179.6	0	0	0	0	109.2
164	D	60.9	Low	64.1	Low	119 Å²	119	136.4 Å²	136.4	64%	0.636	73%	0.729	S	S	*	*			trans	-70.8	129.7	175.5	-78.9	-16.2	0	0	0	111.1	R156	R156-D164 IonicContact CZ-OD1 3.27Å; R156-D164 IonicContact NE-OD1 3.35Å; R156-D164 PolarHBondContact NE-OD1 3.45Å; R156-D164 IonicContact NH2-OD1 2.69Å; R156-D164 PolarHBondContact NH2-OD1 3.41Å; R156-D164 IonicContact NH2-OD2 3.31Å
165	R	63.1	Low	63.8	Low	231 Å²	231	136.4 Å²	136.4	87%	0.872	74%	0.735	S	S	*	*			trans	-120.1	120.3	169.6	-73.4	-176.5	171.9	177.7	-2.1	108.9
166	A	66.1	Low	63.7	Low	114 Å²	114	140 Å²	140	94%	0.942	76%	0.755	S	S	*	*			trans	-72.4	132.8	172.1	0	0	0	0	0	110.3
167	M	64.6	Low	64	Low	169 Å²	169	142.3 Å²	142.3	83%	0.833	77%	0.768	S	S	*	*			trans	-139.5	123.5	174.2	177	169.3	147.5	0	0	108.4	T169	M167-T169 PolarHBondContact O-N 2.79Å
168	Q	61.9	Low	64.2	Low	175 Å²	175	148.5 Å²	148.5	82%	0.818	78%	0.78	S	S	*	*			trans	-91	97.8	-172.6	-173.8	177	2.6	0	0	110.9	L170	Q168-L170 PolarHBondContact O-N 3.04Å
169	T	58.6	Low	64.5	Low	104 Å²	104	146.6 Å²	146.6	64%	0.638	77%	0.769	S	S	*	*			trans	-73.9	119.2	167.3	45.9	0	0	0	0	110.2	M167 N171	M167-T169 PolarHBondContact O-N 2.79Å; T169-N171 PolarHBondContact O-N 2.85Å
170	L	58.6	Low	64.3	Low	156 Å²	156	151.8 Å²	151.8	82%	0.817	79%	0.791	S	S	*	*			trans	-76.3	107.6	172.7	-70.9	169.3	0	0	0	109.8	Q168 G172	Q168-L170 PolarHBondContact O-N 3.04Å; L170-G172 PolarHBondContact O-N 2.68Å
171	N	60.8	Low	64.2	Low	150 Å²	150	149.4 Å²	149.4	80%	0.802	78%	0.784	S	S	*	*			trans	-70.7	114.1	173.6	-70.8	-3.3	0	0	0	109.7	T169	T169-N171 PolarHBondContact O-N 2.85Å
172	G	68.6	Low	64.3	Low	73 Å²	73	147.3 Å²	147.3	75%	0.753	78%	0.782	S	S	*	*			trans	-65.1	147	176.9	0	0	0	0	0	112.7	L170	L170-G172 PolarHBondContact O-N 2.68Å
173	A	70.2	Confident	64.3	Low	100 Å²	100	149.5 Å²	149.5	83%	0.826	80%	0.8	S	S	*	*			trans	-64.3	137.6	-177.7	0	0	0	0	0	112.7	K175	A173-K175 PolarHBondContact O-N 3.26Å
174	T	64.9	Low	63.9	Low	135 Å²	135	151.9 Å²	151.9	83%	0.828	81%	0.805	S	S	*	*			trans	-67.9	109	-179.3	49.6	0	0	0	0	111.9	N176	T174-N176 PolarHBondContact O-N 3.27Å
175	K	69.3	Low	63.8	Low	202 Å²	202	153.9 Å²	153.9	88%	0.878	82%	0.815	S	S	*	*			trans	-84.4	108.9	170.2	-81	-172.8	173.9	-179.5	0	111.1	A173 K177	A173-K175 PolarHBondContact O-N 3.26Å; K175-K177 PolarHBondContact O-N 3.29Å
176	N	66.4	Low	64.2	Low	160 Å²	160	151.3 Å²	151.3	86%	0.856	82%	0.815	S	S	*	*			trans	-73.5	123.5	164	-71	-16.4	0	0	0	109.5	T174	T174-N176 PolarHBondContact O-N 3.27Å
177	K	70.6	Confident	64	Low	179 Å²	179	151.1 Å²	151.1	78%	0.778	80%	0.802	S	S	*	*			trans	-111.1	109.5	173.3	-177.1	-176.9	179.3	-174.2	0	108.7	K175 I179	K175-K177 PolarHBondContact O-N 3.29Å; K177-I179 HydrophobicContact CG-CG1 4.49Å
178	Q	65.5	Low	64	Low	193 Å²	193	150.3 Å²	150.3	90%	0.902	80%	0.801	S	S	*	*			trans	-68.7	138.3	166.3	-74	177.3	-31	0	0	109.2
179	I	62.9	Low	63.9	Low	131 Å²	131	147 Å²	147	67%	0.672	79%	0.793	S	S	*	*			trans	-120.3	118.7	174.3	-58.6	176	0	0	0	106	K177	K177-I179 HydrophobicContact CG-CG1 4.49Å
180	Q	60.9	Low	64	Low	177 Å²	177	150 Å²	150	83%	0.827	81%	0.805	S	S	*	*			trans	-124.6	99.2	179.3	-172.1	174.4	11.5	0	0	108.1
181	N	61.6	Low	64.3	Low	144 Å²	144	149.7 Å²	149.7	77%	0.77	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-90.5	126.6	169.1	-73.4	0.4	0	0	0	108.1
182	N	68.1	Low	64.3	Low	142 Å²	142	150.6 Å²	150.6	76%	0.759	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-67.7	143.7	166	-68.1	-18	0	0	0	109.1	M184	N182-M184 PolarHBondContact O-N 3.19Å
183	L	63.8	Low	63.8	Low	160 Å²	160	151.3 Å²	151.3	84%	0.838	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-62.7	135.2	170.9	-109	81.9	0	0	0	109.9	L185	L183-L185 PolarHBondContact O-N 3.04Å
184	M	54.2	Low	63.3	Low	176 Å²	176	149.5 Å²	149.5	87%	0.867	79%	0.787	S	S	*	*			trans	-70.9	107.8	165.1	-73.1	-84.5	-83.1	0	0	108.2	N182 M186	N182-M184 PolarHBondContact O-N 3.19Å; M184-M186 PolarHBondContact O-N 3.13Å
185	L	60	Low	62.6	Low	161 Å²	161	152.1 Å²	152.1	84%	0.843	79%	0.792	S	S	*	*			trans	-72.2	103.4	168.8	-69.8	172	0	0	0	108.4	L183	L183-L185 PolarHBondContact O-N 3.04Å
186	M	71.3	Confident	61.7	Low	176 Å²	176	150.9 Å²	150.9	87%	0.867	79%	0.787	S	S	*	*			trans	-73.5	137.3	164.5	-62.9	-171.4	102.3	0	0	108.6	M184	M184-M186 PolarHBondContact O-N 3.13Å
187	V	62.4	Low	61	Low	110 Å²	110	145 Å²	145	67%	0.667	76%	0.763	S	S	*	*			trans	-123.8	104.2	176.8	-176.6	0	0	0	0	106.9	T189	V187-T189 HydrophobicContact CG1-CG2 4.16Å; V187-T189 PolarHBondContact O-N 3.46Å
188	D	63.1	Low	60.3	Low	152 Å²	152	147.1 Å²	147.1	81%	0.813	77%	0.767	S	S	*	*			trans	-63.9	129.9	175.3	-60.4	-41	0	0	0	109.1
189	T	60	Low	59.8	Low	107 Å²	107	141 Å²	141	66%	0.656	74%	0.743	S	S	*	*			trans	-136.2	84.7	-172.4	37.1	0	0	0	0	110.5	V187 I191	V187-T189 HydrophobicContact CG1-CG2 4.16Å; V187-T189 PolarHBondContact O-N 3.46Å; T189-I191 PolarHBondContact O-N 3.13Å
190	D	60.7	Low	59.6	Low	166 Å²	166	138.4 Å²	138.4	89%	0.888	73%	0.733	S	S	*	*			trans	-72.2	119.3	177.5	-68.9	-34.5	0	0	0	111.4
191	I	65	Low	59.5	Low	149 Å²	149	135.8 Å²	135.8	76%	0.764	72%	0.721	S	S	*	*			trans	-120.3	104.5	178.3	-58.6	178.8	0	0	0	109.6	T189 A193	T189-I191 PolarHBondContact O-N 3.13Å; I191-A193 PolarHBondContact O-N 3.33Å
192	L	61.4	Low	59.2	Low	170 Å²	170	130.7 Å²	130.7	89%	0.89	70%	0.702	S	S	*	*			trans	-78	84.5	174.1	-86.4	167.8	0	0	0	111.8	S194	L192-S194 PolarHBondContact O-N 3.23Å
193	A	57	Low	58.8	Low	87 Å²	87	128.4 Å²	128.4	72%	0.719	70%	0.696	S	S	*	*			trans	-79.4	88.2	170	0	0	0	0	0	111.3	I191	I191-A193 PolarHBondContact O-N 3.33Å
194	S	59.9	Low	58.5	Low	63 Å²	63	128.9 Å²	128.9	44%	0.441	69%	0.688	S	S	.	*			trans	-76.3	139	173.4	54.8	0	0	0	0	112.1	L192 F196	L192-S194 PolarHBondContact O-N 3.23Å; S194-F196 PolarHBondContact O-N 3.45Å
195	M	49.9	Very low	58.3	Low	190 Å²	190	126 Å²	126	94%	0.936	67%	0.673	S	S	*	*	S	Bend	trans	-67.6	-19.1	-179.9	-67	-153.8	-54.2	0	0	114.1	G197	M195-G197 PolarHBondContact O-N 3.29Å
196	F	51.2	Low	57.9	Low	176 Å²	176	120.8 Å²	120.8	77%	0.772	65%	0.652	S	S	*	*	S	Bend	trans	-74.4	96	171.3	-66.3	-76.9	0	0	0	108.4	S194 W198	S194-F196 PolarHBondContact O-N 3.45Å; F196-W198 PolarHBondContact O-N 3.02Å
197	G	51.7	Low	56.9	Low	35 Å²	35	115.8 Å²	115.8	36%	0.361	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.7	28.1	-158.3	0	0	0	0	0	119.3	M195 T199 V200 Q201	M195-G197 PolarHBondContact O-N 3.29Å; G197-T199 VanDerWaalsContact C-N 3.31Å; G197-T199 PolarHBondContact O-N 2.78Å; G197-V200 PolarHBondContact O-N 3.31Å; G197-Q201 VanDerWaalsContact O-CB 3.24Å; G197-Q201 WeakPolarHBondContact O-CB 3.43Å; G197-Q201 PolarHBondContact O-N 3.47Å
198	W	56.5	Low	56.2	Low	225 Å²	225	116.5 Å²	116.5	85%	0.852	63%	0.629	S	S	*	*	H	α-helix	trans	-58.6	-42.1	172.5	-70.2	67.5	0	0	0	112	F196 G202	F196-W198 PolarHBondContact O-N 3.02Å; W198-G202 PolarHBondContact O-N 2.72Å
199	T	53.6	Low	55.5	Low	64 Å²	64	114 Å²	114	39%	0.393	62%	0.615	S	S	.	*	H	α-helix	trans	-61.1	-51.1	174	47.6	0	0	0	0	111.1	G197 G202 C203	G197-T199 VanDerWaalsContact C-N 3.31Å; G197-T199 PolarHBondContact O-N 2.78Å; T199-G202 PolarHBondContact O-N 3.27Å; T199-C203 PolarHBondContact O-N 2.96Å; T199-C203 PolarHBondContact O-SG 3.47Å; T199-C203 VanDerWaalsContact O-SG 3.36Å
200	V	60.4	Low	54.7	Low	77 Å²	77	115.9 Å²	115.9	47%	0.467	61%	0.614	S	S	.	*	H	α-helix	trans	-60.4	-46.6	178.5	-179.8	0	0	0	0	111.4	G197 G202 C203 Y204	G197-V200 PolarHBondContact O-N 3.31Å; V200-G202 PolarHBondContact O-N 2.95Å; V200-C203 PolarHBondContact O-N 3.4Å; V200-Y204 HydrophobicContact CG1-CD2 3.83Å; V200-Y204 HydrophobicContact CG1-CE2 3.6Å; V200-Y204 VanDerWaalsContact O-CD2 3.24Å; V200-Y204 WeakPolarHBondContact O-CD2 3.48Å; V200-Y204 PolarHBondContact O-N 3.38Å
201	Q	57.1	Low	54	Low	122 Å²	122	111 Å²	111	57%	0.57	59%	0.593	S	S	*	*	H	α-helix	trans	-60.4	-44.8	177.6	-165.6	82.7	-6.2	0	0	111.5	G197 Y204 Q205	G197-Q201 VanDerWaalsContact O-CB 3.24Å; G197-Q201 WeakPolarHBondContact O-CB 3.43Å; G197-Q201 PolarHBondContact O-N 3.47Å; Q201-Y204 PolarHBondContact O-N 3.45Å; Q201-Y204 VanDerWaalsContact O-N 3.14Å; Q201-Q205 PolarHBondContact O-N 3.04Å
202	G	56.8	Low	53.2	Low	37 Å²	37	107.9 Å²	107.9	38%	0.381	58%	0.577	S	S	.	*	H	α-helix	trans	-61.1	-42.8	175	0	0	0	0	0	112.5	W198 T199 V200 Y204 Q205 A206	W198-G202 PolarHBondContact O-N 2.72Å; T199-G202 PolarHBondContact O-N 3.27Å; V200-G202 PolarHBondContact O-N 2.95Å; G202-Y204 VanDerWaalsContact C-N 3.27Å; G202-Y204 PolarHBondContact O-N 2.95Å; G202-Q205 PolarHBondContact O-N 3.25Å; G202-A206 PolarHBondContact O-N 3.07Å
203	C	58.6	Low	52.4	Low	94 Å²	94	104.1 Å²	104.1	64%	0.635	56%	0.558	S	S	*	*	H	α-helix	trans	-65.7	-24.3	174	-70.1	0	0	0	0	113.8	T199 V200 P207	T199-C203 PolarHBondContact O-N 2.96Å; T199-C203 PolarHBondContact O-SG 3.47Å; T199-C203 VanDerWaalsContact O-SG 3.36Å; V200-C203 PolarHBondContact O-N 3.4Å; C203-P207 WeakPolarHBondContact O-CD 3.3Å; C203-P207 WeakPolarHBondContact O-CG 3.35Å
204	Y	57.5	Low	52	Low	169 Å²	169	103.9 Å²	103.9	66%	0.663	54%	0.543	S	S	*	.	H	α-helix	trans	-82.1	-29.9	170.2	-81.5	-65.7	0	0	0	113.6	V200 Q201 G202 Q208	V200-Y204 HydrophobicContact CG1-CD2 3.83Å; V200-Y204 HydrophobicContact CG1-CE2 3.6Å; V200-Y204 VanDerWaalsContact O-CD2 3.24Å; V200-Y204 WeakPolarHBondContact O-CD2 3.48Å; V200-Y204 PolarHBondContact O-N 3.38Å; Q201-Y204 PolarHBondContact O-N 3.45Å; Q201-Y204 VanDerWaalsContact O-N 3.14Å; G202-Y204 VanDerWaalsContact C-N 3.27Å; G202-Y204 PolarHBondContact O-N 2.95Å; Y204-Q208 WeakPolarHBondContact O-CG 3.08Å
205	Q	50.3	Low	51.1	Low	117 Å²	117	105.2 Å²	105.2	55%	0.547	55%	0.549	S	S	.	.	H	α-helix	trans	-81.2	-33.8	177.7	-81.7	-179.8	-57.1	0	0	113.8	Q201 G202 Q208 I209	Q201-Q205 PolarHBondContact O-N 3.04Å; G202-Q205 PolarHBondContact O-N 3.25Å; Q205-Q208 WeakPolarHBondContact O-CB 3.24Å; Q205-Q208 PolarHBondContact O-N 3.49Å; Q205-Q208 VanDerWaalsContact O-N 3.16Å; Q205-I209 WeakPolarHBondContact O-CG1 3.32Å; Q205-I209 PolarHBondContact O-N 2.8Å; Q205-I209 VanDerWaalsContact O-N 3.09Å
206	A	51.6	Low	50.5	Low	51 Å²	51	102.6 Å²	102.6	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-58.9	-43.5	-179.5	0	0	0	0	0	114	G202 Q208 I209 F210	G202-A206 PolarHBondContact O-N 3.07Å; A206-Q208 PolarHBondContact O-N 3.48Å; A206-I209 PolarHBondContact O-N 2.98Å; A206-F210 PolarHBondContact O-N 3.24Å; A206-F210 VanDerWaalsContact O-N 3.09Å
207	P	51.5	Low	49.9	Very low	71 Å²	71	98.3 Å²	98.3	46%	0.461	52%	0.521	S	S	.	.	H	α-helix	trans	-61.5	-39.1	173.6	-24.5	35	0	0	0	113.2	C203 F210 S211	C203-P207 WeakPolarHBondContact O-CD 3.3Å; C203-P207 WeakPolarHBondContact O-CG 3.35Å; P207-F210 WeakPolarHBondContact O-CB 3.47Å; P207-F210 PolarHBondContact O-N 2.86Å; P207-S211 PolarHBondContact O-N 3.17Å; P207-S211 PolarHBondContact O-OG 3.29Å; P207-S211 VanDerWaalsContact O-OG 3.12Å
208	Q	46.4	Very low	49.1	Very low	125 Å²	125	104.8 Å²	104.8	58%	0.584	54%	0.535	S	S	*	.	H	α-helix	trans	-63.2	-43.8	179.2	-64	-71.4	-5	0	0	111.2	Y204 Q205 A206 F210 S211 I212	Y204-Q208 WeakPolarHBondContact O-CG 3.08Å; Q205-Q208 WeakPolarHBondContact O-CB 3.24Å; Q205-Q208 PolarHBondContact O-N 3.49Å; Q205-Q208 VanDerWaalsContact O-N 3.16Å; A206-Q208 PolarHBondContact O-N 3.48Å; Q208-F210 VanDerWaalsContact C-N 3.33Å; Q208-F210 PolarHBondContact O-N 3.33Å; Q208-S211 PolarHBondContact O-N 3.32Å; Q208-I212 VanDerWaalsContact O-CG1 3.31Å; Q208-I212 WeakPolarHBondContact O-CG1 3.47Å; Q208-I212 PolarHBondContact O-N 2.99Å
209	I	49.2	Very low	48	Very low	99 Å²	99	97 Å²	97	51%	0.508	52%	0.519	S	S	.	.	H	α-helix	trans	-63.5	-40.8	176.3	-64.4	165.5	0	0	0	110.6	Q205 A206 I212 N213	Q205-I209 WeakPolarHBondContact O-CG1 3.32Å; Q205-I209 PolarHBondContact O-N 2.8Å; Q205-I209 VanDerWaalsContact O-N 3.09Å; A206-I209 PolarHBondContact O-N 2.98Å; I209-I212 PolarHBondContact O-N 3.17Å; I209-N213 PolarHBondContact O-N 3.43Å
210	F	43.4	Very low	47	Very low	147 Å²	147	100.4 Å²	100.4	65%	0.645	54%	0.535	S	S	*	.	H	α-helix	trans	-60.9	-46.4	172.1	-102	-89.5	0	0	0	112.3	A206 P207 Q208 I212 N213 I214	A206-F210 PolarHBondContact O-N 3.24Å; A206-F210 VanDerWaalsContact O-N 3.09Å; P207-F210 WeakPolarHBondContact O-CB 3.47Å; P207-F210 PolarHBondContact O-N 2.86Å; Q208-F210 VanDerWaalsContact C-N 3.33Å; Q208-F210 PolarHBondContact O-N 3.33Å; F210-I212 VanDerWaalsContact C-N 3.3Å; F210-I212 PolarHBondContact O-N 3.24Å; F210-N213 PolarHBondContact O-N 3.16Å; F210-I214 WeakPolarHBondContact O-CB 3.4Å; F210-I214 VanDerWaalsContact O-CG1 3.25Å; F210-I214 WeakPolarHBondContact O-CG1 3.31Å; F210-I214 PolarHBondContact O-N 3.36Å
211	S	45.3	Very low	45.9	Very low	63 Å²	63	101.9 Å²	101.9	44%	0.441	54%	0.544	S	S	.	.	H	α-helix	trans	-61.2	-35.2	176.9	-61.8	0	0	0	0	113.1	P207 Q208 T215	P207-S211 PolarHBondContact O-N 3.17Å; P207-S211 PolarHBondContact O-OG 3.29Å; P207-S211 VanDerWaalsContact O-OG 3.12Å; Q208-S211 PolarHBondContact O-N 3.32Å; S211-T215 WeakPolarHBondContact O-CG2 3.48Å; S211-T215 PolarHBondContact O-N 2.97Å; S211-T215 PolarHBondContact O-OG1 3.48Å
212	I	48.1	Very low	44.9	Very low	83 Å²	83	102 Å²	102	43%	0.426	55%	0.554	S	S	.	*	H	α-helix	trans	-70.3	-39.8	175.9	-68.4	163.3	0	0	0	111.3	Q208 I209 F210 T215 K216	Q208-I212 VanDerWaalsContact O-CG1 3.31Å; Q208-I212 WeakPolarHBondContact O-CG1 3.47Å; Q208-I212 PolarHBondContact O-N 2.99Å; I209-I212 PolarHBondContact O-N 3.17Å; F210-I212 VanDerWaalsContact C-N 3.3Å; F210-I212 PolarHBondContact O-N 3.24Å; I212-T215 WeakPolarHBondContact CA-OG1 3.4Å; I212-T215 PolarHBondContact O-N 3.2Å; I212-T215 PolarHBondContact O-OG1 3.46Å; I212-T215 VanDerWaalsContact O-OG1 3.09Å; I212-K216 HydrophobicContact CG2-CD 4.33Å; I212-K216 WeakPolarHBondContact O-CB 3.37Å; I212-K216 WeakPolarHBondContact O-CG 3.48Å; I212-K216 PolarHBondContact O-N 3.03Å
213	N	44.4	Very low	44	Very low	91 Å²	91	108.2 Å²	108.2	49%	0.487	57%	0.573	S	S	.	*	H	α-helix	trans	-71.3	-32.7	176.1	-73.9	-17.1	0	0	0	112.4	I209 F210 T217	I209-N213 PolarHBondContact O-N 3.43Å; F210-N213 PolarHBondContact O-N 3.16Å; N213-T217 PolarHBondContact O-N 3.49Å; N213-T217 PolarHBondContact O-OG1 3.28Å
214	I	49.5	Very low	42.6	Very low	82 Å²	82	111.7 Å²	111.7	42%	0.421	58%	0.584	S	S	.	*	H	α-helix	trans	-66.3	-46.4	172.7	-70.3	165.2	0	0	0	110.6	F210 K216 T217 Y218	F210-I214 WeakPolarHBondContact O-CB 3.4Å; F210-I214 VanDerWaalsContact O-CG1 3.25Å; F210-I214 WeakPolarHBondContact O-CG1 3.31Å; F210-I214 PolarHBondContact O-N 3.36Å; I214-K216 PolarHBondContact O-N 2.9Å; I214-T217 WeakPolarHBondContact CA-OG1 3.38Å; I214-T217 PolarHBondContact O-N 3.12Å; I214-T217 PolarHBondContact O-OG1 3.19Å; I214-Y218 HydrophobicContact CG2-CD2 3.74Å; I214-Y218 HydrophobicContact CG2-CE2 3.68Å; I214-Y218 VanDerWaalsContact O-CD2 3.28Å; I214-Y218 WeakPolarHBondContact O-CD2 3.48Å; I214-Y218 PolarHBondContact O-N 2.88Å
215	T	39.9	Very low	41.3	Very low	92 Å²	92	113.2 Å²	113.2	56%	0.564	59%	0.594	S	S	*	*	H	α-helix	trans	-66.5	-37.5	177.9	47.5	0	0	0	0	112.8	S211 I212 Y218 A219	S211-T215 WeakPolarHBondContact O-CG2 3.48Å; S211-T215 PolarHBondContact O-N 2.97Å; S211-T215 PolarHBondContact O-OG1 3.48Å; I212-T215 WeakPolarHBondContact CA-OG1 3.4Å; I212-T215 PolarHBondContact O-N 3.2Å; I212-T215 PolarHBondContact O-OG1 3.46Å; I212-T215 VanDerWaalsContact O-OG1 3.09Å; T215-Y218 PolarHBondContact O-N 3.49Å; T215-A219 PolarHBondContact O-N 2.75Å
216	K	38	Very low	40.4	Very low	134 Å²	134	113 Å²	113	58%	0.583	61%	0.606	S	S	*	*	H	α-helix	trans	-64.7	-37	172.7	-75.4	179.8	178.2	-177.8	0	113.6	I212 I214 N220	I212-K216 HydrophobicContact CG2-CD 4.33Å; I212-K216 WeakPolarHBondContact O-CB 3.37Å; I212-K216 WeakPolarHBondContact O-CG 3.48Å; I212-K216 PolarHBondContact O-N 3.03Å; I214-K216 PolarHBondContact O-N 2.9Å; K216-N220 PolarHBondContact O-N 3.45Å
217	T	37.5	Very low	39.3	Very low	86 Å²	86	122.3 Å²	122.3	53%	0.528	63%	0.63	S	S	.	*	H	α-helix	trans	-72.4	-35.6	176	43.1	0	0	0	0	112.2	N213 I214 N220 V221	N213-T217 PolarHBondContact O-N 3.49Å; N213-T217 PolarHBondContact O-OG1 3.28Å; I214-T217 WeakPolarHBondContact CA-OG1 3.38Å; I214-T217 PolarHBondContact O-N 3.12Å; I214-T217 PolarHBondContact O-OG1 3.19Å; T217-N220 PolarHBondContact O-N 2.99Å; T217-V221 VanDerWaalsContact O-CG2 3.27Å; T217-V221 WeakPolarHBondContact O-CG2 3.24Å; T217-V221 PolarHBondContact O-N 3.15Å
218	Y	36.4	Very low	38.2	Very low	171 Å²	171	128.8 Å²	128.8	67%	0.671	65%	0.65	S	S	*	*	H	α-helix	trans	-67.2	-35	172	-82	-64.5	0	0	0	113.8	I214 T215 N220 V221	I214-Y218 HydrophobicContact CG2-CD2 3.74Å; I214-Y218 HydrophobicContact CG2-CE2 3.68Å; I214-Y218 VanDerWaalsContact O-CD2 3.28Å; I214-Y218 WeakPolarHBondContact O-CD2 3.48Å; I214-Y218 PolarHBondContact O-N 2.88Å; T215-Y218 PolarHBondContact O-N 3.49Å; Y218-N220 VanDerWaalsContact C-N 3.32Å; Y218-N220 PolarHBondContact O-N 2.96Å; Y218-V221 PolarHBondContact O-N 3.12Å
219	A	33.1	Very low	37.4	Very low	62 Å²	62	133.5 Å²	133.5	51%	0.512	66%	0.663	S	S	.	*	H	α-helix	trans	-62	-38	175.2	0	0	0	0	0	112.8	T215 V221 T222	T215-A219 PolarHBondContact O-N 2.75Å; A219-V221 VanDerWaalsContact C-N 3.31Å; A219-V221 PolarHBondContact O-N 3.47Å; A219-T222 PolarHBondContact O-OG1 3.37Å
220	N	32.4	Very low	36.4	Very low	135 Å²	135	136.8 Å²	136.8	72%	0.722	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-5.5	-179.9	-70.8	5.3	0	0	0	114	K216 T217 Y218	K216-N220 PolarHBondContact O-N 3.45Å; T217-N220 PolarHBondContact O-N 2.99Å; Y218-N220 VanDerWaalsContact C-N 3.32Å; Y218-N220 PolarHBondContact O-N 2.96Å
221	V	38	Very low	35.6	Very low	108 Å²	108	135.2 Å²	135.2	66%	0.655	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-12.3	-179.2	163.7	0	0	0	0	112.8	T217 Y218 A219 E223	T217-V221 VanDerWaalsContact O-CG2 3.27Å; T217-V221 WeakPolarHBondContact O-CG2 3.24Å; T217-V221 PolarHBondContact O-N 3.15Å; Y218-V221 PolarHBondContact O-N 3.12Å; A219-V221 VanDerWaalsContact C-N 3.31Å; A219-V221 PolarHBondContact O-N 3.47Å; V221-E223 VanDerWaalsContact C-N 3.29Å; V221-E223 PolarHBondContact O-N 2.88Å
222	T	34.3	Very low	34.6	Very low	126 Å²	126	143.4 Å²	143.4	77%	0.773	71%	0.705	S	S	*	*	S	Bend	trans	-70.6	-19.5	174.1	11.2	0	0	0	0	114.4	A219	A219-T222 PolarHBondContact O-OG1 3.37Å
223	E	37.8	Very low	33.7	Very low	167 Å²	167	146.6 Å²	146.6	78%	0.78	72%	0.722	S	S	*	*	S	Bend	trans	-122.8	80.1	174.7	-70.7	-162	125.5	0	0	112.6	V221	V221-E223 VanDerWaalsContact C-N 3.29Å; V221-E223 PolarHBondContact O-N 2.88Å
224	L	30.4	Very low	32.8	Very low	167 Å²	167	150.2 Å²	150.2	87%	0.874	74%	0.736	S	S	*	*			trans	-173.1	113.3	131.4	-122.8	78.9	0	0	0	110.3
225	K	29.5	Very low	31.7	Very low	201 Å²	201	151.9 Å²	151.9	87%	0.874	75%	0.75	S	S	*	*			trans	-92.5	145.7	165.8	-82.4	-178.8	178.2	172.4	0	110.5
226	S	31.2	Very low	31.1	Very low	113 Å²	113	153.7 Å²	153.7	79%	0.79	76%	0.755	S	S	*	*			trans	74.9	88.1	169.5	74.1	0	0	0	0	118.6
227	R	28.4	Very low	30.6	Very low	246 Å²	246	152.4 Å²	152.4	93%	0.928	76%	0.762	S	S	*	*				-164.2	126.5	115.2	-107.2	165	177.3	172.5	-0.1	111.2
228	K	30.1	Very low	30.2	Very low	206 Å²	206	153.5 Å²	153.5	90%	0.896	77%	0.769	S	S	*	*			trans	-76.8	122.6	169.6	-76.3	-174	173.1	-173.2	0	109.8
229	R	27.6	Very low	30	Very low	224 Å²	224	152 Å²	152	85%	0.845	78%	0.782	S	S	*	*			trans	-146.1	125.3	150.7	-75.9	-166.8	172.6	131.4	-2.4	107.8	V231	R229-V231 PolarHBondContact O-N 3.05Å
230	D	28.6	Very low	29.7	Very low	168 Å²	168	153.5 Å²	153.5	90%	0.898	79%	0.789	S	S	*	*			trans	-74.7	118.2	178	-60.7	-73.9	0	0	0	110
231	V	27.6	Very low	30.1	Very low	114 Å²	114	155.3 Å²	155.3	69%	0.691	80%	0.798	S	S	*	*			trans	-123.1	108.9	172.4	-179.2	0	0	0	0	107.7	R229 L233	R229-V231 PolarHBondContact O-N 3.05Å; V231-L233 HydrophobicContact CG1-CG 4.43Å; V231-L233 PolarHBondContact O-N 3.33Å; V231-L233 VanDerWaalsContact O-N 3.07Å
232	R	24.8	Very low	29.9	Very low	236 Å²	236	159 Å²	159	89%	0.891	81%	0.805	S	S	*	*			trans	-71.9	97.4	171.1	-87	-176.6	167.3	179.7	-3.8	109.4	Q234	R232-Q234 PolarHBondContact O-N 3.49Å
233	L	27.3	Very low	29.5	Very low	150 Å²	150	160.7 Å²	160.7	79%	0.785	81%	0.81	S	S	*	*			trans	-78.5	94.2	165.7	-77.6	163.3	0	0	0	109.6	V231	V231-L233 HydrophobicContact CG1-CG 4.43Å; V231-L233 PolarHBondContact O-N 3.33Å; V231-L233 VanDerWaalsContact O-N 3.07Å
234	Q	26.1	Very low	29.6	Very low	166 Å²	166	159.3 Å²	159.3	78%	0.776	81%	0.812	S	S	*	*			trans	-82.6	106.2	158.8	-75.4	-176.8	-89.5	0	0	108.4	R232 I236	R232-Q234 PolarHBondContact O-N 3.49Å; Q234-I236 PolarHBondContact O-N 3.43Å
235	V	26.3	Very low	29.9	Very low	118 Å²	118	159.9 Å²	159.9	72%	0.715	81%	0.81	S	S	*	*			trans	-87.2	104.6	169.6	-179.6	0	0	0	0	107.6
236	I	27.8	Very low	30.3	Very low	130 Å²	130	157.2 Å²	157.2	67%	0.667	81%	0.811	S	S	*	*			trans	-87.7	109.9	173.8	-61.3	177.4	0	0	0	107.8	Q234 T238	Q234-I236 PolarHBondContact O-N 3.43Å; I236-T238 HydrophobicContact CG2-CG2 3.7Å
237	S	28.3	Very low	30.2	Very low	106 Å²	106	158 Å²	158	74%	0.741	81%	0.811	S	S	*	*			trans	-105.7	93.1	173.1	-63.8	0	0	0	0	109.2
238	T	28	Very low	30.7	Very low	110 Å²	110	150.5 Å²	150.5	68%	0.675	81%	0.81	S	S	*	*			trans	-126	92.6	-178	47.2	0	0	0	0	111.5	I236 S240	I236-T238 HydrophobicContact CG2-CG2 3.7Å; T238-S240 PolarHBondContact O-N 3.02Å
239	C	31.5	Very low	30.7	Very low	138 Å²	138	145.1 Å²	145.1	93%	0.932	80%	0.798	S	S	*	*			trans	-79.3	89.9	159.6	44.3	0	0	0	0	109.1
240	S	28.6	Very low	31.1	Very low	95 Å²	95	139.5 Å²	139.5	66%	0.664	79%	0.793	S	S	*	*			trans	-138.6	116.5	172.8	-174.6	0	0	0	0	110.4	T238 K242	T238-S240 PolarHBondContact O-N 3.02Å; S240-K242 VanDerWaalsContact C-N 3.31Å; S240-K242 PolarHBondContact O-N 3.32Å; S240-K242 VanDerWaalsContact O-N 3.13Å
241	L	38.8	Very low	31.7	Very low	173 Å²	173	138.4 Å²	138.4	91%	0.906	79%	0.787	S	S	*	*	S	Bend	trans	-85.7	72.6	175.1	-99.7	166.9	0	0	0	110.1
242	K	33.8	Very low	32.8	Very low	185 Å²	185	138.2 Å²	138.2	80%	0.804	78%	0.782	S	S	*	*			trans	-173.3	73.3	165.5	-104.3	158	-171.2	177.5	0	110	S240	S240-K242 VanDerWaalsContact C-N 3.31Å; S240-K242 PolarHBondContact O-N 3.32Å; S240-K242 VanDerWaalsContact O-N 3.13Å
243	D	27.3	Very low	34.1	Very low	162 Å²	162	131 Å²	131	87%	0.866	76%	0.764	S	S	*	*			trans	-170.5	79.5	158.4	-94.5	-28.5	0	0	0	108.1
244	V	39.5	Very low	35.1	Very low	138 Å²	138	130.7 Å²	130.7	84%	0.836	76%	0.758	S	S	*	*			trans	-130.6	67.8	172.2	-172.4	0	0	0	0	109.3
245	E	36.8	Very low	36.6	Very low	178 Å²	178	124.6 Å²	124.6	83%	0.832	74%	0.736	S	S	*	*	S	Bend	trans	-146	145.7	157.8	-109.9	169.8	-142.1	0	0	107.7
246	T	37.4	Very low	38.5	Very low	145 Å²	145	123 Å²	123	89%	0.89	72%	0.724	S	S	*	*	S	Bend	trans	75.1	25.2	177.7	73.4	0	0	0	0	120.4
247	V	28.7	Very low	40.5	Very low	131 Å²	131	123.3 Å²	123.3	79%	0.794	72%	0.721	S	S	*	*			trans	-124.7	118	149.5	-177.3	0	0	0	0	110.2	S249	V247-S249 PolarHBondContact O-N 3.23Å
248	G	38.9	Very low	42.7	Very low	88 Å²	88	124.1 Å²	124.1	91%	0.907	71%	0.713	S	S	*	*			trans	-84.4	93.4	178.7	0	0	0	0	0	112.5
249	S	31.8	Very low	45.1	Very low	93 Å²	93	124.3 Å²	124.3	65%	0.65	71%	0.709	S	S	*	*			trans	-139.7	123.6	161	52.8	0	0	0	0	110.2	V247 L251	V247-S249 PolarHBondContact O-N 3.23Å; S249-L251 PolarHBondContact O-N 2.85Å; S249-L251 VanDerWaalsContact O-N 3.17Å
250	S	34.8	Very low	47.6	Very low	105 Å²	105	122.2 Å²	122.2	73%	0.734	69%	0.688	S	S	*	*			trans	-67.4	111.2	175.2	50.3	0	0	0	0	110	N252	S250-N252 PolarHBondContact O-N 3.07Å; S250-N252 VanDerWaalsContact O-N 3.07Å
251	L	42.5	Very low	50	Low	146 Å²	146	122.9 Å²	122.9	76%	0.764	68%	0.682	S	S	*	*			trans	-64.7	104.9	167.7	-82.5	160.9	0	0	0	108.9	S249 T253	S249-L251 PolarHBondContact O-N 2.85Å; S249-L251 VanDerWaalsContact O-N 3.17Å; L251-T253 HydrophobicContact CB-CG2 4.48Å; L251-T253 PolarHBondContact O-N 3.15Å
252	N	50.6	Low	52.1	Low	110 Å²	110	119.1 Å²	119.1	59%	0.588	67%	0.666	S	S	*	*			trans	-73.8	68.5	172.3	-82	-1.9	0	0	0	110.2	S250 Q254 A255 D256	S250-N252 PolarHBondContact O-N 3.07Å; S250-N252 VanDerWaalsContact O-N 3.07Å; N252-Q254 PolarHBondContact O-N 3.24Å; N252-Q254 VanDerWaalsContact O-N 3.07Å; N252-A255 HydrophobicContact CB-CB 3.86Å; N252-A255 WeakPolarHBondContact O-CA 3.21Å; N252-A255 WeakPolarHBondContact O-CB 3.49Å; N252-A255 PolarHBondContact O-N 3.4Å; N252-D256 PolarHBondContact O-N 3.39Å
253	T	50.8	Low	54.7	Low	85 Å²	85	112.4 Å²	112.4	52%	0.521	64%	0.642	S	S	.	*	H	α-helix	trans	-52.3	-31.4	175	52.2	0	0	0	0	112.3	L251 D256 F257	L251-T253 HydrophobicContact CB-CG2 4.48Å; L251-T253 PolarHBondContact O-N 3.15Å; T253-D256 PolarHBondContact O-N 3.04Å; T253-F257 WeakPolarHBondContact O-CD2 3.48Å; T253-F257 PolarHBondContact O-N 2.98Å
254	Q	49.6	Very low	57.4	Low	142 Å²	142	111.4 Å²	111.4	66%	0.664	64%	0.637	S	S	*	*	H	α-helix	trans	-66.5	-34.6	174.6	-169.3	163.1	-15.3	0	0	113.3	N252 F257 E258	N252-Q254 PolarHBondContact O-N 3.24Å; N252-Q254 VanDerWaalsContact O-N 3.07Å; Q254-F257 PolarHBondContact O-N 3.14Å; Q254-E258 PolarHBondContact O-N 3.37Å
255	A	57.7	Low	59.7	Low	38 Å²	38	113 Å²	113	31%	0.314	63%	0.632	S	S	.	*	H	α-helix	trans	-71.5	-35	173.3	0	0	0	0	0	111.6	N252 F257 E258 L259	N252-A255 HydrophobicContact CB-CB 3.86Å; N252-A255 WeakPolarHBondContact O-CA 3.21Å; N252-A255 WeakPolarHBondContact O-CB 3.49Å; N252-A255 PolarHBondContact O-N 3.4Å; A255-F257 VanDerWaalsContact C-N 3.34Å; A255-E258 PolarHBondContact O-N 3.17Å; A255-L259 WeakPolarHBondContact O-CB 3.24Å; A255-L259 WeakPolarHBondContact O-CG 3.48Å; A255-L259 PolarHBondContact O-N 2.88Å
256	D	65.9	Low	62.2	Low	84 Å²	84	107.9 Å²	107.9	45%	0.449	61%	0.608	S	S	.	*	H	α-helix	trans	-64.3	-39.3	172.7	-65.3	-40.4	0	0	0	111.4	N252 T253 L259 I260	N252-D256 PolarHBondContact O-N 3.39Å; T253-D256 PolarHBondContact O-N 3.04Å; D256-L259 PolarHBondContact O-N 2.98Å; D256-I260 WeakPolarHBondContact O-CB 2.99Å; D256-I260 WeakPolarHBondContact O-CD1 3.27Å; D256-I260 VanDerWaalsContact O-CG1 3.24Å; D256-I260 WeakPolarHBondContact O-CG1 3.27Å; D256-I260 PolarHBondContact O-N 3.32Å
257	F	69.9	Low	64.5	Low	138 Å²	138	105.8 Å²	105.8	61%	0.605	59%	0.588	S	S	*	*	H	α-helix	trans	-64.5	-42.1	172.6	-75.6	-61	0	0	0	112.7	T253 Q254 A255 L259 I260 M261	T253-F257 WeakPolarHBondContact O-CD2 3.48Å; T253-F257 PolarHBondContact O-N 2.98Å; Q254-F257 PolarHBondContact O-N 3.14Å; A255-F257 VanDerWaalsContact C-N 3.34Å; F257-L259 VanDerWaalsContact C-N 3.34Å; F257-L259 PolarHBondContact O-N 3.2Å; F257-I260 PolarHBondContact O-N 3.37Å; F257-M261 WeakPolarHBondContact O-CB 3.4Å; F257-M261 WeakPolarHBondContact O-CG 3.35Å; F257-M261 PolarHBondContact O-N 3.09Å
258	E	74.4	Confident	67.2	Low	123 Å²	123	107 Å²	107	58%	0.575	58%	0.579	S	S	*	*	H	α-helix	trans	-63.6	-38.2	174.5	-73.1	176.4	-172.8	0	0	111.9	Q254 A255 M261 T262	Q254-E258 PolarHBondContact O-N 3.37Å; A255-E258 PolarHBondContact O-N 3.17Å; E258-M261 PolarHBondContact O-N 3.48Å; E258-T262 WeakPolarHBondContact O-CB 3.4Å; E258-T262 WeakPolarHBondContact O-CG2 3.39Å; E258-T262 PolarHBondContact O-N 3.49Å; E258-T262 PolarHBondContact O-OG1 3.19Å
259	L	78.7	Confident	69.6	Low	114 Å²	114	106.1 Å²	106.1	60%	0.597	56%	0.559	S	S	*	*	H	α-helix	trans	-66.5	-35.5	173.1	-80	163.3	0	0	0	113.4	A255 D256 F257 T262 S263	A255-L259 WeakPolarHBondContact O-CB 3.24Å; A255-L259 WeakPolarHBondContact O-CG 3.48Å; A255-L259 PolarHBondContact O-N 2.88Å; D256-L259 PolarHBondContact O-N 2.98Å; F257-L259 VanDerWaalsContact C-N 3.34Å; F257-L259 PolarHBondContact O-N 3.2Å; L259-T262 WeakPolarHBondContact CA-OG1 3.24Å; L259-T262 PolarHBondContact O-OG1 2.95Å; L259-S263 PolarHBondContact O-N 3.45Å
260	I	83.3	Confident	72.3	Confident	93 Å²	93	106.3 Å²	106.3	48%	0.477	55%	0.552	S	S	.	*	H	α-helix	trans	-70.1	-47.7	173.8	-71	162.8	0	0	0	110.3	D256 F257 T262 S263 F266	D256-I260 WeakPolarHBondContact O-CB 2.99Å; D256-I260 WeakPolarHBondContact O-CD1 3.27Å; D256-I260 VanDerWaalsContact O-CG1 3.24Å; D256-I260 WeakPolarHBondContact O-CG1 3.27Å; D256-I260 PolarHBondContact O-N 3.32Å; F257-I260 PolarHBondContact O-N 3.37Å; I260-T262 VanDerWaalsContact C-N 3.28Å; I260-T262 PolarHBondContact O-N 2.94Å; I260-S263 WeakPolarHBondContact O-CB 3.37Å; I260-S263 PolarHBondContact O-N 3.18Å; I260-F266 HydrophobicContact CG2-CD2 4.48Å; I260-F266 WeakPolarHBondContact O-CB 3.35Å
261	M	78.9	Confident	74.7	Confident	109 Å²	109	104.6 Å²	104.6	54%	0.537	53%	0.534	S	S	.	.	H	α-helix	trans	-64.1	-32.4	179.4	-68.7	-68.3	-69.7	0	0	112.3	F257 E258 S263 F266 H267	F257-M261 WeakPolarHBondContact O-CB 3.4Å; F257-M261 WeakPolarHBondContact O-CG 3.35Å; F257-M261 PolarHBondContact O-N 3.09Å; E258-M261 PolarHBondContact O-N 3.48Å; M261-S263 VanDerWaalsContact C-N 3.35Å; M261-F266 HydrophobicContact CE-CE1 3.89Å; M261-F266 HydrophobicContact CE-CZ 4.19Å; M261-F266 HydrophobicContact SD-CD1 4.22Å; M261-F266 HydrophobicContact SD-CE1 3.48Å; M261-F266 WeakPolarHBondContact SD-CE1 3.42Å; M261-F266 HydrophobicContact SD-CE2 4.27Å; M261-F266 HydrophobicContact SD-CZ 3.51Å; M261-F266 VanDerWaalsContact SD-CZ 3.51Å; M261-H267 PolarHBondContact O-CE1 3.13Å; M261-H267 PolarHBondContact O-ND1 3.18Å
262	T	83.4	Confident	76.8	Confident	95 Å²	95	101.9 Å²	101.9	58%	0.583	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-7.6	173.6	51.4	0	0	0	0	114.2	E258 L259 I260	E258-T262 WeakPolarHBondContact O-CB 3.4Å; E258-T262 WeakPolarHBondContact O-CG2 3.39Å; E258-T262 PolarHBondContact O-N 3.49Å; E258-T262 PolarHBondContact O-OG1 3.19Å; L259-T262 WeakPolarHBondContact CA-OG1 3.24Å; L259-T262 PolarHBondContact O-OG1 2.95Å; I260-T262 VanDerWaalsContact C-N 3.28Å; I260-T262 PolarHBondContact O-N 2.94Å
263	S	88.2	Confident	78.6	Confident	44 Å²	44	102.3 Å²	102.3	31%	0.308	52%	0.52	S	S	.	.			trans	-69.6	137.3	-176.7	-169.2	0	0	0	0	113.1	L259 I260 M261 K265 F266 H267	L259-S263 PolarHBondContact O-N 3.45Å; I260-S263 WeakPolarHBondContact O-CB 3.37Å; I260-S263 PolarHBondContact O-N 3.18Å; M261-S263 VanDerWaalsContact C-N 3.35Å; S263-K265 PolarHBondContact O-N 3.26Å; S263-F266 PolarHBondContact O-N 3.42Å; S263-H267 PolarHBondContact O-N 3.24Å; S263-H267 PolarHBondContact O-ND1 3.02Å; S263-H267 VanDerWaalsContact O-ND1 3.07Å
264	D	84.2	Confident	80.3	Confident	141 Å²	141	101.5 Å²	101.5	75%	0.754	51%	0.511	S	S	*	.	H	α-helix	trans	-54.7	-36.2	173.6	-52.8	-47.6	0	0	0	112.4	F266 H267 Y268	D264-F266 VanDerWaalsContact C-N 3.35Å; D264-H267 PolarHBondContact O-N 3.09Å; D264-Y268 VanDerWaalsContact O-CB 3.27Å; D264-Y268 WeakPolarHBondContact O-CB 3.34Å; D264-Y268 PolarHBondContact O-N 3.14Å
265	K	87.4	Confident	82.1	Confident	170 Å²	170	97.6 Å²	97.6	74%	0.739	49%	0.49	S	S	*	.	H	α-helix	trans	-67.1	-36.5	179.2	-69.7	179.7	179.7	176.9	0	112.1	S263 S269	S263-K265 PolarHBondContact O-N 3.26Å; K265-S269 WeakPolarHBondContact O-CB 3.34Å; K265-S269 PolarHBondContact O-N 2.98Å; K265-S269 VanDerWaalsContact O-N 3.13Å; K265-S269 PolarHBondContact O-OG 2.92Å
266	F	89.1	Confident	83.5	Confident	71 Å²	71	99.7 Å²	99.7	31%	0.311	50%	0.499	S	S	.	.	H	α-helix	trans	-71.2	-48.4	176.7	-179.5	-99.6	0	0	0	110.3	I260 M261 S263 D264 Y268 S269 L270	I260-F266 HydrophobicContact CG2-CD2 4.48Å; I260-F266 WeakPolarHBondContact O-CB 3.35Å; M261-F266 HydrophobicContact CE-CE1 3.89Å; M261-F266 HydrophobicContact CE-CZ 4.19Å; M261-F266 HydrophobicContact SD-CD1 4.22Å; M261-F266 HydrophobicContact SD-CE1 3.48Å; M261-F266 WeakPolarHBondContact SD-CE1 3.42Å; M261-F266 HydrophobicContact SD-CE2 4.27Å; M261-F266 HydrophobicContact SD-CZ 3.51Å; M261-F266 VanDerWaalsContact SD-CZ 3.51Å; S263-F266 PolarHBondContact O-N 3.42Å; D264-F266 VanDerWaalsContact C-N 3.35Å; F266-Y268 PolarHBondContact O-N 2.92Å; F266-S269 PolarHBondContact O-N 3.48Å; F266-S269 VanDerWaalsContact O-N 3.12Å; F266-L270 HydrophobicContact CE1-CD2 4.4Å; F266-L270 WeakPolarHBondContact O-CB 3.17Å; F266-L270 PolarHBondContact O-N 3.13Å
267	H	84.9	Confident	84.5	Confident	101 Å²	101	99.2 Å²	99.2	47%	0.468	50%	0.499	S	S	.	.	H	α-helix	trans	-55.5	-46.4	174.3	-77.4	92.1	0	0	0	112.8	M261 S263 D264 S269 L270 L271	M261-H267 PolarHBondContact O-CE1 3.13Å; M261-H267 PolarHBondContact O-ND1 3.18Å; S263-H267 PolarHBondContact O-N 3.24Å; S263-H267 PolarHBondContact O-ND1 3.02Å; S263-H267 VanDerWaalsContact O-ND1 3.07Å; D264-H267 PolarHBondContact O-N 3.09Å; H267-S269 VanDerWaalsContact C-N 3.33Å; H267-S269 PolarHBondContact O-N 3.23Å; H267-L270 PolarHBondContact O-N 2.87Å; H267-L271 WeakPolarHBondContact O-CB 3.11Å; H267-L271 PolarHBondContact O-N 3.16Å
268	Y	86.3	Confident	85.2	Confident	157 Å²	157	93.5 Å²	93.5	62%	0.616	47%	0.474	S	S	*	.	H	α-helix	trans	-60.2	-42.4	175.9	-179.2	-92	0	0	0	112.3	D264 F266 L271 L272	D264-Y268 VanDerWaalsContact O-CB 3.27Å; D264-Y268 WeakPolarHBondContact O-CB 3.34Å; D264-Y268 PolarHBondContact O-N 3.14Å; F266-Y268 PolarHBondContact O-N 2.92Å; Y268-L271 PolarHBondContact O-N 2.97Å; Y268-L272 HydrophobicContact CE1-CD1 4.35Å; Y268-L272 WeakPolarHBondContact O-CB 3.35Å; Y268-L272 PolarHBondContact O-N 3.42Å
269	S	89.8	Confident	85.5	Confident	70 Å²	70	94.4 Å²	94.4	49%	0.49	47%	0.473	S	S	.	.	H	α-helix	trans	-67.1	-38.8	178.5	-56.9	0	0	0	0	112	K265 F266 H267 L272 M273	K265-S269 WeakPolarHBondContact O-CB 3.34Å; K265-S269 PolarHBondContact O-N 2.98Å; K265-S269 VanDerWaalsContact O-N 3.13Å; K265-S269 PolarHBondContact O-OG 2.92Å; F266-S269 PolarHBondContact O-N 3.48Å; F266-S269 VanDerWaalsContact O-N 3.12Å; H267-S269 VanDerWaalsContact C-N 3.33Å; H267-S269 PolarHBondContact O-N 3.23Å; S269-L272 PolarHBondContact O-N 3.44Å; S269-M273 PolarHBondContact O-N 3.49Å
270	L	88.4	Confident	85.8	Confident	96 Å²	96	94.8 Å²	94.8	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-65.8	-45.2	175.8	-177.2	63.1	0	0	0	111.7	F266 H267 L272 M273 E274	F266-L270 HydrophobicContact CE1-CD2 4.4Å; F266-L270 WeakPolarHBondContact O-CB 3.17Å; F266-L270 PolarHBondContact O-N 3.13Å; H267-L270 PolarHBondContact O-N 2.87Å; L270-L272 VanDerWaalsContact C-N 3.3Å; L270-L272 PolarHBondContact O-N 3Å; L270-M273 WeakPolarHBondContact O-CB 3.4Å; L270-M273 PolarHBondContact O-N 2.92Å; L270-M273 VanDerWaalsContact O-N 3.16Å; L270-E274 PolarHBondContact O-N 2.87Å
271	L	83.9	Confident	85.9	Confident	69 Å²	69	95.2 Å²	95.2	36%	0.361	48%	0.479	S	S	.	.	H	α-helix	trans	-64.6	-33.3	176.5	-179.2	148.3	0	0	0	112.2	H267 Y268 R275	H267-L271 WeakPolarHBondContact O-CB 3.11Å; H267-L271 PolarHBondContact O-N 3.16Å; Y268-L271 PolarHBondContact O-N 2.97Å; L271-R275 VanDerWaalsContact CD2-NH1 3.33Å; L271-R275 WeakPolarHBondContact O-CB 3.35Å; L271-R275 WeakPolarHBondContact O-CG 3.47Å; L271-R275 PolarHBondContact O-N 3.44Å; L271-R275 VanDerWaalsContact O-N 3.13Å
272	L	86.4	Confident	86	Confident	90 Å²	90	91.7 Å²	91.7	47%	0.471	46%	0.46	S	S	.	.	H	α-helix	trans	-72.5	-34.9	172.9	-167.3	125.5	0	0	0	112.3	Y268 S269 L270 T276	Y268-L272 HydrophobicContact CE1-CD1 4.35Å; Y268-L272 WeakPolarHBondContact O-CB 3.35Å; Y268-L272 PolarHBondContact O-N 3.42Å; S269-L272 PolarHBondContact O-N 3.44Å; L270-L272 VanDerWaalsContact C-N 3.3Å; L270-L272 PolarHBondContact O-N 3Å; L272-T276 WeakPolarHBondContact O-CB 3.25Å; L272-T276 PolarHBondContact O-N 3.05Å; L272-T276 VanDerWaalsContact O-N 3.14Å; L272-T276 PolarHBondContact O-OG1 2.76Å
273	M	89.5	Confident	85.9	Confident	119 Å²	119	91.6 Å²	91.6	59%	0.586	45%	0.453	S	S	*	.	H	α-helix	trans	-64.5	-48.1	171.8	-173.7	65.8	72.5	0	0	111.2	S269 L270 R275 T276 V277	S269-M273 PolarHBondContact O-N 3.49Å; L270-M273 WeakPolarHBondContact O-CB 3.4Å; L270-M273 PolarHBondContact O-N 2.92Å; L270-M273 VanDerWaalsContact O-N 3.16Å; M273-R275 PolarHBondContact O-N 3.31Å; M273-T276 WeakPolarHBondContact O-CA 3.45Å; M273-T276 WeakPolarHBondContact O-CB 3.24Å; M273-T276 PolarHBondContact O-N 2.95Å; M273-V277 PolarHBondContact O-N 3.05Å
274	E	87.1	Confident	85.5	Confident	68 Å²	68	92.6 Å²	92.6	32%	0.318	46%	0.46	S	S	.	.	H	α-helix	trans	-55.7	-52.2	177.3	-170	-159.9	158.3	0	0	111.4	L270 T276 V277 L278 N405	L270-E274 PolarHBondContact O-N 2.87Å; E274-T276 PolarHBondContact O-N 2.89Å; E274-V277 PolarHBondContact O-N 3.38Å; E274-V277 VanDerWaalsContact O-N 3.12Å; E274-L278 HydrophobicContact CG-CD1 3.91Å; E274-L278 HydrophobicContact CG-CG 4.43Å; E274-L278 WeakPolarHBondContact O-CG 3.1Å; E274-L278 PolarHBondContact O-N 3.23Å; E274-N405 PolarHBondContact OE1-ND2 2.71Å
275	R	86.1	Confident	85.3	Confident	59 Å²	59	88 Å²	88	22%	0.223	43%	0.434	C	S	.	.	H	α-helix	trans	-55.3	-33.4	174.2	-78.1	171.2	156.6	171.5	-10.6	113.2	L271 M273 R279 E410	L271-R275 VanDerWaalsContact CD2-NH1 3.33Å; L271-R275 WeakPolarHBondContact O-CB 3.35Å; L271-R275 WeakPolarHBondContact O-CG 3.47Å; L271-R275 PolarHBondContact O-N 3.44Å; L271-R275 VanDerWaalsContact O-N 3.13Å; M273-R275 PolarHBondContact O-N 3.31Å; R275-R279 WeakPolarHBondContact O-CB 3.2Å; R275-R279 PolarHBondContact O-N 3.12Å; R275-E410 IonicContact CZ-OE1 3.42Å; R275-E410 IonicContact CZ-OE2 2.67Å; R275-E410 IonicContact NH1-OE1 3.59Å; R275-E410 IonicContact NH2-OE1 3.97Å; R275-E410 PolarHBondContact NH2-OE1 3.13Å; R275-E410 IonicContact NH2-OE2 3.94Å; R275-E410 PolarHBondContact NH2-OE2 3.39Å
276	T	87.1	Confident	84.9	Confident	82 Å²	82	80.5 Å²	80.5	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-73.3	-42.3	178.2	-57.3	0	0	0	0	111.6	L272 M273 E274 N280	L272-T276 WeakPolarHBondContact O-CB 3.25Å; L272-T276 PolarHBondContact O-N 3.05Å; L272-T276 VanDerWaalsContact O-N 3.14Å; L272-T276 PolarHBondContact O-OG1 2.76Å; M273-T276 WeakPolarHBondContact O-CA 3.45Å; M273-T276 WeakPolarHBondContact O-CB 3.24Å; M273-T276 PolarHBondContact O-N 2.95Å; E274-T276 PolarHBondContact O-N 2.89Å; T276-N280 PolarHBondContact O-N 3.48Å
277	V	87.6	Confident	84.5	Confident	75 Å²	75	77.6 Å²	77.6	46%	0.455	39%	0.391	S	S	.	.	H	α-helix	trans	-63.4	-47.8	174.2	173.7	0	0	0	0	110.8	M273 E274 R279 N280 N281	M273-V277 PolarHBondContact O-N 3.05Å; E274-V277 PolarHBondContact O-N 3.38Å; E274-V277 VanDerWaalsContact O-N 3.12Å; V277-R279 PolarHBondContact O-N 3.05Å; V277-N280 WeakPolarHBondContact O-CB 3.4Å; V277-N280 PolarHBondContact O-N 2.86Å; V277-N280 VanDerWaalsContact O-N 3.12Å; V277-N281 PolarHBondContact O-N 2.91Å; V277-N281 PolarHBondContact O-OD1 2.7Å
278	L	84.3	Confident	84.2	Confident	17 Å²	17	73.4 Å²	73.4	9%	0.089	37%	0.374	C	S	.	.	H	α-helix	trans	-64.6	-41.5	179.8	-67.1	171.7	0	0	0	112.2	E274 N280 N281 F282 N405 T407	E274-L278 HydrophobicContact CG-CD1 3.91Å; E274-L278 HydrophobicContact CG-CG 4.43Å; E274-L278 WeakPolarHBondContact O-CG 3.1Å; E274-L278 PolarHBondContact O-N 3.23Å; L278-N280 PolarHBondContact O-N 3.27Å; L278-N281 PolarHBondContact O-N 3.01Å; L278-N281 VanDerWaalsContact O-N 3.15Å; L278-F282 HydrophobicContact CD2-CE2 4.21Å; L278-F282 WeakPolarHBondContact O-CD2 3.36Å; L278-F282 PolarHBondContact O-N 2.89Å; L278-N405 HydrophobicContact CD1-CB 4.09Å; L278-N405 WeakPolarHBondContact CD1-OD1 3.17Å; L278-T407 VanDerWaalsContact CD1-OG1 3.24Å; L278-T407 WeakPolarHBondContact CD1-OG1 3.46Å; L278-T407 HydrophobicContact CD2-CG2 4.08Å; L278-T407 VanDerWaalsContact CD2-OG1 3.25Å; L278-T407 WeakPolarHBondContact CD2-OG1 3.26Å
279	R	81.1	Confident	83.8	Confident	143 Å²	143	66.6 Å²	66.6	54%	0.54	35%	0.347	S	S	.	.	H	α-helix	trans	-57.6	-35.9	173.1	177.7	178.1	172.5	-174.5	-2.9	112.3	R275 V277 Q283 L286	R275-R279 WeakPolarHBondContact O-CB 3.2Å; R275-R279 PolarHBondContact O-N 3.12Å; V277-R279 PolarHBondContact O-N 3.05Å; R279-Q283 VanDerWaalsContact O-CA 3.31Å; R279-Q283 WeakPolarHBondContact O-CA 3.38Å; R279-Q283 WeakPolarHBondContact O-CB 3.41Å; R279-Q283 PolarHBondContact O-N 3.08Å; R279-Q283 VanDerWaalsContact O-N 3.16Å; R279-L286 HydrophobicContact CB-CD1 4.38Å; R279-L286 HydrophobicContact CG-CD1 4.15Å
280	N	85.2	Confident	83.2	Confident	122 Å²	122	68.5 Å²	68.5	65%	0.652	34%	0.344	S	S	*	.	H	α-helix	trans	-71.5	-42.4	176	-167.7	57.4	0	0	0	111.8	T276 V277 L278 F282 Q283	T276-N280 PolarHBondContact O-N 3.48Å; V277-N280 WeakPolarHBondContact O-CB 3.4Å; V277-N280 PolarHBondContact O-N 2.86Å; V277-N280 VanDerWaalsContact O-N 3.12Å; L278-N280 PolarHBondContact O-N 3.27Å; N280-F282 PolarHBondContact O-N 3.33Å; N280-Q283 VanDerWaalsContact O-CB 3.32Å; N280-Q283 WeakPolarHBondContact O-CB 3.4Å; N280-Q283 PolarHBondContact O-N 3.33Å
281	N	84.4	Confident	82.6	Confident	102 Å²	102	69.9 Å²	69.9	55%	0.545	35%	0.346	S	S	.	.	H	α-helix	trans	-63.9	-39.2	177.7	-66.5	-9.1	0	0	0	112.8	V277 L278	V277-N281 PolarHBondContact O-N 2.91Å; V277-N281 PolarHBondContact O-OD1 2.7Å; L278-N281 PolarHBondContact O-N 3.01Å; L278-N281 VanDerWaalsContact O-N 3.15Å
282	F	81.6	Confident	82.3	Confident	34 Å²	34	71.1 Å²	71.1	15%	0.149	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	21.5	-179.3	-64.2	-77.2	0	0	0	113.4	L278 N280 S284 Q285 L286 L333 P406 T407	L278-F282 HydrophobicContact CD2-CE2 4.21Å; L278-F282 WeakPolarHBondContact O-CD2 3.36Å; L278-F282 PolarHBondContact O-N 2.89Å; N280-F282 PolarHBondContact O-N 3.33Å; F282-S284 VanDerWaalsContact C-N 3.26Å; F282-S284 PolarHBondContact O-N 3.15Å; F282-Q285 VanDerWaalsContact C-OE1 3.24Å; F282-Q285 PolarHBondContact O-N 3.45Å; F282-Q285 PolarHBondContact O-OE1 3.38Å; F282-L286 HydrophobicContact CB-CD1 4.11Å; F282-L286 HydrophobicContact CB-CG 4.21Å; F282-L286 WeakPolarHBondContact O-CB 3.47Å; F282-L286 VanDerWaalsContact O-CG 3.24Å; F282-L286 WeakPolarHBondContact O-CG 3.42Å; F282-L286 PolarHBondContact O-N 3.12Å; F282-L333 HydrophobicContact CE1-CD2 4.13Å; F282-L333 HydrophobicContact CZ-CD2 3.96Å; F282-P406 HydrophobicContact CD1-CG 4.44Å; F282-P406 HydrophobicContact CD2-CG 3.47Å; F282-P406 VanDerWaalsContact CD2-CG 3.47Å; F282-P406 HydrophobicContact CE1-CG 4.46Å; F282-P406 HydrophobicContact CE2-CG 3.51Å; F282-P406 HydrophobicContact CG-CG 3.98Å; F282-P406 HydrophobicContact CZ-CG 4.02Å; F282-T407 HydrophobicContact CE2-CG2 4.05Å; F282-T407 HydrophobicContact CZ-CG2 4.21Å
283	Q	82.2	Confident	81.3	Confident	93 Å²	93	72.2 Å²	72.2	44%	0.435	37%	0.365	S	S	.	.	H	α-helix	trans	-60.7	-30.5	-171.2	173.7	57.7	30	0	0	113.5	R279 N280 A287	R279-Q283 VanDerWaalsContact O-CA 3.31Å; R279-Q283 WeakPolarHBondContact O-CA 3.38Å; R279-Q283 WeakPolarHBondContact O-CB 3.41Å; R279-Q283 PolarHBondContact O-N 3.08Å; R279-Q283 VanDerWaalsContact O-N 3.16Å; N280-Q283 VanDerWaalsContact O-CB 3.32Å; N280-Q283 WeakPolarHBondContact O-CB 3.4Å; N280-Q283 PolarHBondContact O-N 3.33Å; Q283-A287 VanDerWaalsContact O-CB 3.27Å; Q283-A287 WeakPolarHBondContact O-CB 3.27Å; Q283-A287 PolarHBondContact O-N 3.25Å; Q283-A287 VanDerWaalsContact O-N 3.13Å
284	S	78.1	Confident	80.2	Confident	66 Å²	66	71.4 Å²	71.4	46%	0.462	36%	0.362	S	S	.	.	H	α-helix	trans	-75.8	-46.8	176	49.5	0	0	0	0	112.1	F282 L286 A287 A288 L294	F282-S284 VanDerWaalsContact C-N 3.26Å; F282-S284 PolarHBondContact O-N 3.15Å; S284-L286 VanDerWaalsContact C-N 3.32Å; S284-L286 PolarHBondContact O-N 3.16Å; S284-A287 PolarHBondContact O-N 3.09Å; S284-A288 PolarHBondContact O-N 3.11Å; S284-L294 VanDerWaalsContact O-CD2 3.27Å; S284-L294 WeakPolarHBondContact O-CD2 3.33Å
285	Q	80.7	Confident	78.7	Confident	44 Å²	44	76.3 Å²	76.3	21%	0.206	39%	0.39	C	S	.	.	H	α-helix	trans	-60.8	-42.5	176.6	-60.7	81	-1.4	0	0	111.1	F282 A287 A288 Y289 L349 I350	F282-Q285 VanDerWaalsContact C-OE1 3.24Å; F282-Q285 PolarHBondContact O-N 3.45Å; F282-Q285 PolarHBondContact O-OE1 3.38Å; Q285-A287 VanDerWaalsContact C-N 3.34Å; Q285-A287 PolarHBondContact O-N 3.4Å; Q285-A288 PolarHBondContact O-N 2.92Å; Q285-Y289 WeakPolarHBondContact O-CB 3.47Å; Q285-Y289 PolarHBondContact O-N 3.21Å; Q285-L349 WeakPolarHBondContact CG-O 3.47Å; Q285-I350 HydrophobicContact CB-CG1 4.04Å
286	L	80.1	Confident	76.9	Confident	13 Å²	13	82.5 Å²	82.5	7%	0.068	42%	0.421	C	S	.	.	H	α-helix	trans	-70.4	-27.3	177.7	-66.7	173.1	0	0	0	113.3	R279 F282 S284 R290 I350 I403	R279-L286 HydrophobicContact CB-CD1 4.38Å; R279-L286 HydrophobicContact CG-CD1 4.15Å; F282-L286 HydrophobicContact CB-CD1 4.11Å; F282-L286 HydrophobicContact CB-CG 4.21Å; F282-L286 WeakPolarHBondContact O-CB 3.47Å; F282-L286 VanDerWaalsContact O-CG 3.24Å; F282-L286 WeakPolarHBondContact O-CG 3.42Å; F282-L286 PolarHBondContact O-N 3.12Å; S284-L286 VanDerWaalsContact C-N 3.32Å; S284-L286 PolarHBondContact O-N 3.16Å; L286-R290 WeakPolarHBondContact O-CG 3.24Å; L286-R290 PolarHBondContact O-N 2.85Å; L286-I350 HydrophobicContact CD2-CD1 4.22Å; L286-I403 HydrophobicContact CD2-CG2 3.63Å; L286-I403 WeakPolarHBondContact CD2-O 3.38Å
287	A	80.5	Confident	74.5	Confident	9 Å²	9	81.3 Å²	81.3	7%	0.074	43%	0.426	C	S	.	.	H	α-helix	trans	-71.5	-48.2	170.2	0	0	0	0	0	111.1	Q283 S284 Q285 Y289 R290 K291 L292 L294	Q283-A287 VanDerWaalsContact O-CB 3.27Å; Q283-A287 WeakPolarHBondContact O-CB 3.27Å; Q283-A287 PolarHBondContact O-N 3.25Å; Q283-A287 VanDerWaalsContact O-N 3.13Å; S284-A287 PolarHBondContact O-N 3.09Å; Q285-A287 VanDerWaalsContact C-N 3.34Å; Q285-A287 PolarHBondContact O-N 3.4Å; A287-Y289 PolarHBondContact O-N 3.09Å; A287-R290 CarbonylContact O-C 3.45Å; A287-R290 PolarHBondContact O-N 3.48Å; A287-R290 VanDerWaalsContact O-N 3.09Å; A287-K291 PolarHBondContact O-N 2.82Å; A287-L292 HydrophobicContact CB-CB 4.12Å; A287-L292 PolarHBondContact O-N 2.84Å; A287-L294 HydrophobicContact CB-CD2 3.94Å
288	A	77.3	Confident	71.8	Confident	13 Å²	13	87.3 Å²	87.3	11%	0.107	45%	0.446	C	S	.	.	H	α-helix	trans	-59.5	-45.8	177.5	0	0	0	0	0	112.6	S284 Q285 R290 K291 L294 L349 Q702	S284-A288 PolarHBondContact O-N 3.11Å; Q285-A288 PolarHBondContact O-N 2.92Å; A288-R290 PolarHBondContact O-N 2.92Å; A288-K291 PolarHBondContact O-N 3.47Å; A288-L294 HydrophobicContact CB-CD2 4.25Å; A288-L349 HydrophobicContact CB-CD2 3.66Å; A288-Q702 PolarHBondContact O-NE2 2.78Å; A288-Q702 VanDerWaalsContact O-NE2 3.11Å
289	Y	78.3	Confident	69.3	Low	14 Å²	14	93.4 Å²	93.4	6%	0.055	48%	0.478	C	S	.	.	H	α-helix	trans	-54.1	-37.1	173.8	178.4	-104.9	0	0	0	112.6	Q285 A287 K291 L349 I403 T686 C688 V700	Q285-Y289 WeakPolarHBondContact O-CB 3.47Å; Q285-Y289 PolarHBondContact O-N 3.21Å; A287-Y289 PolarHBondContact O-N 3.09Å; Y289-K291 VanDerWaalsContact C-N 3.32Å; Y289-L349 HydrophobicContact CD2-CD1 4.28Å; Y289-I403 HydrophobicContact CD1-CD1 4.5Å; Y289-I403 HydrophobicContact CD1-CG2 4.17Å; Y289-I403 HydrophobicContact CE1-CD1 3.61Å; Y289-I403 HydrophobicContact CE1-CG2 4.17Å; Y289-I403 HydrophobicContact CE2-CD1 4.05Å; Y289-I403 WeakPolarHBondContact OH-CD1 3.38Å; Y289-T686 HydrophobicContact CD1-CG2 4.22Å; Y289-T686 HydrophobicContact CD2-CG2 4.46Å; Y289-T686 HydrophobicContact CE1-CG2 3.75Å; Y289-T686 HydrophobicContact CE2-CG2 4.01Å; Y289-T686 WeakPolarHBondContact CE2-OG1 3.46Å; Y289-T686 VanDerWaalsContact CZ-OG1 3.28Å; Y289-T686 VanDerWaalsContact O-CG2 3.24Å; Y289-T686 WeakPolarHBondContact O-CG2 3.44Å; Y289-T686 PolarHBondContact OH-OG1 3.38Å; Y289-C688 HydrophobicContact CD2-CB 4.28Å; Y289-C688 VanDerWaalsContact CD2-SG 3.6Å; Y289-C688 HydrophobicContact CE2-CB 4.02Å; Y289-V700 HydrophobicContact CD2-CG1 4.45Å
290	R	78.3	Confident	66.9	Low	111 Å²	111	92.1 Å²	92.1	42%	0.419	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	8	178.5	-68.4	178.1	172.9	169.7	-1.1	114	L286 A287 A288 L292 D379	L286-R290 WeakPolarHBondContact O-CG 3.24Å; L286-R290 PolarHBondContact O-N 2.85Å; A287-R290 CarbonylContact O-C 3.45Å; A287-R290 PolarHBondContact O-N 3.48Å; A287-R290 VanDerWaalsContact O-N 3.09Å; A288-R290 PolarHBondContact O-N 2.92Å; R290-L292 HydrophobicContact CB-CD1 4.05Å; R290-L292 HydrophobicContact CB-CG 3.93Å; R290-L292 PolarHBondContact O-N 2.9Å; R290-L292 VanDerWaalsContact O-N 3.17Å; R290-D379 IonicContact NH2-OD1 3.77Å
291	K	75	Confident	64.3	Low	124 Å²	124	95 Å²	95	54%	0.539	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	28.3	-172.1	-57.3	-173	176.1	-170.9	0	113.8	A287 A288 Y289 D687	A287-K291 PolarHBondContact O-N 2.82Å; A288-K291 PolarHBondContact O-N 3.47Å; Y289-K291 VanDerWaalsContact C-N 3.32Å; K291-D687 WeakPolarHBondContact CE-OD1 3.46Å; K291-D687 WeakPolarHBondContact CE-OD2 3.45Å; K291-D687 IonicContact NZ-OD1 3.71Å; K291-D687 PolarHBondContact NZ-OD1 2.8Å; K291-D687 IonicContact NZ-OD2 3.14Å; K291-D687 PolarHBondContact NZ-OD2 3.12Å
292	L	77.7	Confident	61.6	Low	95 Å²	95	97 Å²	97	50%	0.497	50%	0.501	S	S	.	.			trans	-80.8	144	174.7	-63.9	174.8	0	0	0	109.8	A287 R290 L294	A287-L292 HydrophobicContact CB-CB 4.12Å; A287-L292 PolarHBondContact O-N 2.84Å; R290-L292 HydrophobicContact CB-CD1 4.05Å; R290-L292 HydrophobicContact CB-CG 3.93Å; R290-L292 PolarHBondContact O-N 2.9Å; R290-L292 VanDerWaalsContact O-N 3.17Å; L292-L294 PolarHBondContact O-N 2.91Å
293	P	65.1	Low	59.1	Low	113 Å²	113	99.4 Å²	99.4	73%	0.734	52%	0.521	S	S	*	.			trans	-61	125.3	179.2	25.1	-33.9	0	0	0	110.5	L295	P293-L295 PolarHBondContact O-N 3.41Å; P293-L295 VanDerWaalsContact O-N 3.17Å
294	L	66.7	Low	56.7	Low	103 Å²	103	99 Å²	99	54%	0.539	52%	0.524	S	S	.	.			trans	-67.7	113.2	175.8	-67.2	178.9	0	0	0	109.5	S284 A287 A288 L292 Q296	S284-L294 VanDerWaalsContact O-CD2 3.27Å; S284-L294 WeakPolarHBondContact O-CD2 3.33Å; A287-L294 HydrophobicContact CB-CD2 3.94Å; A288-L294 HydrophobicContact CB-CD2 4.25Å; L292-L294 PolarHBondContact O-N 2.91Å; L294-Q296 VanDerWaalsContact C-N 3.34Å; L294-Q296 PolarHBondContact O-N 3.37Å
295	L	56.3	Low	54.4	Low	171 Å²	171	102.5 Å²	102.5	90%	0.895	54%	0.537	S	S	*	.			trans	-68	95.5	166.9	-66.6	175.7	0	0	0	108.2	P293 G297	P293-L295 PolarHBondContact O-N 3.41Å; P293-L295 VanDerWaalsContact O-N 3.17Å; L295-G297 PolarHBondContact O-N 3.29Å
296	Q	46.5	Very low	52	Low	188 Å²	188	105.2 Å²	105.2	88%	0.879	56%	0.557	S	S	*	*			trans	-58.9	104.4	162.7	-78.9	-175.8	-20.3	0	0	107.9	L294 K298	L294-Q296 VanDerWaalsContact C-N 3.34Å; L294-Q296 PolarHBondContact O-N 3.37Å; Q296-K298 PolarHBondContact O-N 3.07Å
297	G	37.8	Very low	49.6	Very low	58 Å²	58	109.4 Å²	109.4	60%	0.598	58%	0.578	S	S	*	*			trans	-58.5	135.6	165.8	0	0	0	0	0	108.5	L295 D299	L295-G297 PolarHBondContact O-N 3.29Å; G297-D299 PolarHBondContact O-N 2.99Å; G297-D299 VanDerWaalsContact O-N 3.13Å
298	K	31.8	Very low	47.3	Very low	201 Å²	201	114.1 Å²	114.1	87%	0.874	60%	0.602	S	S	*	*			trans	-65.7	113.8	165.8	-73	-179.5	175.8	179.5	0	106.9	Q296 T300	Q296-K298 PolarHBondContact O-N 3.07Å; K298-T300 VanDerWaalsContact C-N 3.3Å; K298-T300 PolarHBondContact O-N 2.85Å
299	D	31.6	Very low	45	Very low	144 Å²	144	116.8 Å²	116.8	77%	0.77	62%	0.62	S	S	*	*			trans	-63	88.6	-179.9	-74.8	-50.9	0	0	0	111.3	G297 H301	G297-D299 PolarHBondContact O-N 2.99Å; G297-D299 VanDerWaalsContact O-N 3.13Å; D299-H301 PolarHBondContact O-N 3.32Å
300	T	29.7	Very low	42.6	Very low	117 Å²	117	124.8 Å²	124.8	72%	0.718	65%	0.65	S	S	*	*			trans	-69.9	97.2	161.9	45.3	0	0	0	0	107.3	K298 H302	K298-T300 VanDerWaalsContact C-N 3.3Å; K298-T300 PolarHBondContact O-N 2.85Å; T300-H302 PolarHBondContact O-N 3.48Å
301	H	31.3	Very low	40.2	Very low	183 Å²	183	123 Å²	123	85%	0.847	65%	0.649	S	S	*	*			trans	-57.5	80.4	177.5	-71.6	-82.3	0	0	0	112.3	D299	D299-H301 PolarHBondContact O-N 3.32Å
302	H	26.8	Very low	38.2	Very low	142 Å²	142	122.9 Å²	122.9	66%	0.657	65%	0.653	S	S	*	*			trans	-101.1	109.3	174.4	-121	-72.4	0	0	0	108.7	T300 V304	T300-H302 PolarHBondContact O-N 3.48Å; H302-V304 PolarHBondContact O-N 2.77Å
303	P	29.5	Very low	36	Very low	86 Å²	86	124.9 Å²	124.9	56%	0.558	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	10	-168.7	28.7	-36.4	0	0	0	115	L307	P303-L307 WeakPolarHBondContact O-CD1 3.45Å; P303-L307 WeakPolarHBondContact O-CG 3.49Å
304	V	31.1	Very low	34.2	Very low	84 Å²	84	123.3 Å²	123.3	51%	0.509	65%	0.652	S	S	.	*	H	α-helix	trans	-76.7	-42.2	-174.4	-176.5	0	0	0	0	111.6	H302 L307 L308	H302-V304 PolarHBondContact O-N 2.77Å; V304-L307 PolarHBondContact O-N 3.46Å; V304-L308 PolarHBondContact O-N 2.84Å
305	L	31.5	Very low	32.3	Very low	140 Å²	140	128.5 Å²	128.5	73%	0.733	66%	0.664	S	S	*	*	H	α-helix	trans	-69.8	-38.3	-177.6	-65.8	176.3	0	0	0	112.1	L307 L308	L305-L307 PolarHBondContact O-N 2.72Å; L305-L308 PolarHBondContact O-N 2.7Å
306	T	29.5	Very low	31.4	Very low	101 Å²	101	126.3 Å²	126.3	62%	0.62	65%	0.652	S	S	*	*	H	α-helix	trans	-69.7	-18.9	176	-29	0	0	0	0	113.2	S309	T306-S309 PolarHBondContact O-OG 2.86Å
307	L	30.1	Very low	30.5	Very low	100 Å²	100	126 Å²	126	52%	0.524	65%	0.648	S	S	.	*	H	α-helix	trans	-84	-28.4	173	-78.2	170.8	0	0	0	112.5	P303 V304 L305 N311	P303-L307 WeakPolarHBondContact O-CD1 3.45Å; P303-L307 WeakPolarHBondContact O-CG 3.49Å; V304-L307 PolarHBondContact O-N 3.46Å; L305-L307 PolarHBondContact O-N 2.72Å; L307-N311 VanDerWaalsContact O-CB 3.3Å; L307-N311 WeakPolarHBondContact O-CB 3.31Å; L307-N311 PolarHBondContact O-N 2.86Å; L307-N311 PolarHBondContact O-ND2 3.2Å
308	L	31.1	Very low	29.9	Very low	109 Å²	109	126.2 Å²	126.2	57%	0.571	65%	0.65	S	S	*	*	H	α-helix	trans	-69.8	-39.5	179.8	-76.9	172.3	0	0	0	112.6	V304 L305 L312	V304-L308 PolarHBondContact O-N 2.84Å; L305-L308 PolarHBondContact O-N 2.7Å; L308-L312 PolarHBondContact O-N 3.5Å
309	S	29.8	Very low	29.8	Very low	69 Å²	69	122.5 Å²	122.5	48%	0.483	65%	0.647	S	S	.	*	H	α-helix	trans	-61.8	-52.1	173.5	50.9	0	0	0	0	112	T306 N311 L312	T306-S309 PolarHBondContact O-OG 2.86Å; S309-N311 PolarHBondContact O-N 3.41Å; S309-L312 PolarHBondContact O-N 3.07Å
310	R	27.6	Very low	29.7	Very low	181 Å²	181	125.1 Å²	125.1	68%	0.683	65%	0.651	S	S	*	*	H	α-helix	trans	-68.7	-25.6	-178.8	-97.5	-179.4	168	175.4	-2.1	115.6	S314	R310-S314 PolarHBondContact O-N 2.89Å; R310-S314 PolarHBondContact O-OG 3.14Å
311	N	27.9	Very low	29.3	Very low	74 Å²	74	130 Å²	130	40%	0.396	66%	0.663	S	S	.	*	H	α-helix	trans	-81.1	-16.6	176.7	-81.2	-75.3	0	0	0	113.7	L307 S309	L307-N311 VanDerWaalsContact O-CB 3.3Å; L307-N311 WeakPolarHBondContact O-CB 3.31Å; L307-N311 PolarHBondContact O-N 2.86Å; L307-N311 PolarHBondContact O-ND2 3.2Å; S309-N311 PolarHBondContact O-N 3.41Å
312	L	33.2	Very low	28.9	Very low	121 Å²	121	130.3 Å²	130.3	63%	0.634	66%	0.664	S	S	*	*	H	α-helix	trans	-74.6	-44.7	169.6	-81.6	162.4	0	0	0	111.3	L308 S309 S314 I316	L308-L312 PolarHBondContact O-N 3.5Å; S309-L312 PolarHBondContact O-N 3.07Å; L312-S314 VanDerWaalsContact C-N 3.34Å; L312-S314 PolarHBondContact O-N 3.45Å; L312-I316 WeakPolarHBondContact O-CD1 3.25Å; L312-I316 WeakPolarHBondContact O-CG1 3.49Å
313	E	30.8	Very low	28.9	Very low	138 Å²	138	132.9 Å²	132.9	65%	0.645	68%	0.677	S	S	*	*	H	α-helix	trans	-58.3	-43.5	178.2	-62.1	177	131.5	0	0	112.6
314	S	27.1	Very low	28.5	Very low	80 Å²	80	138 Å²	138	56%	0.559	69%	0.69	S	S	*	*	H	α-helix	trans	-81.6	-16.2	-170.8	51.3	0	0	0	0	115.5	R310 L312	R310-S314 PolarHBondContact O-N 2.89Å; R310-S314 PolarHBondContact O-OG 3.14Å; L312-S314 VanDerWaalsContact C-N 3.34Å; L312-S314 PolarHBondContact O-N 3.45Å
315	R	28.2	Very low	28.2	Very low	212 Å²	212	145.6 Å²	145.6	80%	0.8	71%	0.71	S	S	*	*	H	α-helix	trans	-94.3	-10.7	-179.7	-74.8	-172	174.8	-162.7	-0.3	114.9
316	I	36.1	Very low	27.7	Very low	125 Å²	125	148.8 Å²	148.8	64%	0.641	72%	0.718	S	S	*	*	H	α-helix	trans	-84	-28	-176.6	-67.3	171.5	0	0	0	112.1	L312 G318	L312-I316 WeakPolarHBondContact O-CD1 3.25Å; L312-I316 WeakPolarHBondContact O-CG1 3.49Å; I316-G318 PolarHBondContact O-N 2.85Å
317	F	29.1	Very low	27.5	Very low	181 Å²	181	149.7 Å²	149.7	79%	0.794	73%	0.728	S	S	*	*			trans	-102.5	72	-176.6	-77.8	-80.9	0	0	0	114.2
318	G	23.9	Very low	27.1	Very low	62 Å²	62	150 Å²	150	64%	0.639	74%	0.739	S	S	*	*			trans	-73.8	132.4	158.2	0	0	0	0	0	111	I316	I316-G318 PolarHBondContact O-N 2.85Å
319	P	30.2	Very low	26.8	Very low	123 Å²	123	149.3 Å²	149.3	80%	0.799	74%	0.743	S	S	*	*	S	Bend	trans	-74.2	132.3	-175.6	28.7	-34.1	0	0	0	112.4
320	K	28.7	Very low	26.4	Very low	200 Å²	200	151.8 Å²	151.8	87%	0.87	76%	0.755	S	S	*	*			trans	74.5	91	176.4	-49.7	171.9	-176.6	175.4	0	115.9
321	F	22.2	Very low	26.4	Very low	218 Å²	218	145.6 Å²	145.6	96%	0.956	74%	0.737	S	S	*	*			trans	-134.6	145	143.8	-111.8	-86.6	0	0	0	110.5
322	H	23.2	Very low	26.1	Very low	190 Å²	190	148.7 Å²	148.7	88%	0.88	75%	0.751	S	S	*	*			trans	-78.7	142.9	-171.8	-95.9	-87.4	0	0	0	113.1	K324	H322-K324 PolarHBondContact O-N 3.15Å; H322-K324 VanDerWaalsContact O-N 3.15Å
323	Q	27.2	Very low	25.7	Very low	196 Å²	196	146.8 Å²	146.8	92%	0.916	74%	0.741	S	S	*	*			trans	-64.4	108	-178.5	-163.3	178	37.7	0	0	111.9
324	K	20.1	Very low	25.6	Very low	193 Å²	193	144.6 Å²	144.6	84%	0.839	74%	0.737	S	S	*	*			trans	-127.6	131.6	159	-95	-172.9	173.7	-178.8	0	108.9	H322 F326	H322-K324 PolarHBondContact O-N 3.15Å; H322-K324 VanDerWaalsContact O-N 3.15Å; K324-F326 PolarHBondContact O-N 2.9Å
325	R	25.6	Very low	25.4	Very low	245 Å²	245	145.3 Å²	145.3	93%	0.925	74%	0.741	S	S	*	*			trans	-65	123.9	-178.2	-70.1	175.4	172.2	165.4	-5.4	110.8
326	F	20	Very low	25.3	Very low	206 Å²	206	142.9 Å²	142.9	90%	0.904	74%	0.737	S	S	*	*			trans	-133.3	152.1	150.8	-91.7	-80.3	0	0	0	108.7	K324	K324-F326 PolarHBondContact O-N 2.9Å
327	S	26	Very low	24.8	Very low	120 Å²	120	142.2 Å²	142.2	84%	0.839	74%	0.739	S	S	*	*			trans	-103.2	116.3	-170.9	-169.5	0	0	0	0	111.2
328	S	21.6	Very low	24.7	Very low	106 Å²	106	140.7 Å²	140.7	74%	0.741	73%	0.734	S	S	*	*			trans	-160.9	103.1	166.8	55.9	0	0	0	0	108.8
329	S	24.1	Very low	24.7	Very low	95 Å²	95	144.8 Å²	144.8	66%	0.664	74%	0.741	S	S	*	*			trans	-71.1	138.4	-176.9	-53.8	0	0	0	0	111.9
330	V	22.5	Very low	24.5	Very low	121 Å²	121	142.1 Å²	142.1	73%	0.733	72%	0.723	S	S	*	*			trans	-106.8	126.2	169.5	177.5	0	0	0	0	108
331	V	26	Very low	24.4	Very low	51 Å²	51	139 Å²	139	31%	0.309	72%	0.721	S	S	.	*			trans	-87.4	130.5	174	-178.3	0	0	0	0	108.9	V355 W408	V331-V355 HydrophobicContact CG1-CG2 4.26Å; V331-V355 HydrophobicContact CG2-CG2 4.13Å; V331-W408 HydrophobicContact CG2-CH2 4.28Å
332	M	22.7	Very low	24.8	Very low	140 Å²	140	133.6 Å²	133.6	69%	0.69	70%	0.702	S	S	*	*			trans	-112.1	112.4	177.6	-85	-76.9	-69.9	0	0	109.8
333	L	24.7	Very low	25.5	Very low	80 Å²	80	133 Å²	133	42%	0.419	70%	0.699	S	S	.	*			trans	-80.4	119.7	159.2	-95.1	78.2	0	0	0	109.1	F282 T407	F282-L333 HydrophobicContact CE1-CD2 4.13Å; F282-L333 HydrophobicContact CZ-CD2 3.96Å; L333-T407 HydrophobicContact CD1-CG2 4.4Å
334	T	27.9	Very low	26.3	Very low	92 Å²	92	127 Å²	127	56%	0.564	68%	0.683	S	S	*	*			trans	-92	108.5	160.7	47.1	0	0	0	0	109.2
335	C	24.5	Very low	27.8	Very low	95 Å²	95	121 Å²	121	64%	0.642	66%	0.66	S	S	*	*			trans	-102.8	101	179.6	-165.5	0	0	0	0	110.5
336	F	25.4	Very low	29.4	Very low	161 Å²	161	109.6 Å²	109.6	71%	0.706	62%	0.618	S	S	*	*			trans	-94.2	93.4	170.5	-76.8	-75.4	0	0	0	110.3	Q338	F336-Q338 PolarHBondContact O-N 2.69Å
337	T	25.5	Very low	31.2	Very low	111 Å²	111	101.6 Å²	101.6	68%	0.681	59%	0.587	S	S	*	*			trans	-73.3	80	160.1	53.8	0	0	0	0	108.9	N339	T337-N339 VanDerWaalsContact C-N 3.33Å; T337-N339 PolarHBondContact O-N 3.23Å
338	Q	26.1	Very low	33.1	Very low	150 Å²	150	100.5 Å²	100.5	70%	0.701	57%	0.571	S	S	*	*			trans	-69.9	96	163.2	-78.8	-167.7	-7.8	0	0	108.3	F336 T340	F336-Q338 PolarHBondContact O-N 2.69Å; Q338-T340 HydrophobicContact CB-CG2 4.46Å; Q338-T340 PolarHBondContact O-N 2.79Å
339	N	24.4	Very low	35	Very low	148 Å²	148	96.3 Å²	96.3	79%	0.791	54%	0.54	S	S	*	.			trans	-74.3	65.9	163.5	-69.5	-0	0	0	0	108.6	T337 T341	T337-N339 VanDerWaalsContact C-N 3.33Å; T337-N339 PolarHBondContact O-N 3.23Å; N339-T341 PolarHBondContact O-N 2.68Å
340	T	26.1	Very low	37	Very low	66 Å²	66	92.2 Å²	92.2	41%	0.405	51%	0.511	S	S	.	.			trans	-66.4	125.1	167.4	35	0	0	0	0	108.5	Q338 D342	Q338-T340 HydrophobicContact CB-CG2 4.46Å; Q338-T340 PolarHBondContact O-N 2.79Å; T340-D342 PolarHBondContact O-N 2.97Å; T340-D342 VanDerWaalsContact O-N 3.09Å
341	T	27.2	Very low	39	Very low	136 Å²	136	88.1 Å²	88.1	83%	0.834	49%	0.487	S	S	*	.			trans	-82.5	29.1	179.8	52.6	0	0	0	0	112.5	N339	N339-T341 PolarHBondContact O-N 2.68Å
342	D	30.2	Very low	41	Very low	103 Å²	103	85.8 Å²	85.8	55%	0.551	47%	0.473	S	S	*	.			trans	-106.4	109	-179	-65.6	-48.2	0	0	0	108.9	T340 A344 L345	T340-D342 PolarHBondContact O-N 2.97Å; T340-D342 VanDerWaalsContact O-N 3.09Å; D342-A344 PolarHBondContact O-N 3.24Å; D342-L345 PolarHBondContact O-N 3.22Å
343	E	37.8	Very low	42.7	Very low	178 Å²	178	80.2 Å²	80.2	83%	0.832	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	11.7	-169.9	-57.2	-173	131.3	0	0	115.3	N705	E343-N705 PolarHBondContact O-ND2 2.64Å
344	A	44.7	Very low	44	Very low	70 Å²	70	77.5 Å²	77.5	58%	0.579	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	-6.8	-173.7	0	0	0	0	0	114.8	D342	D342-A344 PolarHBondContact O-N 3.24Å
345	L	50.1	Low	45	Very low	68 Å²	68	76.5 Å²	76.5	36%	0.356	43%	0.429	S	S	.	.	S	Bend	trans	-93.7	142.2	-177.2	-70	175	0	0	0	112.8	D342 S347	D342-L345 PolarHBondContact O-N 3.22Å; L345-S347 PolarHBondContact O-N 3.36Å
346	P	59.3	Low	45.7	Very low	5 Å²	5	74.3 Å²	74.3	3%	0.032	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-78.8	119	-178.2	32	-31.6	0	0	0	110.5	I348 I667 Q669 Y701 Q702 L703	P346-I348 PolarHBondContact O-N 3.05Å; P346-I667 HydrophobicContact CB-CG2 4.48Å; P346-I667 HydrophobicContact CG-CG2 3.92Å; P346-Q669 HydrophobicContact CG-CB 3.86Å; P346-Q669 HydrophobicContact CG-CG 4.13Å; P346-Y701 HydrophobicContact CB-CD1 4.5Å; P346-Y701 HydrophobicContact CG-CD1 4.3Å; P346-Q702 WeakPolarHBondContact CA-O 3.47Å; P346-Q702 WeakPolarHBondContact CB-O 2.95Å; P346-L703 HydrophobicContact CB-CD2 4.49Å
347	S	58.9	Low	46.1	Very low	38 Å²	38	73.4 Å²	73.4	27%	0.266	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-68.9	123.9	-177.4	58.1	0	0	0	0	111.9	L345 L349 Q702 Q704	L345-S347 PolarHBondContact O-N 3.36Å; S347-L349 PolarHBondContact O-N 3.37Å; S347-Q702 PolarHBondContact O-N 2.97Å; S347-Q704 PolarHBondContact OG-NE2 2.76Å
348	I	65.9	Low	46.5	Very low	96 Å²	96	72.3 Å²	72.3	49%	0.492	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	125.7	169.1	-62.8	165.9	0	0	0	108.9	P346 T699 Y701	P346-I348 PolarHBondContact O-N 3.05Å; I348-T699 HydrophobicContact CG1-CG2 4.41Å; I348-T699 HydrophobicContact CG2-CG2 3.88Å; I348-Y701 HydrophobicContact CD1-CE1 4.23Å; I348-Y701 HydrophobicContact CG1-CD1 3.84Å; I348-Y701 HydrophobicContact CG1-CE1 3.48Å; I348-Y701 VanDerWaalsContact CG1-CE1 3.48Å
349	L	61.2	Low	46.9	Very low	18 Å²	18	66.6 Å²	66.6	9%	0.094	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-54.6	177.5	-66.6	-172.9	0	0	0	112.6	Q285 A288 Y289 S347 V700 Q702	Q285-L349 WeakPolarHBondContact CG-O 3.47Å; A288-L349 HydrophobicContact CB-CD2 3.66Å; Y289-L349 HydrophobicContact CD2-CD1 4.28Å; S347-L349 PolarHBondContact O-N 3.37Å; L349-V700 PolarHBondContact N-O 2.9Å; L349-Q702 HydrophobicContact CD1-CB 3.82Å; L349-Q702 HydrophobicContact CD1-CG 4.42Å; L349-Q702 HydrophobicContact CD2-CB 4.13Å; L349-Q702 HydrophobicContact CG-CB 3.84Å
350	I	66.3	Low	47.3	Very low	10 Å²	10	60.7 Å²	60.7	5%	0.051	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	142.9	-171.3	-56.3	177.8	0	0	0	107.6	Q285 L286 F352 I403 P406 V700	Q285-I350 HydrophobicContact CB-CG1 4.04Å; L286-I350 HydrophobicContact CD2-CD1 4.22Å; I350-F352 HydrophobicContact CG2-CD1 4.1Å; I350-F352 HydrophobicContact CG2-CE1 3.63Å; I350-F352 HydrophobicContact CG2-CE2 4.39Å; I350-F352 HydrophobicContact CG2-CZ 3.79Å; I350-I403 HydrophobicContact CD1-CG2 4.39Å; I350-P406 HydrophobicContact CG2-CB 3.9Å; I350-V700 HydrophobicContact CB-CB 4.32Å; I350-V700 HydrophobicContact CB-CG2 4.29Å; I350-V700 PolarHBondContact N-O 3.07Å; I350-V700 PolarHBondContact O-N 2.98Å
351	S	64.3	Low	47.9	Very low	34 Å²	34	57.7 Å²	57.7	24%	0.238	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.1	163.6	176	0	0	0	0	109.4	V698	S351-V698 WeakPolarHBondContact CA-O 3.42Å
352	F	67.6	Low	48.2	Very low	2 Å²	2	52.5 Å²	52.5	1%	0.009	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.9	173.4	-43.8	-77.4	0	0	0	108.5	I350 L381 W401 P406 Q697 V698 V700	I350-F352 HydrophobicContact CG2-CD1 4.1Å; I350-F352 HydrophobicContact CG2-CE1 3.63Å; I350-F352 HydrophobicContact CG2-CE2 4.39Å; I350-F352 HydrophobicContact CG2-CZ 3.79Å; F352-L381 HydrophobicContact CD2-CD2 4.23Å; F352-L381 HydrophobicContact CE2-CD2 3.81Å; F352-L381 HydrophobicContact CZ-CD2 4.48Å; F352-W401 HydrophobicContact CB-CD2 3.97Å; F352-W401 HydrophobicContact CB-CE3 4.05Å; F352-W401 HydrophobicContact CB-CH2 4.35Å; F352-W401 HydrophobicContact CB-CZ2 4.28Å; F352-W401 HydrophobicContact CB-CZ3 4.23Å; F352-W401 HydrophobicContact CD1-CD2 4.4Å; F352-W401 HydrophobicContact CD1-CE3 4.04Å; F352-W401 HydrophobicContact CG-CD2 4.33Å; F352-W401 HydrophobicContact CG-CE3 4.35Å; F352-P406 HydrophobicContact CD1-CB 3.94Å; F352-P406 HydrophobicContact CE1-CB 3.71Å; F352-Q697 CarbonylContact O-C 3.53Å; F352-Q697 WeakPolarHBondContact O-CA 3.4Å; F352-V698 HydrophobicContact CB-CB 4.45Å; F352-V698 HydrophobicContact CD2-CB 4.25Å; F352-V698 HydrophobicContact CD2-CG1 4.16Å; F352-V698 WeakPolarHBondContact CD2-O 3.38Å; F352-V698 PolarHBondContact N-O 2.9Å; F352-V698 PolarHBondContact O-N 3.22Å; F352-V700 HydrophobicContact CD2-CG2 4.44Å; F352-V700 HydrophobicContact CE2-CG2 3.55Å; F352-V700 HydrophobicContact CZ-CG2 4.13Å
353	S	59.4	Low	48.4	Very low	24 Å²	24	49.7 Å²	49.7	17%	0.168	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	126.3	177.3	56.4	0	0	0	0	110.8	W401	S353-W401 WeakPolarHBondContact O-CH2 3.23Å
354	C	50.5	Low	47.9	Very low	23 Å²	23	41.2 Å²	41.2	16%	0.155	26%	0.257	C	S	.	.			trans	-93.1	130.8	169.2	-154.4	0	0	0	0	108.7	P356 Y385 C399 W401	C354-P356 VanDerWaalsContact O-CD 3.26Å; C354-P356 WeakPolarHBondContact O-CD 3.18Å; C354-Y385 HydrophobicContact CB-CE1 4.18Å; C354-Y385 HydrophobicContact CB-CE2 4.03Å; C354-C399 VanDerWaalsContact SG-SG 3.64Å; C354-W401 HydrophobicContact CB-CZ2 4.1Å
355	V	49.1	Very low	47.2	Very low	71 Å²	71	38.5 Å²	38.5	43%	0.43	23%	0.233	S	C	.	.			trans	-104	72.9	179.6	-169.4	0	0	0	0	112.6	V331	V331-V355 HydrophobicContact CG1-CG2 4.26Å; V331-V355 HydrophobicContact CG2-CG2 4.13Å
356	P	39.2	Very low	46.3	Very low	49 Å²	49	35.3 Å²	35.3	32%	0.318	22%	0.217	S	C	.	.			trans	-105.2	126.3	143.4	1.2	19.6	0	0	0	109.3	C354 S358 L359 L397	C354-P356 VanDerWaalsContact O-CD 3.26Å; C354-P356 WeakPolarHBondContact O-CD 3.18Å; P356-S358 PolarHBondContact O-N 3Å; P356-L359 HydrophobicContact CB-CD1 4.05Å; P356-L359 HydrophobicContact CG-CD1 4.14Å; P356-L397 HydrophobicContact CG-CD2 4.09Å
357	V	35.4	Very low	44.9	Very low	141 Å²	141	37.4 Å²	37.4	86%	0.855	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	131.2	-179.9	-179.9	0	0	0	0	110.5
358	S	32.7	Very low	43.4	Very low	89 Å²	89	37.1 Å²	37.1	62%	0.622	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	75	32.1	173.6	-157.4	0	0	0	0	117.2	P356	P356-S358 PolarHBondContact O-N 3Å
359	L	35.6	Very low	41.9	Very low	30 Å²	30	32.6 Å²	32.6	16%	0.157	21%	0.205	C	C	.	.			trans	-117.2	122.2	167.6	-70	177.3	0	0	0	111.7	P356 E387	P356-L359 HydrophobicContact CB-CD1 4.05Å; P356-L359 HydrophobicContact CG-CD1 4.14Å; L359-E387 HydrophobicContact CD2-CB 4.18Å
360	C	32.5	Very low	40.4	Very low	23 Å²	23	31.9 Å²	31.9	16%	0.155	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	157.3	173.5	-57.1	0	0	0	0	110.3	V362 Y385 G386 T388 S694	C360-V362 HydrophobicContact CB-CG2 4.18Å; C360-V362 PolarHBondContact O-N 2.96Å; C360-Y385 CarbonylContact O-C 3.52Å; C360-Y385 VanDerWaalsContact O-CA 3.26Å; C360-Y385 WeakPolarHBondContact O-CA 3.38Å; C360-G386 PolarHBondContact N-O 2.79Å; C360-G386 PolarHBondContact O-N 2.86Å; C360-G386 VanDerWaalsContact O-O 3.08Å; C360-T388 HydrophobicContact CB-CG2 3.92Å; C360-S694 PolarHBondContact SG-O 3.23Å
361	P	37.8	Very low	39.1	Very low	4 Å²	4	31.4 Å²	31.4	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	108.9	163.5	27.7	-15.2	0	0	0	107	G384 Y385 T678 D693	P361-G384 WeakPolarHBondContact CA-O 3.03Å; P361-Y385 HydrophobicContact CB-CD1 4.16Å; P361-Y385 HydrophobicContact CB-CE1 4.14Å; P361-T678 PolarHBondContact O-OG1 2.98Å; P361-T678 VanDerWaalsContact O-OG1 3.09Å; P361-D693 WeakPolarHBondContact CD-O 3.41Å; P361-D693 WeakPolarHBondContact CG-O 3.35Å
362	V	33.7	Very low	37.9	Very low	27 Å²	27	29.9 Å²	29.9	16%	0.164	19%	0.189	C	C	.	.			trans	-101.5	132	-179.1	-179.8	0	0	0	0	107.8	C360 G384 G386 T388 V419 T420	C360-V362 HydrophobicContact CB-CG2 4.18Å; C360-V362 PolarHBondContact O-N 2.96Å; V362-G384 PolarHBondContact N-O 3.34Å; V362-G384 VanDerWaalsContact N-O 3.15Å; V362-G386 WeakPolarHBondContact CG2-O 3.38Å; V362-T388 HydrophobicContact CG2-CG2 3.76Å; V362-V419 WeakPolarHBondContact CB-O 3.36Å; V362-V419 WeakPolarHBondContact CG1-O 3.14Å; V362-T420 HydrophobicContact CG1-CG2 4.42Å
363	L	35.1	Very low	36.8	Very low	44 Å²	44	31.3 Å²	31.3	23%	0.23	20%	0.196	C	C	.	.			trans	-43.5	144.9	-175.3	-76.6	163.5	0	0	0	113.3	P369 T420 T421 E634 T678 S679	L363-P369 HydrophobicContact CD2-CB 4.22Å; L363-T420 CarbonylContact O-C 3.57Å; L363-T421 WeakPolarHBondContact O-CA 3.01Å; L363-T421 PolarHBondContact O-N 2.9Å; L363-E634 WeakPolarHBondContact CD2-OE2 3.38Å; L363-T678 WeakPolarHBondContact CD2-O 3.4Å; L363-S679 VanDerWaalsContact CD2-CB 3.49Å
364	P	26.7	Very low	36.3	Very low	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.188	C	C	.	.				-73.3	144.9	105.4	-3.5	-18.2	0	0	0	117.9	P369 G370 V422	P364-P369 VanDerWaalsContact CG-O 3.27Å; P364-P369 WeakPolarHBondContact CG-O 3.36Å; P364-P369 CarbonylContact O-C 3.52Å; P364-P369 WeakPolarHBondContact O-CA 3.16Å; P364-G370 VanDerWaalsContact CD-CA 3.44Å; P364-G370 PolarHBondContact O-N 3.16Å; P364-V422 WeakPolarHBondContact CB-O 3.23Å; P364-V422 HydrophobicContact CG-CB 4.21Å; P364-V422 HydrophobicContact CG-CG2 3.6Å; P364-V422 VanDerWaalsContact CG-O 3.27Å; P364-V422 WeakPolarHBondContact CG-O 3.22Å
365	V	30.5	Very low	36.4	Very low	12 Å²	12	32.5 Å²	32.5	7%	0.073	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-92.8	166.5	144.7	-164.7	0	0	0	0	106.9	Q471 C548	V365-Q471 HydrophobicContact CB-CB 4.05Å; V365-Q471 HydrophobicContact CB-CG 3.85Å; V365-Q471 HydrophobicContact CG1-CG 4.42Å; V365-C548 HydrophobicContact CG1-CB 3.98Å
366	D	29.8	Very low	36.7	Very low	2 Å²	2	34.2 Å²	34.2	1%	0.011	21%	0.21	C	C	.	.	S	Bend	trans	-36.8	147.7	-150.7	-8.2	-50.9	0	0	0	119.1	S368 Q471 R473 R636	D366-S368 WeakPolarHBondContact CA-O 3.43Å; D366-Q471 VanDerWaalsContact CB-NE2 3.34Å; D366-Q471 PolarHBondContact O-NE2 3.31Å; D366-Q471 PolarHBondContact OD2-NE2 3.35Å; D366-R473 WeakPolarHBondContact O-CB 3.28Å; D366-R473 IonicContact OD2-NH1 2.68Å; D366-R473 PolarHBondContact OD2-NH1 2.7Å; D366-R636 IonicContact OD1-CZ 2.69Å; D366-R636 VanDerWaalsContact OD1-CZ 3.28Å; D366-R636 IonicContact OD1-NH1 2.66Å; D366-R636 PolarHBondContact OD1-NH1 2.81Å; D366-R636 IonicContact OD1-NH2 2.68Å; D366-R636 PolarHBondContact OD1-NH2 2.96Å
367	C	30.6	Very low	37.8	Very low	48 Å²	48	38.6 Å²	38.6	32%	0.324	22%	0.221	S	C	.	.	S	Bend	cis	-87.5	112.3	21.5	-65	0	0	0	0	115	R473	C367-R473 PolarHBondContact SG-NE 3.16Å
368	S	27.4	Very low	39.2	Very low	33 Å²	33	33.7 Å²	33.7	23%	0.231	19%	0.192	C	C	.	.	S	Bend	trans	58.9	-177.5	-165.6	74.4	0	0	0	0	111.4	D366 R636 L681	D366-S368 WeakPolarHBondContact CA-O 3.43Å; S368-R636 PolarHBondContact O-NH2 3.01Å; S368-L681 WeakPolarHBondContact OG-CD1 3.46Å
369	P	34.3	Very low	41	Very low	0 Å²	0	31 Å²	31	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-84.6	-156.9	-161	45.5	-47	0	0	0	111.2	L363 P364 V371 E634 L680 L681	L363-P369 HydrophobicContact CD2-CB 4.22Å; P364-P369 VanDerWaalsContact CG-O 3.27Å; P364-P369 WeakPolarHBondContact CG-O 3.36Å; P364-P369 CarbonylContact O-C 3.52Å; P364-P369 WeakPolarHBondContact O-CA 3.16Å; P369-V371 HydrophobicContact CG-CB 3.95Å; P369-V371 HydrophobicContact CG-CG2 4.19Å; P369-V371 PolarHBondContact O-N 2.97Å; P369-E634 WeakPolarHBondContact CA-OE1 3.37Å; P369-E634 WeakPolarHBondContact CB-OE1 3.32Å; P369-E634 WeakPolarHBondContact CB-OE2 3.41Å; P369-L680 VanDerWaalsContact CB-O 3.29Å; P369-L680 WeakPolarHBondContact CB-O 3.22Å; P369-L680 VanDerWaalsContact CD-O 3.29Å; P369-L680 WeakPolarHBondContact CD-O 3.46Å; P369-L680 VanDerWaalsContact CG-O 3.24Å; P369-L680 WeakPolarHBondContact CG-O 3.1Å; P369-L681 HydrophobicContact CG-CB 3.53Å
370	G	30.8	Very low	43	Very low	3 Å²	3	30.7 Å²	30.7	3%	0.031	17%	0.169	C	C	.	.	S	Bend	trans	-23.7	-0.9	153.3	0	0	0	0	0	121.9	P364 V383	P364-G370 VanDerWaalsContact CD-CA 3.44Å; P364-G370 PolarHBondContact O-N 3.16Å; G370-V383 WeakPolarHBondContact O-CA 3.37Å
371	V	37.6	Very low	45.4	Very low	1 Å²	1	29.7 Å²	29.7	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	80.4	-156	-170.2	0	0	0	0	107.8	P369 L381 A382 V383 L681 V690 V698	P369-V371 HydrophobicContact CG-CB 3.95Å; P369-V371 HydrophobicContact CG-CG2 4.19Å; P369-V371 PolarHBondContact O-N 2.97Å; V371-L381 HydrophobicContact CG1-CD1 3.4Å; V371-L381 VanDerWaalsContact CG1-CD1 3.4Å; V371-L381 HydrophobicContact CG1-CD2 3.63Å; V371-L381 HydrophobicContact CG1-CG 3.36Å; V371-A382 CarbonylContact C-O 3.56Å; V371-A382 VanDerWaalsContact CA-O 3.28Å; V371-A382 WeakPolarHBondContact CA-O 3.4Å; V371-V383 HydrophobicContact CG1-CG2 4.25Å; V371-V383 HydrophobicContact CG2-CG2 4.35Å; V371-L681 HydrophobicContact CB-CB 4.48Å; V371-L681 HydrophobicContact CB-CD2 4.13Å; V371-L681 HydrophobicContact CG1-CD2 3.67Å; V371-V690 HydrophobicContact CG1-CB 4.45Å; V371-V690 HydrophobicContact CG1-CG1 4.19Å; V371-V698 HydrophobicContact CG2-CG1 4.25Å
372	S	39.3	Very low	47.6	Very low	2 Å²	2	29.5 Å²	29.5	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.7	-176.5	60.5	0	0	0	0	113.1	L381 A382 F424	S372-L381 CarbonylContact O-C 3.59Å; S372-L381 WeakPolarHBondContact O-CA 3.17Å; S372-A382 PolarHBondContact N-O 2.66Å; S372-A382 PolarHBondContact O-N 3.47Å; S372-F424 WeakPolarHBondContact O-CE2 3.33Å; S372-F424 WeakPolarHBondContact OG-CD2 3.35Å
373	H	45.6	Very low	49.9	Very low	31 Å²	31	28.2 Å²	28.2	14%	0.144	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	138.4	171.4	-83.4	-109.4	0	0	0	110.3	P378 L380 L381	H373-P378 PolarHBondContact CE1-O 2.95Å; H373-P378 PolarHBondContact ND1-O 2.91Å; H373-L380 WeakPolarHBondContact CA-O 3.27Å; H373-L381 WeakPolarHBondContact NE2-CD1 3.26Å
374	S	47.4	Very low	52.2	Low	1 Å²	1	26.1 Å²	26.1	1%	0.007	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-79.3	135.2	168.2	70.8	0	0	0	0	110.4	D376 Y377	S374-D376 VanDerWaalsContact C-N 3.34Å; S374-D376 PolarHBondContact O-N 2.81Å; S374-Y377 CarbonylContact O-C 3.58Å; S374-Y377 VanDerWaalsContact O-C 3.25Å; S374-Y377 PolarHBondContact O-N 3.02Å; S374-Y377 WeakPolarHBondContact OG-CB 3.49Å; S374-Y377 PolarHBondContact OG-N 3.38Å; S374-Y377 PolarHBondContact OG-O 2.86Å
375	P	53.8	Low	54.9	Low	71 Å²	71	26.3 Å²	26.3	46%	0.461	14%	0.143	S	C	.	.	S	Bend	trans	-54.6	-42.1	-177.4	-32.5	37.1	0	0	0	115.1
376	D	54	Low	56.9	Low	108 Å²	108	25.7 Å²	25.7	58%	0.578	14%	0.139	S	C	*	.	S	Bend	trans	-77.5	-28.9	-179.5	-77.9	7.6	0	0	0	113.3	S374 P378 P429	S374-D376 VanDerWaalsContact C-N 3.34Å; S374-D376 PolarHBondContact O-N 2.81Å; D376-P378 WeakPolarHBondContact O-CD 3.38Å; D376-P429 HydrophobicContact CB-CB 4.33Å; D376-P429 HydrophobicContact CB-CG 3.91Å; D376-P429 VanDerWaalsContact CG-CG 3.42Å; D376-P429 VanDerWaalsContact OD2-CG 3.27Å; D376-P429 WeakPolarHBondContact OD2-CG 3.27Å
377	Y	62.4	Low	58.8	Low	140 Å²	140	27.8 Å²	27.8	55%	0.549	15%	0.149	S	C	.	.			trans	-122.1	83.1	-178.4	-50.9	-85.1	0	0	0	110.2	S374 D379 L380	S374-Y377 CarbonylContact O-C 3.58Å; S374-Y377 VanDerWaalsContact O-C 3.25Å; S374-Y377 PolarHBondContact O-N 3.02Å; S374-Y377 WeakPolarHBondContact OG-CB 3.49Å; S374-Y377 PolarHBondContact OG-N 3.38Å; S374-Y377 PolarHBondContact OG-O 2.86Å; Y377-D379 PolarHBondContact O-N 2.8Å; Y377-L380 WeakPolarHBondContact O-CB 3.28Å; Y377-L380 PolarHBondContact O-N 2.84Å
378	P	65.5	Low	59.9	Low	39 Å²	39	29.1 Å²	29.1	25%	0.253	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-4.7	178.8	29.2	-37.8	0	0	0	113.8	H373 D376 L685	H373-P378 PolarHBondContact CE1-O 2.95Å; H373-P378 PolarHBondContact ND1-O 2.91Å; D376-P378 WeakPolarHBondContact O-CD 3.38Å; P378-L685 HydrophobicContact CB-CD1 3.6Å; P378-L685 HydrophobicContact CB-CG 4.14Å; P378-L685 HydrophobicContact CG-CD1 3.55Å
379	D	70.1	Confident	61.3	Low	32 Å²	32	32.3 Å²	32.3	17%	0.171	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	1.2	169.3	-61	-55.8	0	0	0	113.2	R290 Y377 S402 I403 K404	R290-D379 IonicContact NH2-OD1 3.77Å; Y377-D379 PolarHBondContact O-N 2.8Å; D379-S402 CarbonylContact O-C 3.56Å; D379-S402 WeakPolarHBondContact O-CA 3.46Å; D379-S402 WeakPolarHBondContact O-CB 3.28Å; D379-S402 PolarHBondContact O-OG 2.87Å; D379-I403 HydrophobicContact CB-CB 4.48Å; D379-I403 PolarHBondContact O-N 2.86Å; D379-K404 WeakPolarHBondContact OD2-CE 3.39Å; D379-K404 IonicContact OD2-NZ 3.07Å; D379-K404 PolarHBondContact OD2-NZ 2.78Å
380	L	78.4	Confident	62.2	Low	23 Å²	23	40.6 Å²	40.6	12%	0.12	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	139.9	-177.4	-171.1	75.5	0	0	0	110.9	H373 Y377 C400 F424	H373-L380 WeakPolarHBondContact CA-O 3.27Å; Y377-L380 WeakPolarHBondContact O-CB 3.28Å; Y377-L380 PolarHBondContact O-N 2.84Å; L380-C400 HydrophobicContact CD1-CB 4.2Å; L380-F424 HydrophobicContact CD2-CZ 4.24Å
381	L	81.7	Confident	63.1	Low	3 Å²	3	51.5 Å²	51.5	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	102.9	-162.7	-162	84.8	0	0	0	110.7	F352 V371 S372 H373 V383 C400 W401 L681	F352-L381 HydrophobicContact CD2-CD2 4.23Å; F352-L381 HydrophobicContact CE2-CD2 3.81Å; F352-L381 HydrophobicContact CZ-CD2 4.48Å; V371-L381 HydrophobicContact CG1-CD1 3.4Å; V371-L381 VanDerWaalsContact CG1-CD1 3.4Å; V371-L381 HydrophobicContact CG1-CD2 3.63Å; V371-L381 HydrophobicContact CG1-CG 3.36Å; S372-L381 CarbonylContact O-C 3.59Å; S372-L381 WeakPolarHBondContact O-CA 3.17Å; H373-L381 WeakPolarHBondContact NE2-CD1 3.26Å; L381-V383 HydrophobicContact CD2-CG2 4.44Å; L381-C400 CarbonylContact O-C 3.58Å; L381-C400 WeakPolarHBondContact O-CA 3.4Å; L381-W401 HydrophobicContact CB-CB 4.25Å; L381-W401 HydrophobicContact CD2-CB 4.46Å; L381-W401 PolarHBondContact N-O 3Å; L381-W401 PolarHBondContact O-N 3.25Å; L381-L681 HydrophobicContact CD1-CD2 3.98Å
382	A	83.7	Confident	63.8	Low	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.3	-179.1	0	0	0	0	0	111.7	V371 S372 V422 F424 L432	V371-A382 CarbonylContact C-O 3.56Å; V371-A382 VanDerWaalsContact CA-O 3.28Å; V371-A382 WeakPolarHBondContact CA-O 3.4Å; S372-A382 PolarHBondContact N-O 2.66Å; S372-A382 PolarHBondContact O-N 3.47Å; A382-V422 HydrophobicContact CB-CG2 4.38Å; A382-F424 HydrophobicContact CB-CE2 3.53Å; A382-F424 HydrophobicContact CB-CZ 3.8Å; A382-L432 HydrophobicContact CB-CD1 4.1Å; A382-L432 HydrophobicContact CB-CD2 3.98Å
383	V	83.8	Confident	64.8	Low	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.7	-178.5	-179.9	0	0	0	0	110.6	G370 V371 L381 Y385 V398 C399 V698	G370-V383 WeakPolarHBondContact O-CA 3.37Å; V371-V383 HydrophobicContact CG1-CG2 4.25Å; V371-V383 HydrophobicContact CG2-CG2 4.35Å; L381-V383 HydrophobicContact CD2-CG2 4.44Å; V383-Y385 HydrophobicContact CB-CE2 4.05Å; V383-Y385 HydrophobicContact CG1-CD2 4.28Å; V383-Y385 HydrophobicContact CG1-CE1 3.99Å; V383-Y385 HydrophobicContact CG1-CE2 3.66Å; V383-Y385 VanDerWaalsContact CG1-CZ 3.5Å; V383-V398 WeakPolarHBondContact O-CA 3.45Å; V383-C399 PolarHBondContact N-O 3.41Å; V383-C399 PolarHBondContact O-N 3.49Å; V383-V698 HydrophobicContact CG1-CG2 3.95Å; V383-V698 HydrophobicContact CG2-CG2 4.29Å
384	G	83.8	Confident	65.8	Low	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	136.3	173.5	0	0	0	0	0	112.4	P361 V362	P361-G384 WeakPolarHBondContact CA-O 3.03Å; V362-G384 PolarHBondContact N-O 3.34Å; V362-G384 VanDerWaalsContact N-O 3.15Å
385	Y	81.5	Confident	67.3	Low	3 Å²	3	65.6 Å²	65.6	1%	0.012	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	142	174.8	-58.1	-86.6	0	0	0	111.4	C354 C360 P361 V383 G396 L397 C399 W401 V419 G696	C354-Y385 HydrophobicContact CB-CE1 4.18Å; C354-Y385 HydrophobicContact CB-CE2 4.03Å; C360-Y385 CarbonylContact O-C 3.52Å; C360-Y385 VanDerWaalsContact O-CA 3.26Å; C360-Y385 WeakPolarHBondContact O-CA 3.38Å; P361-Y385 HydrophobicContact CB-CD1 4.16Å; P361-Y385 HydrophobicContact CB-CE1 4.14Å; V383-Y385 HydrophobicContact CB-CE2 4.05Å; V383-Y385 HydrophobicContact CG1-CD2 4.28Å; V383-Y385 HydrophobicContact CG1-CE1 3.99Å; V383-Y385 HydrophobicContact CG1-CE2 3.66Å; V383-Y385 VanDerWaalsContact CG1-CZ 3.5Å; Y385-G396 WeakPolarHBondContact O-CA 3.39Å; Y385-L397 HydrophobicContact CD2-CB 4.35Å; Y385-L397 PolarHBondContact N-O 2.82Å; Y385-L397 PolarHBondContact O-N 3.48Å; Y385-L397 VanDerWaalsContact O-N 3.1Å; Y385-C399 HydrophobicContact CE2-CB 3.9Å; Y385-W401 PolarHBondContact OH-NE1 3.04Å; Y385-V419 PolarHBondContact O-N 2.9Å; Y385-G696 WeakPolarHBondContact CE1-O 3.22Å
386	G	72.9	Confident	68.6	Low	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	158.1	-178.5	0	0	0	0	0	111.8	C360 V362	C360-G386 PolarHBondContact N-O 2.79Å; C360-G386 PolarHBondContact O-N 2.86Å; C360-G386 VanDerWaalsContact O-O 3.08Å; V362-G386 WeakPolarHBondContact CG2-O 3.38Å
387	E	69.1	Low	70	Confident	45 Å²	45	58.2 Å²	58.2	21%	0.21	28%	0.278	C	S	.	.			trans	-81.6	123.3	170.6	-163.1	172.9	176	0	0	108.5	L359 D389 N392	L359-E387 HydrophobicContact CD2-CB 4.18Å; E387-D389 VanDerWaalsContact C-N 3.26Å; E387-D389 HydrophobicContact CG-CB 4.45Å; E387-D389 PolarHBondContact O-N 2.96Å; E387-N392 VanDerWaalsContact CD-CB 3.42Å; E387-N392 HydrophobicContact CG-CB 4.42Å; E387-N392 VanDerWaalsContact OE1-CB 3.3Å; E387-N392 WeakPolarHBondContact OE1-CB 3.43Å; E387-N392 PolarHBondContact OE1-ND2 2.73Å; E387-N392 WeakPolarHBondContact OE2-CB 3.44Å
388	T	55.3	Low	71.1	Confident	77 Å²	77	51.5 Å²	51.5	47%	0.472	25%	0.252	S	S	.	.			trans	-75	-16.1	-178.2	47.8	0	0	0	0	113.7	C360 V362 Y390	C360-T388 HydrophobicContact CB-CG2 3.92Å; V362-T388 HydrophobicContact CG2-CG2 3.76Å; T388-Y390 PolarHBondContact O-N 3.44Å; T388-Y390 VanDerWaalsContact O-N 3.15Å
389	D	56.3	Low	72	Confident	99 Å²	99	49.7 Å²	49.7	53%	0.529	24%	0.24	S	C	.	.			trans	-76.9	102.6	-175.7	-91.6	21.9	0	0	0	110.7	E387 R391 N392	E387-D389 VanDerWaalsContact C-N 3.26Å; E387-D389 HydrophobicContact CG-CB 4.45Å; E387-D389 PolarHBondContact O-N 2.96Å; D389-R391 PolarHBondContact O-N 3.02Å; D389-N392 PolarHBondContact O-N 3.37Å
390	Y	52.6	Low	72.7	Confident	175 Å²	175	48.1 Å²	48.1	69%	0.686	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-6.8	176.4	-68.1	-90.5	0	0	0	116.9	T388 W470	T388-Y390 PolarHBondContact O-N 3.44Å; T388-Y390 VanDerWaalsContact O-N 3.15Å; Y390-W470 HydrophobicContact CE1-CH2 4.39Å; Y390-W470 WeakPolarHBondContact OH-CH2 3.27Å
391	R	49.6	Very low	72.9	Confident	232 Å²	232	47.1 Å²	47.1	88%	0.875	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-21.4	176.5	-65.3	-175.1	174.1	-161.4	-2.2	113.5	D389	D389-R391 PolarHBondContact O-N 3.02Å
392	N	53.6	Low	72.9	Confident	83 Å²	83	47.1 Å²	47.1	44%	0.444	23%	0.227	S	C	.	.			trans	-112.2	104.2	179.8	-67.9	-9.1	0	0	0	108.6	E387 D389 G394	E387-N392 VanDerWaalsContact CD-CB 3.42Å; E387-N392 HydrophobicContact CG-CB 4.42Å; E387-N392 VanDerWaalsContact OE1-CB 3.3Å; E387-N392 WeakPolarHBondContact OE1-CB 3.43Å; E387-N392 PolarHBondContact OE1-ND2 2.73Å; E387-N392 WeakPolarHBondContact OE2-CB 3.44Å; D389-N392 PolarHBondContact O-N 3.37Å; N392-G394 PolarHBondContact O-N 3.06Å
393	H	58.9	Low	72.6	Confident	147 Å²	147	47.6 Å²	47.6	68%	0.681	23%	0.229	S	C	*	.			trans	-80.1	67.2	168.7	-61.6	-46.2	0	0	0	109.6
394	G	66.7	Low	72.4	Confident	10 Å²	10	51.5 Å²	51.5	10%	0.103	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-64.7	157.1	173.6	0	0	0	0	0	112.2	N392 S417 A418	N392-G394 PolarHBondContact O-N 3.06Å; G394-S417 CarbonylContact O-C 3.5Å; G394-A418 PolarHBondContact O-N 2.87Å
395	P	80.4	Confident	72.2	Confident	90 Å²	90	52.1 Å²	52.1	58%	0.584	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-65.7	144.8	170.6	30.2	-34.6	0	0	0	110.4	C415	P395-C415 CarbonylContact C-O 3.54Å; P395-C415 WeakPolarHBondContact CA-O 3.37Å; P395-C415 WeakPolarHBondContact CB-O 3.31Å
396	G	80.5	Confident	71.9	Confident	3 Å²	3	52.1 Å²	52.1	3%	0.031	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	165.1	174.4	0	0	0	0	0	112.6	Y385 C415 S417	Y385-G396 WeakPolarHBondContact O-CA 3.39Å; G396-C415 PolarHBondContact N-O 2.85Å; G396-C415 PolarHBondContact O-N 2.9Å; G396-S417 WeakPolarHBondContact CA-O 3.45Å; G396-S417 PolarHBondContact N-O 3.01Å
397	L	84.2	Confident	72.2	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.11	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.6	176.3	-156.8	72.9	0	0	0	109.1	P356 Y385 I412 N414	P356-L397 HydrophobicContact CG-CD2 4.09Å; Y385-L397 HydrophobicContact CD2-CB 4.35Å; Y385-L397 PolarHBondContact N-O 2.82Å; Y385-L397 PolarHBondContact O-N 3.48Å; Y385-L397 VanDerWaalsContact O-N 3.1Å; L397-I412 HydrophobicContact CD1-CG2 3.56Å; L397-I412 HydrophobicContact CD2-CG2 4.1Å; L397-I412 HydrophobicContact CG-CG2 3.88Å; L397-N414 WeakPolarHBondContact CD1-OD1 3.38Å
398	V	85.3	Confident	72.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.4	165.2	-174	0	0	0	0	108.5	V383 I413 V419 V422 L432 V434	V383-V398 WeakPolarHBondContact O-CA 3.45Å; V398-I413 HydrophobicContact CB-CB 4.26Å; V398-I413 PolarHBondContact N-O 3.09Å; V398-I413 PolarHBondContact O-N 3Å; V398-V419 HydrophobicContact CG2-CG1 4.26Å; V398-V419 HydrophobicContact CG2-CG2 3.7Å; V398-V422 HydrophobicContact CG1-CG1 4.37Å; V398-V422 HydrophobicContact CG2-CG1 4.05Å; V398-L432 HydrophobicContact CG1-CD2 3.95Å; V398-V434 HydrophobicContact CG2-CG1 4.08Å; V398-V434 HydrophobicContact CG2-CG2 4.16Å
399	C	84.4	Confident	73.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.1	174.7	-61.1	0	0	0	0	109.8	C354 V383 Y385 P409 R411	C354-C399 VanDerWaalsContact SG-SG 3.64Å; V383-C399 PolarHBondContact N-O 3.41Å; V383-C399 PolarHBondContact O-N 3.49Å; Y385-C399 HydrophobicContact CE2-CB 3.9Å; C399-P409 HydrophobicContact CB-CB 3.78Å; C399-P409 HydrophobicContact CB-CG 4.17Å; C399-R411 WeakPolarHBondContact CA-O 3.45Å
400	C	83.9	Confident	74.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	100.2	169.7	-60.5	0	0	0	0	108.4	L380 L381 P409 E410 R411 M446	L380-C400 HydrophobicContact CD1-CB 4.2Å; L381-C400 CarbonylContact O-C 3.58Å; L381-C400 WeakPolarHBondContact O-CA 3.4Å; C400-P409 CarbonylContact O-C 3.6Å; C400-E410 PolarHBondContact O-N 2.83Å; C400-R411 HydrophobicContact CB-CB 4.11Å; C400-R411 PolarHBondContact N-O 2.9Å; C400-R411 PolarHBondContact O-N 2.84Å; C400-M446 HydrophobicContact CB-CE 4.02Å; C400-M446 WeakPolarHBondContact SG-CE 3.14Å
401	W	82.9	Confident	76.2	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	154.2	174.3	-62.3	92.5	0	0	0	110.1	F352 S353 C354 L381 Y385 P409	F352-W401 HydrophobicContact CB-CD2 3.97Å; F352-W401 HydrophobicContact CB-CE3 4.05Å; F352-W401 HydrophobicContact CB-CH2 4.35Å; F352-W401 HydrophobicContact CB-CZ2 4.28Å; F352-W401 HydrophobicContact CB-CZ3 4.23Å; F352-W401 HydrophobicContact CD1-CD2 4.4Å; F352-W401 HydrophobicContact CD1-CE3 4.04Å; F352-W401 HydrophobicContact CG-CD2 4.33Å; F352-W401 HydrophobicContact CG-CE3 4.35Å; S353-W401 WeakPolarHBondContact O-CH2 3.23Å; C354-W401 HydrophobicContact CB-CZ2 4.1Å; L381-W401 HydrophobicContact CB-CB 4.25Å; L381-W401 HydrophobicContact CD2-CB 4.46Å; L381-W401 PolarHBondContact N-O 3Å; L381-W401 PolarHBondContact O-N 3.25Å; Y385-W401 PolarHBondContact OH-NE1 3.04Å; W401-P409 HydrophobicContact CD2-CB 3.92Å; W401-P409 HydrophobicContact CE3-CB 4.04Å; W401-P409 HydrophobicContact CG-CB 4.34Å; W401-P409 HydrophobicContact CH2-CG 4.4Å; W401-P409 HydrophobicContact CZ2-CB 4.46Å; W401-P409 HydrophobicContact CZ2-CG 4.46Å; W401-P409 HydrophobicContact CZ3-CB 4.38Å; W401-P409 HydrophobicContact CZ3-CG 4.49Å
402	S	81.1	Confident	77.8	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.3	165.1	-177.3	0	0	0	0	110.6	D379 K404 N405	D379-S402 CarbonylContact O-C 3.56Å; D379-S402 WeakPolarHBondContact O-CA 3.46Å; D379-S402 WeakPolarHBondContact O-CB 3.28Å; D379-S402 PolarHBondContact O-OG 2.87Å; S402-K404 PolarHBondContact O-N 3.3Å; S402-K404 PolarHBondContact OG-N 2.98Å; S402-N405 CarbonylContact O-C 3.58Å; S402-N405 PolarHBondContact O-N 3.41Å
403	I	78.5	Confident	79.3	Confident	9 Å²	9	37.7 Å²	37.7	5%	0.046	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.7	173.5	-54.1	-178.1	0	0	0	111.1	L286 Y289 I350 D379	L286-I403 HydrophobicContact CD2-CG2 3.63Å; L286-I403 WeakPolarHBondContact CD2-O 3.38Å; Y289-I403 HydrophobicContact CD1-CD1 4.5Å; Y289-I403 HydrophobicContact CD1-CG2 4.17Å; Y289-I403 HydrophobicContact CE1-CD1 3.61Å; Y289-I403 HydrophobicContact CE1-CG2 4.17Å; Y289-I403 HydrophobicContact CE2-CD1 4.05Å; Y289-I403 WeakPolarHBondContact OH-CD1 3.38Å; I350-I403 HydrophobicContact CD1-CG2 4.39Å; D379-I403 HydrophobicContact CB-CB 4.48Å; D379-I403 PolarHBondContact O-N 2.86Å
404	K	79.7	Confident	80.6	Confident	82 Å²	82	36 Å²	36	36%	0.357	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-18.6	172.3	-63.5	167.5	-176.8	129.9	0	114.4	D379 S402	D379-K404 WeakPolarHBondContact OD2-CE 3.39Å; D379-K404 IonicContact OD2-NZ 3.07Å; D379-K404 PolarHBondContact OD2-NZ 2.78Å; S402-K404 PolarHBondContact O-N 3.3Å; S402-K404 PolarHBondContact OG-N 2.98Å
405	N	78.4	Confident	81.4	Confident	13 Å²	13	35.8 Å²	35.8	7%	0.07	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-143	89.8	174.1	-172.6	-20.3	0	0	0	109.3	E274 L278 S402 T407 W408	E274-N405 PolarHBondContact OE1-ND2 2.71Å; L278-N405 HydrophobicContact CD1-CB 4.09Å; L278-N405 WeakPolarHBondContact CD1-OD1 3.17Å; S402-N405 CarbonylContact O-C 3.58Å; S402-N405 PolarHBondContact O-N 3.41Å; N405-T407 VanDerWaalsContact C-N 3.27Å; N405-T407 PolarHBondContact O-N 3.21Å; N405-T407 PolarHBondContact OD1-N 3.42Å; N405-T407 VanDerWaalsContact OD1-N 3.14Å; N405-T407 PolarHBondContact OD1-OG1 3.38Å; N405-W408 VanDerWaalsContact CG-O 3.3Å; N405-W408 PolarHBondContact OD1-N 3.17Å; N405-W408 PolarHBondContact OD1-O 3.43Å
406	P	76.1	Confident	81.6	Confident	4 Å²	4	37.1 Å²	37.1	3%	0.026	18%	0.18	C	C	.	.	S	Bend	trans	-77.2	-11.3	179.4	32.3	-36.4	0	0	0	113.7	F282 I350 F352	F282-P406 HydrophobicContact CD1-CG 4.44Å; F282-P406 HydrophobicContact CD2-CG 3.47Å; F282-P406 VanDerWaalsContact CD2-CG 3.47Å; F282-P406 HydrophobicContact CE1-CG 4.46Å; F282-P406 HydrophobicContact CE2-CG 3.51Å; F282-P406 HydrophobicContact CG-CG 3.98Å; F282-P406 HydrophobicContact CZ-CG 4.02Å; I350-P406 HydrophobicContact CG2-CB 3.9Å; F352-P406 HydrophobicContact CD1-CB 3.94Å; F352-P406 HydrophobicContact CE1-CB 3.71Å
407	T	77.8	Confident	81.8	Confident	32 Å²	32	37.4 Å²	37.4	20%	0.196	18%	0.181	C	C	.	.	S	Bend	trans	-92.5	-28	-176.4	40.4	0	0	0	0	113.9	L278 F282 L333 N405	L278-T407 VanDerWaalsContact CD1-OG1 3.24Å; L278-T407 WeakPolarHBondContact CD1-OG1 3.46Å; L278-T407 HydrophobicContact CD2-CG2 4.08Å; L278-T407 VanDerWaalsContact CD2-OG1 3.25Å; L278-T407 WeakPolarHBondContact CD2-OG1 3.26Å; F282-T407 HydrophobicContact CE2-CG2 4.05Å; F282-T407 HydrophobicContact CZ-CG2 4.21Å; L333-T407 HydrophobicContact CD1-CG2 4.4Å; N405-T407 VanDerWaalsContact C-N 3.27Å; N405-T407 PolarHBondContact O-N 3.21Å; N405-T407 PolarHBondContact OD1-N 3.42Å; N405-T407 VanDerWaalsContact OD1-N 3.14Å; N405-T407 PolarHBondContact OD1-OG1 3.38Å
408	W	79.4	Confident	81.9	Confident	146 Å²	146	36.5 Å²	36.5	55%	0.553	18%	0.177	S	C	*	.	S	Bend	trans	-137.6	132.6	179.8	-65.6	105.5	0	0	0	110.7	V331 N405	V331-W408 HydrophobicContact CG2-CH2 4.28Å; N405-W408 VanDerWaalsContact CG-O 3.3Å; N405-W408 PolarHBondContact OD1-N 3.17Å; N405-W408 PolarHBondContact OD1-O 3.43Å
409	P	80.6	Confident	81.9	Confident	22 Å²	22	36.5 Å²	36.5	14%	0.143	18%	0.177	C	C	.	.			trans	-69.2	141.4	174.8	30.6	-34.8	0	0	0	110.6	C399 C400 W401 R411 I412	C399-P409 HydrophobicContact CB-CB 3.78Å; C399-P409 HydrophobicContact CB-CG 4.17Å; C400-P409 CarbonylContact O-C 3.6Å; W401-P409 HydrophobicContact CD2-CB 3.92Å; W401-P409 HydrophobicContact CE3-CB 4.04Å; W401-P409 HydrophobicContact CG-CB 4.34Å; W401-P409 HydrophobicContact CH2-CG 4.4Å; W401-P409 HydrophobicContact CZ2-CB 4.46Å; W401-P409 HydrophobicContact CZ2-CG 4.46Å; W401-P409 HydrophobicContact CZ3-CB 4.38Å; W401-P409 HydrophobicContact CZ3-CG 4.49Å; P409-R411 VanDerWaalsContact C-N 3.31Å; P409-R411 PolarHBondContact O-N 2.95Å; P409-I412 HydrophobicContact CB-CG1 4.4Å; P409-I412 HydrophobicContact CG-CD1 3.81Å; P409-I412 HydrophobicContact CG-CG1 3.61Å
410	E	79.1	Confident	82	Confident	83 Å²	83	37 Å²	37	39%	0.388	18%	0.18	S	C	.	.	S	Bend	trans	-72	-25.8	-178.5	176.8	162.4	-160.8	0	0	112.6	R275 C400	R275-E410 IonicContact CZ-OE1 3.42Å; R275-E410 IonicContact CZ-OE2 2.67Å; R275-E410 IonicContact NH1-OE1 3.59Å; R275-E410 IonicContact NH2-OE1 3.97Å; R275-E410 PolarHBondContact NH2-OE1 3.13Å; R275-E410 IonicContact NH2-OE2 3.94Å; R275-E410 PolarHBondContact NH2-OE2 3.39Å; C400-E410 PolarHBondContact O-N 2.83Å
411	R	79.4	Confident	82.1	Confident	51 Å²	51	37 Å²	37	19%	0.192	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	145	168.7	-64.3	-70.2	-157.6	131.8	1.8	110.4	C399 C400 P409 M446 S448 N451	C399-R411 WeakPolarHBondContact CA-O 3.45Å; C400-R411 HydrophobicContact CB-CB 4.11Å; C400-R411 PolarHBondContact N-O 2.9Å; C400-R411 PolarHBondContact O-N 2.84Å; P409-R411 VanDerWaalsContact C-N 3.31Å; P409-R411 PolarHBondContact O-N 2.95Å; R411-M446 HydrophobicContact CB-CE 3.92Å; R411-M446 HydrophobicContact CG-CE 3.74Å; R411-M446 PolarHBondContact NH2-O 3.3Å; R411-S448 VanDerWaalsContact CZ-O 3.29Å; R411-S448 PolarHBondContact NH1-O 3.16Å; R411-S448 PolarHBondContact NH2-O 2.83Å; R411-N451 PolarHBondContact NH1-OD1 2.85Å
412	I	83.9	Confident	82.3	Confident	69 Å²	69	37 Å²	37	35%	0.354	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.1	166.4	-55.8	179.8	0	0	0	106.9	L397 P409	L397-I412 HydrophobicContact CD1-CG2 3.56Å; L397-I412 HydrophobicContact CD2-CG2 4.1Å; L397-I412 HydrophobicContact CG-CG2 3.88Å; P409-I412 HydrophobicContact CB-CG1 4.4Å; P409-I412 HydrophobicContact CG-CD1 3.81Å; P409-I412 HydrophobicContact CG-CG1 3.61Å
413	I	83.7	Confident	82.5	Confident	5 Å²	5	37.1 Å²	37.1	3%	0.026	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.6	177.6	-57.9	171.4	0	0	0	107.1	V398 L432 H444 M446	V398-I413 HydrophobicContact CB-CB 4.26Å; V398-I413 PolarHBondContact N-O 3.09Å; V398-I413 PolarHBondContact O-N 3Å; I413-L432 HydrophobicContact CD1-CD2 4.42Å; I413-H444 HydrophobicContact CD1-CB 4Å; I413-H444 WeakPolarHBondContact CG2-CE1 3.4Å; I413-H444 WeakPolarHBondContact CG2-ND1 3.22Å; I413-M446 HydrophobicContact CD1-CE 4.38Å; I413-M446 HydrophobicContact CD1-SD 3.92Å
414	N	86.1	Confident	82.9	Confident	112 Å²	112	36.9 Å²	36.9	60%	0.599	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	136.3	177.3	-63.1	0.6	0	0	0	109.6	L397	L397-N414 WeakPolarHBondContact CD1-OD1 3.38Å
415	C	84.4	Confident	83.1	Confident	4 Å²	4	33 Å²	33	3%	0.027	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.8	175.7	-58.9	0	0	0	0	109.7	P395 G396 S417 V419 M436	P395-C415 CarbonylContact C-O 3.54Å; P395-C415 WeakPolarHBondContact CA-O 3.37Å; P395-C415 WeakPolarHBondContact CB-O 3.31Å; G396-C415 PolarHBondContact N-O 2.85Å; G396-C415 PolarHBondContact O-N 2.9Å; C415-S417 PolarHBondContact O-N 3.26Å; C415-V419 HydrophobicContact CB-CG2 4.2Å; C415-M436 HydrophobicContact CB-CE 3.95Å; C415-M436 HydrophobicContact CB-SD 4.45Å
416	D	83.7	Confident	83.3	Confident	118 Å²	118	35.5 Å²	35.5	63%	0.631	18%	0.181	S	C	*	.	S	Bend	trans	-71.1	1.1	-177	-35.7	-114.6	0	0	0	114	R459	D416-R459 VanDerWaalsContact CG-NH1 3.26Å; D416-R459 IonicContact OD1-NH1 3.28Å; D416-R459 IonicContact OD2-CZ 3.58Å; D416-R459 IonicContact OD2-NH1 3.13Å; D416-R459 PolarHBondContact OD2-NH1 2.66Å; D416-R459 IonicContact OD2-NH2 2.7Å; D416-R459 PolarHBondContact OD2-NH2 3.13Å
417	S	86.2	Confident	83.5	Confident	9 Å²	9	39.6 Å²	39.6	6%	0.063	20%	0.202	C	C	.	.	S	Bend	trans	-149.7	147	179.1	174.5	0	0	0	0	108.7	G394 G396 C415 V419 C437 D438	G394-S417 CarbonylContact O-C 3.5Å; G396-S417 WeakPolarHBondContact CA-O 3.45Å; G396-S417 PolarHBondContact N-O 3.01Å; C415-S417 PolarHBondContact O-N 3.26Å; S417-V419 PolarHBondContact O-N 2.75Å; S417-C437 PolarHBondContact OG-SG 2.84Å; S417-D438 PolarHBondContact OG-N 2.83Å
418	A	84.8	Confident	83.7	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.025	20%	0.204	C	C	.	.			trans	-48.8	132.3	178	0	0	0	0	0	112.3	G394 M436 C437	G394-A418 PolarHBondContact O-N 2.87Å; A418-M436 WeakPolarHBondContact O-CA 3.4Å; A418-C437 HydrophobicContact CB-CB 4.35Å; A418-C437 PolarHBondContact O-N 2.83Å
419	V	86.2	Confident	83.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	135.9	-179.9	178	0	0	0	0	109.4	V362 Y385 V398 C415 S417 V422 V434	V362-V419 WeakPolarHBondContact CB-O 3.36Å; V362-V419 WeakPolarHBondContact CG1-O 3.14Å; Y385-V419 PolarHBondContact O-N 2.9Å; V398-V419 HydrophobicContact CG2-CG1 4.26Å; V398-V419 HydrophobicContact CG2-CG2 3.7Å; C415-V419 HydrophobicContact CB-CG2 4.2Å; S417-V419 PolarHBondContact O-N 2.75Å; V419-V422 HydrophobicContact CG1-CG1 3.63Å; V419-V434 HydrophobicContact CG1-CG1 4.06Å; V419-V434 HydrophobicContact CG2-CG1 4.11Å
420	T	85.4	Confident	83.2	Confident	10 Å²	10	33.1 Å²	33.1	6%	0.061	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	0.7	-179.8	60	0	0	0	0	114	V362 L363 G435 M436 C437 V469	V362-T420 HydrophobicContact CG1-CG2 4.42Å; L363-T420 CarbonylContact O-C 3.57Å; T420-G435 PolarHBondContact N-O 2.73Å; T420-M436 VanDerWaalsContact OG1-C 3.31Å; T420-M436 PolarHBondContact OG1-O 3.3Å; T420-C437 HydrophobicContact CG2-CB 3.67Å; T420-V469 WeakPolarHBondContact CB-O 3.36Å; T420-V469 PolarHBondContact OG1-O 3.02Å
421	T	85.8	Confident	83.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	148.1	166.7	-180	0	0	0	0	111	L363 V434 G435 V469 L472	L363-T421 WeakPolarHBondContact O-CA 3.01Å; L363-T421 PolarHBondContact O-N 2.9Å; T421-V434 CarbonylContact O-C 3.52Å; T421-V434 WeakPolarHBondContact O-CA 3.35Å; T421-G435 PolarHBondContact N-O 2.97Å; T421-G435 PolarHBondContact O-N 3.43Å; T421-V469 HydrophobicContact CG2-CB 4.18Å; T421-V469 HydrophobicContact CG2-CG1 3.84Å; T421-V469 WeakPolarHBondContact CG2-O 2.98Å; T421-L472 HydrophobicContact CG2-CB 3.37Å; T421-L472 HydrophobicContact CG2-CD1 4.4Å; T421-L472 HydrophobicContact CG2-CG 4.44Å; T421-L472 PolarHBondContact OG1-N 3.39Å; T421-L472 VanDerWaalsContact OG1-N 3.11Å
422	V	88.1	Confident	83.9	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	142.6	170.6	-51.9	0	0	0	0	111.6	P364 A382 V398 V419 L432 A433 V434	P364-V422 WeakPolarHBondContact CB-O 3.23Å; P364-V422 HydrophobicContact CG-CB 4.21Å; P364-V422 HydrophobicContact CG-CG2 3.6Å; P364-V422 VanDerWaalsContact CG-O 3.27Å; P364-V422 WeakPolarHBondContact CG-O 3.22Å; A382-V422 HydrophobicContact CB-CG2 4.38Å; V398-V422 HydrophobicContact CG1-CG1 4.37Å; V398-V422 HydrophobicContact CG2-CG1 4.05Å; V419-V422 HydrophobicContact CG1-CG1 3.63Å; V422-L432 HydrophobicContact CB-CD1 4.15Å; V422-L432 HydrophobicContact CG2-CD1 4.39Å; V422-A433 CarbonylContact C-O 3.49Å; V422-A433 WeakPolarHBondContact CA-O 3.36Å; V422-V434 HydrophobicContact CG1-CB 4.3Å; V422-V434 HydrophobicContact CG1-CG1 4.09Å; V422-V434 HydrophobicContact CG1-CG2 3.96Å
423	D	85.8	Confident	84.2	Confident	6 Å²	6	26 Å²	26	3%	0.032	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	145.5	177.4	-169.4	32.5	0	0	0	113.3	A433 L472 R473 W474	D423-A433 PolarHBondContact N-O 3.13Å; D423-A433 PolarHBondContact O-N 3.28Å; D423-L472 HydrophobicContact CB-CD2 3.81Å; D423-L472 WeakPolarHBondContact CB-O 3.36Å; D423-R473 VanDerWaalsContact OD2-CA 3.3Å; D423-R473 WeakPolarHBondContact OD2-CA 3.44Å; D423-W474 PolarHBondContact O-NE1 2.86Å; D423-W474 PolarHBondContact OD2-N 2.91Å
424	F	86.4	Confident	84.5	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.018	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.5	-178.9	-83.6	-70	0	0	0	111.8	S372 L380 A382 L432 M446	S372-F424 WeakPolarHBondContact O-CE2 3.33Å; S372-F424 WeakPolarHBondContact OG-CD2 3.35Å; L380-F424 HydrophobicContact CD2-CZ 4.24Å; A382-F424 HydrophobicContact CB-CE2 3.53Å; A382-F424 HydrophobicContact CB-CZ 3.8Å; F424-L432 HydrophobicContact CD1-CB 4.18Å; F424-L432 HydrophobicContact CD1-CD1 3.99Å; F424-L432 HydrophobicContact CD2-CD1 4.13Å; F424-L432 HydrophobicContact CE1-CB 3.95Å; F424-L432 HydrophobicContact CE1-CD1 3.95Å; F424-L432 HydrophobicContact CE1-CG 4.38Å; F424-L432 HydrophobicContact CE2-CD1 4.09Å; F424-L432 HydrophobicContact CG-CD1 4.08Å; F424-L432 HydrophobicContact CZ-CD1 4Å; F424-L432 HydrophobicContact CZ-CD2 4.45Å; F424-M446 HydrophobicContact CE1-CG 4.09Å
425	S	84.9	Confident	84.7	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.007	12%	0.12	C	C	.	.			trans	-65.7	134.5	168.4	165.4	0	0	0	0	110.1	S428 P429 Q431 E488	S425-S428 WeakPolarHBondContact CB-O 3.26Å; S425-S428 WeakPolarHBondContact CB-OG 3.21Å; S425-S428 CarbonylContact O-C 3.6Å; S425-S428 PolarHBondContact OG-N 2.73Å; S425-S428 PolarHBondContact OG-OG 2.76Å; S425-P429 VanDerWaalsContact O-CA 3.31Å; S425-P429 WeakPolarHBondContact O-CA 3.41Å; S425-Q431 PolarHBondContact N-O 2.9Å; S425-E488 WeakPolarHBondContact CA-OE2 3.39Å; S425-E488 WeakPolarHBondContact CB-OE2 3.49Å; S425-E488 PolarHBondContact OG-OE2 2.87Å
426	S	81.1	Confident	84.9	Confident	65 Å²	65	20.4 Å²	20.4	46%	0.455	12%	0.12	S	C	.	.	S	Bend	trans	-90.9	-20.8	-179.6	-64.7	0	0	0	0	113.5	E488	S426-E488 WeakPolarHBondContact CA-OE1 3.28Å; S426-E488 VanDerWaalsContact CB-OE1 3.29Å; S426-E488 WeakPolarHBondContact CB-OE1 3.31Å; S426-E488 PolarHBondContact N-OE1 2.54Å; S426-E488 PolarHBondContact N-OE2 3.14Å
427	I	80.9	Confident	85.1	Confident	90 Å²	90	15.9 Å²	15.9	46%	0.462	10%	0.097	S	C	.	.	S	Bend	trans	-81.6	-31.9	166.5	-74.4	173.3	0	0	0	111.1	Q476 K486 E488	I427-Q476 HydrophobicContact CD1-CG 4.09Å; I427-Q476 HydrophobicContact CG1-CG 4.35Å; I427-K486 HydrophobicContact CD1-CB 4.46Å; I427-E488 HydrophobicContact CD1-CB 4.05Å; I427-E488 HydrophobicContact CD1-CG 4.24Å; I427-E488 HydrophobicContact CG1-CG 4.48Å; I427-E488 WeakPolarHBondContact CG1-OE1 3.5Å; I427-E488 VanDerWaalsContact N-CD 3.29Å; I427-E488 PolarHBondContact N-OE1 2.92Å; I427-E488 PolarHBondContact N-OE2 2.8Å
428	S	81.2	Confident	85.1	Confident	36 Å²	36	17.9 Å²	17.9	25%	0.252	11%	0.107	S	C	.	.			trans	-133.5	76.1	-177.5	63.8	0	0	0	0	112.2	S425 G430 Q431	S425-S428 WeakPolarHBondContact CB-O 3.26Å; S425-S428 WeakPolarHBondContact CB-OG 3.21Å; S425-S428 CarbonylContact O-C 3.6Å; S425-S428 PolarHBondContact OG-N 2.73Å; S425-S428 PolarHBondContact OG-OG 2.76Å; S428-G430 PolarHBondContact O-N 3.27Å; S428-Q431 PolarHBondContact O-N 2.81Å; S428-Q431 PolarHBondContact OG-NE2 2.83Å
429	P	72.7	Confident	85.2	Confident	17 Å²	17	17.8 Å²	17.8	11%	0.11	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-0.8	-176.3	21.5	-31.6	0	0	0	115.6	D376 S425 Q431	D376-P429 HydrophobicContact CB-CB 4.33Å; D376-P429 HydrophobicContact CB-CG 3.91Å; D376-P429 VanDerWaalsContact CG-CG 3.42Å; D376-P429 VanDerWaalsContact OD2-CG 3.27Å; D376-P429 WeakPolarHBondContact OD2-CG 3.27Å; S425-P429 VanDerWaalsContact O-CA 3.31Å; S425-P429 WeakPolarHBondContact O-CA 3.41Å; P429-Q431 VanDerWaalsContact C-N 3.34Å
430	G	77.1	Confident	85.4	Confident	12 Å²	12	17.8 Å²	17.8	12%	0.124	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-7.7	162.7	0	0	0	0	0	114.8	S428 N445 M446	S428-G430 PolarHBondContact O-N 3.27Å; G430-N445 CarbonylContact O-C 3.58Å; G430-N445 WeakPolarHBondContact O-CA 3.35Å; G430-N445 PolarHBondContact O-OD1 2.98Å; G430-M446 WeakPolarHBondContact O-CB 3.31Å; G430-M446 PolarHBondContact O-N 2.87Å
431	Q	85.6	Confident	85.7	Confident	53 Å²	53	17.3 Å²	17.3	25%	0.248	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.1	178.8	-61.8	-168.3	59.1	0	0	111.2	S425 S428 P429 I443	S425-Q431 PolarHBondContact N-O 2.9Å; S428-Q431 PolarHBondContact O-N 2.81Å; S428-Q431 PolarHBondContact OG-NE2 2.83Å; P429-Q431 VanDerWaalsContact C-N 3.34Å; Q431-I443 HydrophobicContact CB-CG2 4.32Å
432	L	87.9	Confident	86	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	120.4	173.5	-179.6	62.4	0	0	0	108.5	A382 V398 I413 V422 F424 V434 H444 M446	A382-L432 HydrophobicContact CB-CD1 4.1Å; A382-L432 HydrophobicContact CB-CD2 3.98Å; V398-L432 HydrophobicContact CG1-CD2 3.95Å; I413-L432 HydrophobicContact CD1-CD2 4.42Å; V422-L432 HydrophobicContact CB-CD1 4.15Å; V422-L432 HydrophobicContact CG2-CD1 4.39Å; F424-L432 HydrophobicContact CD1-CB 4.18Å; F424-L432 HydrophobicContact CD1-CD1 3.99Å; F424-L432 HydrophobicContact CD2-CD1 4.13Å; F424-L432 HydrophobicContact CE1-CB 3.95Å; F424-L432 HydrophobicContact CE1-CD1 3.95Å; F424-L432 HydrophobicContact CE1-CG 4.38Å; F424-L432 HydrophobicContact CE2-CD1 4.09Å; F424-L432 HydrophobicContact CG-CD1 4.08Å; F424-L432 HydrophobicContact CZ-CD1 4Å; F424-L432 HydrophobicContact CZ-CD2 4.45Å; L432-V434 HydrophobicContact CG-CG2 4.32Å; L432-H444 PolarHBondContact N-O 2.95Å; L432-H444 PolarHBondContact O-N 2.85Å; L432-M446 HydrophobicContact CB-CG 4.12Å; L432-M446 HydrophobicContact CB-SD 3.86Å; L432-M446 HydrophobicContact CD2-SD 3.94Å
433	A	90.3	Very high	86	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	143.9	174	0	0	0	0	0	110	V422 D423 A442 I443 L472 W474 L490	V422-A433 CarbonylContact C-O 3.49Å; V422-A433 WeakPolarHBondContact CA-O 3.36Å; D423-A433 PolarHBondContact N-O 3.13Å; D423-A433 PolarHBondContact O-N 3.28Å; A433-A442 CarbonylContact C-O 3.49Å; A433-A442 WeakPolarHBondContact CA-O 3.39Å; A433-I443 HydrophobicContact CB-CG1 4.17Å; A433-L472 HydrophobicContact CB-CD1 4.37Å; A433-L472 HydrophobicContact CB-CD2 3.71Å; A433-W474 HydrophobicContact CB-CZ2 3.95Å; A433-L490 HydrophobicContact CB-CD1 4Å; A433-L490 HydrophobicContact CB-CD2 3.88Å
434	V	90.4	Very high	86.1	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	121.4	-168.8	179.4	0	0	0	0	108.8	V398 V419 T421 V422 L432 M436 I441 A442	V398-V434 HydrophobicContact CG2-CG1 4.08Å; V398-V434 HydrophobicContact CG2-CG2 4.16Å; V419-V434 HydrophobicContact CG1-CG1 4.06Å; V419-V434 HydrophobicContact CG2-CG1 4.11Å; T421-V434 CarbonylContact O-C 3.52Å; T421-V434 WeakPolarHBondContact O-CA 3.35Å; V422-V434 HydrophobicContact CG1-CB 4.3Å; V422-V434 HydrophobicContact CG1-CG1 4.09Å; V422-V434 HydrophobicContact CG1-CG2 3.96Å; L432-V434 HydrophobicContact CG-CG2 4.32Å; V434-M436 HydrophobicContact CG1-CE 4.35Å; V434-I441 CarbonylContact O-C 3.5Å; V434-I441 VanDerWaalsContact O-CA 3.28Å; V434-I441 WeakPolarHBondContact O-CA 3.48Å; V434-A442 PolarHBondContact N-O 2.64Å; V434-A442 PolarHBondContact O-N 3.3Å
435	G	89.9	Confident	86	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	147.4	171.1	0	0	0	0	0	111.6	T420 T421 S440	T420-G435 PolarHBondContact N-O 2.73Å; T421-G435 PolarHBondContact N-O 2.97Å; T421-G435 PolarHBondContact O-N 3.43Å; G435-S440 WeakPolarHBondContact CA-O 3.17Å
436	M	88.9	Confident	85.7	Confident	4 Å²	4	20.7 Å²	20.7	2%	0.02	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	158.7	-171	-57.5	176.7	-169.7	0	0	112	C415 A418 T420 V434 D438 G439 S440 A442 R459 V469	C415-M436 HydrophobicContact CB-CE 3.95Å; C415-M436 HydrophobicContact CB-SD 4.45Å; A418-M436 WeakPolarHBondContact O-CA 3.4Å; T420-M436 VanDerWaalsContact OG1-C 3.31Å; T420-M436 PolarHBondContact OG1-O 3.3Å; V434-M436 HydrophobicContact CG1-CE 4.35Å; M436-D438 PolarHBondContact O-N 3.17Å; M436-G439 PolarHBondContact O-N 2.94Å; M436-G439 VanDerWaalsContact O-N 3.07Å; M436-S440 PolarHBondContact N-O 2.68Å; M436-A442 HydrophobicContact CE-CB 3.72Å; M436-R459 PolarHBondContact SD-NH2 2.88Å; M436-V469 PolarHBondContact O-N 3.35Å
437	C	86.6	Confident	85.4	Confident	23 Å²	23	25 Å²	25	16%	0.155	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.5	-179	84.4	0	0	0	0	113.7	S417 A418 T420 G439 P468	S417-C437 PolarHBondContact OG-SG 2.84Å; A418-C437 HydrophobicContact CB-CB 4.35Å; A418-C437 PolarHBondContact O-N 2.83Å; T420-C437 HydrophobicContact CG2-CB 3.67Å; C437-G439 PolarHBondContact O-N 3.05Å; C437-P468 HydrophobicContact CB-CG 4.41Å; C437-P468 WeakPolarHBondContact O-CA 3.19Å; C437-P468 WeakPolarHBondContact O-CD 3.25Å; C437-P468 WeakPolarHBondContact O-CG 3.28Å
438	D	86.8	Confident	84.9	Confident	51 Å²	51	22.8 Å²	22.8	27%	0.273	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	0.4	174.7	90	-42.4	0	0	0	114.1	S417 M436 S440 R464	S417-D438 PolarHBondContact OG-N 2.83Å; M436-D438 PolarHBondContact O-N 3.17Å; D438-S440 WeakPolarHBondContact OD1-CA 3.19Å; D438-S440 WeakPolarHBondContact OD1-CB 3.04Å; D438-S440 PolarHBondContact OD1-N 3.11Å; D438-S440 PolarHBondContact OD1-OG 2.94Å; D438-S440 PolarHBondContact OD2-OG 3.02Å; D438-R464 PolarHBondContact O-NH2 2.98Å; D438-R464 IonicContact OD2-CZ 3.71Å; D438-R464 VanDerWaalsContact OD2-CZ 3.31Å; D438-R464 IonicContact OD2-NH1 3.24Å; D438-R464 PolarHBondContact OD2-NH1 2.81Å; D438-R464 IonicContact OD2-NH2 2.75Å; D438-R464 PolarHBondContact OD2-NH2 2.94Å
439	G	87.4	Confident	84	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	87.3	-1	-175.7	0	0	0	0	0	114.7	M436 C437 R464 G467	M436-G439 PolarHBondContact O-N 2.94Å; M436-G439 VanDerWaalsContact O-N 3.07Å; C437-G439 PolarHBondContact O-N 3.05Å; G439-R464 WeakPolarHBondContact O-CG 3.46Å; G439-G467 WeakPolarHBondContact CA-O 3.34Å; G439-G467 PolarHBondContact N-O 3.25Å
440	S	90.5	Very high	83.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.166	C	C	.	.			trans	-70.5	150.3	173.4	-58.2	0	0	0	0	112.6	G435 M436 D438 R459 R464	G435-S440 WeakPolarHBondContact CA-O 3.17Å; M436-S440 PolarHBondContact N-O 2.68Å; D438-S440 WeakPolarHBondContact OD1-CA 3.19Å; D438-S440 WeakPolarHBondContact OD1-CB 3.04Å; D438-S440 PolarHBondContact OD1-N 3.11Å; D438-S440 PolarHBondContact OD1-OG 2.94Å; D438-S440 PolarHBondContact OD2-OG 3.02Å; S440-R459 VanDerWaalsContact OG-CG 3.31Å; S440-R459 WeakPolarHBondContact OG-CG 3.39Å; S440-R464 PolarHBondContact OG-NH1 3.11Å
441	I	92	Very high	82.8	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.5	164	-66.8	170.8	0	0	0	108	V434 S458 V469 L472 L490 W502 L509	V434-I441 CarbonylContact O-C 3.5Å; V434-I441 VanDerWaalsContact O-CA 3.28Å; V434-I441 WeakPolarHBondContact O-CA 3.48Å; I441-S458 PolarHBondContact N-OG 3.11Å; I441-S458 WeakPolarHBondContact O-CB 3.5Å; I441-S458 PolarHBondContact O-N 3.28Å; I441-S458 PolarHBondContact O-OG 3.44Å; I441-V469 HydrophobicContact CD1-CG1 4.32Å; I441-V469 HydrophobicContact CD1-CG2 4.45Å; I441-V469 HydrophobicContact CG1-CG1 4.49Å; I441-V469 HydrophobicContact CG1-CG2 4.12Å; I441-L472 HydrophobicContact CB-CD1 4.31Å; I441-L472 HydrophobicContact CD1-CD1 3.85Å; I441-L472 HydrophobicContact CG1-CD1 3.79Å; I441-L472 HydrophobicContact CG2-CD1 3.62Å; I441-L490 HydrophobicContact CG2-CD2 4Å; I441-W502 HydrophobicContact CD1-CD2 4.2Å; I441-W502 HydrophobicContact CD1-CG 4.47Å; I441-W502 HydrophobicContact CD1-CZ2 3.79Å; I441-L509 HydrophobicContact CB-CD2 4.28Å; I441-L509 HydrophobicContact CG2-CD2 3.87Å
442	A	90.4	Very high	81.5	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.008	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	148.1	170.9	0	0	0	0	0	109.7	A433 V434 M436 P454 I456	A433-A442 CarbonylContact C-O 3.49Å; A433-A442 WeakPolarHBondContact CA-O 3.39Å; V434-A442 PolarHBondContact N-O 2.64Å; V434-A442 PolarHBondContact O-N 3.3Å; M436-A442 HydrophobicContact CE-CB 3.72Å; A442-P454 HydrophobicContact CB-CB 3.87Å; A442-I456 CarbonylContact C-O 3.49Å; A442-I456 WeakPolarHBondContact CA-O 3.26Å
443	I	90.1	Very high	80.3	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.5	167.8	-56.3	176.6	0	0	0	106.6	Q431 A433 F455 I456 W474 L490 L509	Q431-I443 HydrophobicContact CB-CG2 4.32Å; A433-I443 HydrophobicContact CB-CG1 4.17Å; I443-F455 WeakPolarHBondContact O-CA 3.31Å; I443-F455 WeakPolarHBondContact O-CB 3.37Å; I443-F455 PolarHBondContact O-N 2.95Å; I443-I456 HydrophobicContact CB-CB 4.48Å; I443-I456 PolarHBondContact N-O 3.07Å; I443-I456 PolarHBondContact O-N 2.96Å; I443-I456 VanDerWaalsContact O-N 3.1Å; I443-W474 HydrophobicContact CD1-CH2 3.99Å; I443-W474 HydrophobicContact CD1-CZ2 4.09Å; I443-L490 HydrophobicContact CD1-CD2 4.17Å; I443-L490 HydrophobicContact CG1-CD2 4.37Å; I443-L509 HydrophobicContact CD1-CD1 3.75Å
444	H	87.3	Confident	79.3	Confident	12 Å²	12	42.8 Å²	42.8	6%	0.056	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.4	179.2	-67.5	-96.5	0	0	0	109.8	I413 L432 P454	I413-H444 HydrophobicContact CD1-CB 4Å; I413-H444 WeakPolarHBondContact CG2-CE1 3.4Å; I413-H444 WeakPolarHBondContact CG2-ND1 3.22Å; L432-H444 PolarHBondContact N-O 2.95Å; L432-H444 PolarHBondContact O-N 2.85Å; H444-P454 VanDerWaalsContact CE1-CA 3.5Å; H444-P454 WeakPolarHBondContact CE1-CA 3.29Å
445	N	83.7	Confident	78.4	Confident	44 Å²	44	48.4 Å²	48.4	24%	0.235	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.4	175.5	-174.9	-16.8	0	0	0	109.7	G430 Q447 S448 F455	G430-N445 CarbonylContact O-C 3.58Å; G430-N445 WeakPolarHBondContact O-CA 3.35Å; G430-N445 PolarHBondContact O-OD1 2.98Å; N445-Q447 PolarHBondContact O-N 3.45Å; N445-Q447 VanDerWaalsContact O-N 3.13Å; N445-Q447 VanDerWaalsContact OD1-CB 3.28Å; N445-Q447 WeakPolarHBondContact OD1-CB 3.29Å; N445-Q447 PolarHBondContact OD1-N 3.43Å; N445-S448 PolarHBondContact O-N 2.85Å; N445-S448 PolarHBondContact O-OG 2.97Å; N445-F455 HydrophobicContact CB-CB 4.28Å; N445-F455 HydrophobicContact CB-CG 4.33Å
446	M	78.3	Confident	78	Confident	26 Å²	26	49.1 Å²	49.1	13%	0.128	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-5.5	179.7	-56.2	-49.8	-60.8	0	0	113.6	C400 R411 I413 F424 G430 L432	C400-M446 HydrophobicContact CB-CE 4.02Å; C400-M446 WeakPolarHBondContact SG-CE 3.14Å; R411-M446 HydrophobicContact CB-CE 3.92Å; R411-M446 HydrophobicContact CG-CE 3.74Å; R411-M446 PolarHBondContact NH2-O 3.3Å; I413-M446 HydrophobicContact CD1-CE 4.38Å; I413-M446 HydrophobicContact CD1-SD 3.92Å; F424-M446 HydrophobicContact CE1-CG 4.09Å; G430-M446 WeakPolarHBondContact O-CB 3.31Å; G430-M446 PolarHBondContact O-N 2.87Å; L432-M446 HydrophobicContact CB-CG 4.12Å; L432-M446 HydrophobicContact CB-SD 3.86Å; L432-M446 HydrophobicContact CD2-SD 3.94Å
447	Q	74.7	Confident	77.8	Confident	154 Å²	154	50.4 Å²	50.4	72%	0.72	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-24.1	175.8	-53.6	-178.8	1.6	0	0	113.1	N445	N445-Q447 PolarHBondContact O-N 3.45Å; N445-Q447 VanDerWaalsContact O-N 3.13Å; N445-Q447 VanDerWaalsContact OD1-CB 3.28Å; N445-Q447 WeakPolarHBondContact OD1-CB 3.29Å; N445-Q447 PolarHBondContact OD1-N 3.43Å
448	S	71.3	Confident	77.8	Confident	45 Å²	45	49.3 Å²	49.3	32%	0.315	27%	0.27	S	S	.	.	S	Bend	trans	-71	145.2	178.4	47.4	0	0	0	0	111.7	R411 N445	R411-S448 VanDerWaalsContact CZ-O 3.29Å; R411-S448 PolarHBondContact NH1-O 3.16Å; R411-S448 PolarHBondContact NH2-O 2.83Å; N445-S448 PolarHBondContact O-N 2.85Å; N445-S448 PolarHBondContact O-OG 2.97Å
449	A	62.1	Low	77.6	Confident	96 Å²	96	51.2 Å²	51.2	79%	0.793	27%	0.273	S	S	*	.	S	Bend	trans	-79.1	-20.4	-179.7	0	0	0	0	0	113.7
450	D	63.2	Low	77.1	Confident	75 Å²	75	60.5 Å²	60.5	40%	0.401	32%	0.317	S	S	.	.			trans	-77	124.6	171.2	-174	25.3	0	0	0	110.5	K452 S453	D450-K452 VanDerWaalsContact OD1-CB 3.31Å; D450-K452 WeakPolarHBondContact OD1-CB 3.24Å; D450-K452 PolarHBondContact OD1-N 3.14Å; D450-S453 PolarHBondContact OD2-N 3.18Å; D450-S453 PolarHBondContact OD2-OG 2.85Å
451	N	61.7	Low	76.7	Confident	64 Å²	64	61.2 Å²	61.2	34%	0.342	32%	0.322	S	S	.	.			trans	-101.8	-3.9	173.8	-65.9	-40.9	0	0	0	112.3	R411	R411-N451 PolarHBondContact NH1-OD1 2.85Å
452	K	58.4	Low	76.1	Confident	194 Å²	194	66.6 Å²	66.6	84%	0.843	37%	0.366	S	S	*	.	S	Bend	trans	-93	-21.1	-170	-61.9	178.9	179.8	175.3	0	114.1	D450	D450-K452 VanDerWaalsContact OD1-CB 3.31Å; D450-K452 WeakPolarHBondContact OD1-CB 3.24Å; D450-K452 PolarHBondContact OD1-N 3.14Å
453	S	61.7	Low	75.8	Confident	62 Å²	62	70.5 Å²	70.5	43%	0.434	38%	0.383	S	S	.	.	S	Bend	trans	-116.3	141.6	178.9	60.3	0	0	0	0	111.5	D450	D450-S453 PolarHBondContact OD2-N 3.18Å; D450-S453 PolarHBondContact OD2-OG 2.85Å
454	P	69.4	Low	75.7	Confident	46 Å²	46	73.6 Å²	73.6	30%	0.299	39%	0.394	S	S	.	.			trans	-68.6	142.6	163.7	31.1	-33.7	0	0	0	109.4	A442 H444 I456	A442-P454 HydrophobicContact CB-CB 3.87Å; H444-P454 VanDerWaalsContact CE1-CA 3.5Å; H444-P454 WeakPolarHBondContact CE1-CA 3.29Å; P454-I456 VanDerWaalsContact C-N 3.3Å; P454-I456 PolarHBondContact O-N 2.94Å
455	F	72.9	Confident	75.9	Confident	119 Å²	119	73.1 Å²	73.1	52%	0.522	39%	0.392	S	S	.	.	S	Bend	trans	-65.3	-38.1	176.7	173.6	-112	0	0	0	110.8	I443 N445	I443-F455 WeakPolarHBondContact O-CA 3.31Å; I443-F455 WeakPolarHBondContact O-CB 3.37Å; I443-F455 PolarHBondContact O-N 2.95Å; N445-F455 HydrophobicContact CB-CB 4.28Å; N445-F455 HydrophobicContact CB-CG 4.33Å
456	I	81.2	Confident	76.1	Confident	14 Å²	14	78.3 Å²	78.3	7%	0.072	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	144.5	170.3	-56.7	175.9	0	0	0	108.5	A442 I443 P454 V504 L509	A442-I456 CarbonylContact C-O 3.49Å; A442-I456 WeakPolarHBondContact CA-O 3.26Å; I443-I456 HydrophobicContact CB-CB 4.48Å; I443-I456 PolarHBondContact N-O 3.07Å; I443-I456 PolarHBondContact O-N 2.96Å; I443-I456 VanDerWaalsContact O-N 3.1Å; P454-I456 VanDerWaalsContact C-N 3.3Å; P454-I456 PolarHBondContact O-N 2.94Å; I456-V504 HydrophobicContact CD1-CB 4.25Å; I456-V504 HydrophobicContact CD1-CG1 3.67Å; I456-V504 HydrophobicContact CD1-CG2 3.49Å; I456-V504 VanDerWaalsContact CD1-CG2 3.49Å; I456-L509 HydrophobicContact CG2-CB 3.9Å; I456-L509 HydrophobicContact CG2-CD1 4Å
457	S	84.3	Confident	76.5	Confident	32 Å²	32	77.8 Å²	77.8	22%	0.224	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	149.3	174.8	-172.2	0	0	0	0	112.7	R459	S457-R459 PolarHBondContact OG-N 2.98Å
458	S	87.4	Confident	77.2	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	39%	0.394	C	S	.	.	S	Bend	trans	-90.9	5.8	175.9	88	0	0	0	0	114.1	I441 E460 C461	I441-S458 PolarHBondContact N-OG 3.11Å; I441-S458 WeakPolarHBondContact O-CB 3.5Å; I441-S458 PolarHBondContact O-N 3.28Å; I441-S458 PolarHBondContact O-OG 3.44Å; S458-E460 VanDerWaalsContact C-N 3.25Å; S458-E460 PolarHBondContact O-N 2.75Å; S458-C461 WeakPolarHBondContact O-CB 3.21Å; S458-C461 PolarHBondContact O-N 3.43Å
459	R	80.9	Confident	78.1	Confident	90 Å²	90	69.5 Å²	69.5	34%	0.34	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-32.5	-175.8	-78.1	-178.1	-174.9	149.7	11.1	113.9	D416 M436 S440 S457 C461	D416-R459 VanDerWaalsContact CG-NH1 3.26Å; D416-R459 IonicContact OD1-NH1 3.28Å; D416-R459 IonicContact OD2-CZ 3.58Å; D416-R459 IonicContact OD2-NH1 3.13Å; D416-R459 PolarHBondContact OD2-NH1 2.66Å; D416-R459 IonicContact OD2-NH2 2.7Å; D416-R459 PolarHBondContact OD2-NH2 3.13Å; M436-R459 PolarHBondContact SD-NH2 2.88Å; S440-R459 VanDerWaalsContact OG-CG 3.31Å; S440-R459 WeakPolarHBondContact OG-CG 3.39Å; S457-R459 PolarHBondContact OG-N 2.98Å; R459-C461 VanDerWaalsContact C-N 3.32Å
460	E	77.8	Confident	79.4	Confident	196 Å²	196	67.8 Å²	67.8	92%	0.916	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-3.4	178.2	-60.2	179.9	-175.1	0	0	112.5	S458 A462	S458-E460 VanDerWaalsContact C-N 3.25Å; S458-E460 PolarHBondContact O-N 2.75Å; E460-A462 PolarHBondContact O-N 3.29Å
461	C	82.1	Confident	80.7	Confident	15 Å²	15	64.2 Å²	64.2	10%	0.101	33%	0.332	C	S	.	.			trans	-76.1	113.9	177.1	-177.5	0	0	0	0	111.1	S458 R459 K463 R464 W502 L509 D510	S458-C461 WeakPolarHBondContact O-CB 3.21Å; S458-C461 PolarHBondContact O-N 3.43Å; R459-C461 VanDerWaalsContact C-N 3.32Å; C461-K463 PolarHBondContact O-N 2.62Å; C461-K463 PolarHBondContact SG-N 3.26Å; C461-R464 VanDerWaalsContact O-CB 3.3Å; C461-R464 WeakPolarHBondContact O-CB 3.14Å; C461-R464 PolarHBondContact O-N 2.85Å; C461-R464 VanDerWaalsContact O-N 3.13Å; C461-W502 HydrophobicContact CB-CZ3 4.32Å; C461-L509 WeakPolarHBondContact CB-O 3.21Å; C461-D510 PolarHBondContact SG-OD1 3.38Å; C461-D510 VanDerWaalsContact SG-OD1 3.41Å
462	A	79.8	Confident	82.1	Confident	112 Å²	112	61.1 Å²	61.1	93%	0.926	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-11.7	177.1	0	0	0	0	0	115	E460	E460-A462 PolarHBondContact O-N 3.29Å
463	K	84	Confident	83.5	Confident	84 Å²	84	53.4 Å²	53.4	37%	0.365	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	2	-179.9	-55.1	179	-157.8	132	0	114.1	C461 R498 D510 C511	C461-K463 PolarHBondContact O-N 2.62Å; C461-K463 PolarHBondContact SG-N 3.26Å; K463-R498 PolarHBondContact O-NH1 3.29Å; K463-R498 PolarHBondContact O-NH2 2.85Å; K463-R498 VanDerWaalsContact O-NH2 3.12Å; K463-D510 IonicContact NZ-OD1 3.91Å; K463-D510 PolarHBondContact NZ-OD1 2.77Å; K463-D510 IonicContact NZ-OD2 3.99Å; K463-D510 PolarHBondContact NZ-OD2 3.19Å; K463-C511 WeakPolarHBondContact CB-SG 3.48Å; K463-C511 VanDerWaalsContact CD-O 3.22Å; K463-C511 WeakPolarHBondContact CD-O 3.41Å; K463-C511 PolarHBondContact NZ-O 3.49Å
464	R	88.8	Confident	84.8	Confident	66 Å²	66	51.9 Å²	51.9	25%	0.249	27%	0.266	C	S	.	.			trans	-45.2	152.2	-180	-170.1	-176.6	84.7	157.2	7.8	113	D438 G439 S440 C461 R498	D438-R464 PolarHBondContact O-NH2 2.98Å; D438-R464 IonicContact OD2-CZ 3.71Å; D438-R464 VanDerWaalsContact OD2-CZ 3.31Å; D438-R464 IonicContact OD2-NH1 3.24Å; D438-R464 PolarHBondContact OD2-NH1 2.81Å; D438-R464 IonicContact OD2-NH2 2.75Å; D438-R464 PolarHBondContact OD2-NH2 2.94Å; G439-R464 WeakPolarHBondContact O-CG 3.46Å; S440-R464 PolarHBondContact OG-NH1 3.11Å; C461-R464 VanDerWaalsContact O-CB 3.3Å; C461-R464 WeakPolarHBondContact O-CB 3.14Å; C461-R464 PolarHBondContact O-N 2.85Å; C461-R464 VanDerWaalsContact O-N 3.13Å; R464-R498 PolarHBondContact O-NH2 3.34Å
465	H	90.8	Very high	85.7	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	26%	0.259	C	S	.	.			trans	-57.8	145	174.4	-72.2	-74.1	0	0	0	111	G467 V469 S492 D496 R498 C500	H465-G467 VanDerWaalsContact C-N 3.32Å; H465-V469 HydrophobicContact CB-CG2 4.39Å; H465-S492 PolarHBondContact NE2-OG 2.68Å; H465-D496 WeakPolarHBondContact CA-OD2 3.46Å; H465-D496 IonicContact CE1-OD1 2.84Å; H465-D496 IonicContact CG-OD1 2.73Å; H465-D496 IonicContact ND1-OD1 3.23Å; H465-D496 PolarHBondContact ND1-OD1 2.86Å; H465-D496 IonicContact ND1-OD2 2.88Å; H465-R498 PolarHBondContact CE1-O 3.35Å; H465-C500 PolarHBondContact CE1-SG 2.86Å
466	L	88.2	Confident	86.2	Confident	153 Å²	153	48.4 Å²	48.4	80%	0.801	25%	0.249	S	C	*	.	S	Bend	trans	-91.5	7.3	-177.3	-60.5	177.1	0	0	0	113.6	D496	L466-D496 HydrophobicContact CB-CB 4.19Å; L466-D496 PolarHBondContact N-OD2 3.3Å; L466-D496 VanDerWaalsContact N-OD2 3.1Å
467	G	86.3	Confident	85.7	Confident	15 Å²	15	48.8 Å²	48.8	16%	0.155	25%	0.25	C	S	.	.	S	Bend	trans	-170.1	-172	179	0	0	0	0	0	109.8	G439 H465 V469	G439-G467 WeakPolarHBondContact CA-O 3.34Å; G439-G467 PolarHBondContact N-O 3.25Å; H465-G467 VanDerWaalsContact C-N 3.32Å; G467-V469 PolarHBondContact O-N 2.81Å
468	P	88.3	Confident	84.7	Confident	25 Å²	25	52.2 Å²	52.2	16%	0.162	26%	0.263	C	S	.	.			trans	-49.8	137	-171.9	-30.1	34.1	0	0	0	114.6	C437 W470 G494 A495	C437-P468 HydrophobicContact CB-CG 4.41Å; C437-P468 WeakPolarHBondContact O-CA 3.19Å; C437-P468 WeakPolarHBondContact O-CD 3.25Å; C437-P468 WeakPolarHBondContact O-CG 3.28Å; P468-W470 HydrophobicContact CB-CD2 4.33Å; P468-W470 HydrophobicContact CB-CH2 4.25Å; P468-W470 HydrophobicContact CB-CZ2 4.03Å; P468-W470 HydrophobicContact CG-CH2 4.48Å; P468-W470 HydrophobicContact CG-CZ2 4.26Å; P468-W470 PolarHBondContact O-N 2.89Å; P468-G494 WeakPolarHBondContact O-CA 3.41Å; P468-A495 PolarHBondContact O-N 2.68Å
469	V	91.6	Very high	83.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	101.1	167.4	-170.1	0	0	0	0	107.3	T420 T421 M436 I441 H465 G467 Q471 L472	T420-V469 WeakPolarHBondContact CB-O 3.36Å; T420-V469 PolarHBondContact OG1-O 3.02Å; T421-V469 HydrophobicContact CG2-CB 4.18Å; T421-V469 HydrophobicContact CG2-CG1 3.84Å; T421-V469 WeakPolarHBondContact CG2-O 2.98Å; M436-V469 PolarHBondContact O-N 3.35Å; I441-V469 HydrophobicContact CD1-CG1 4.32Å; I441-V469 HydrophobicContact CD1-CG2 4.45Å; I441-V469 HydrophobicContact CG1-CG1 4.49Å; I441-V469 HydrophobicContact CG1-CG2 4.12Å; H465-V469 HydrophobicContact CB-CG2 4.39Å; G467-V469 PolarHBondContact O-N 2.81Å; V469-Q471 WeakPolarHBondContact CG1-O 3.48Å; V469-L472 HydrophobicContact CG1-CB 4.28Å
470	W	89.5	Confident	81.5	Confident	60 Å²	60	54.3 Å²	54.3	23%	0.227	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-29.6	-176.7	-67.2	120.8	0	0	0	113	Y390 P468 V493 G546 L547	Y390-W470 HydrophobicContact CE1-CH2 4.39Å; Y390-W470 WeakPolarHBondContact OH-CH2 3.27Å; P468-W470 HydrophobicContact CB-CD2 4.33Å; P468-W470 HydrophobicContact CB-CH2 4.25Å; P468-W470 HydrophobicContact CB-CZ2 4.03Å; P468-W470 HydrophobicContact CG-CH2 4.48Å; P468-W470 HydrophobicContact CG-CZ2 4.26Å; P468-W470 PolarHBondContact O-N 2.89Å; W470-V493 PolarHBondContact N-O 3.09Å; W470-G546 VanDerWaalsContact CD1-O 3.27Å; W470-L547 VanDerWaalsContact CB-O 3.24Å; W470-L547 WeakPolarHBondContact CB-O 3.36Å; W470-L547 HydrophobicContact CD2-CD2 4.12Å; W470-L547 HydrophobicContact CG-CD2 3.99Å
471	Q	89.6	Confident	80.1	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	143.9	178.3	-171.6	169.8	-4.8	0	0	111.2	V365 D366 V469 S492 V493 F549	V365-Q471 HydrophobicContact CB-CB 4.05Å; V365-Q471 HydrophobicContact CB-CG 3.85Å; V365-Q471 HydrophobicContact CG1-CG 4.42Å; D366-Q471 VanDerWaalsContact CB-NE2 3.34Å; D366-Q471 PolarHBondContact O-NE2 3.31Å; D366-Q471 PolarHBondContact OD2-NE2 3.35Å; V469-Q471 WeakPolarHBondContact CG1-O 3.48Å; Q471-S492 CarbonylContact O-C 3.54Å; Q471-S492 VanDerWaalsContact O-CA 3.24Å; Q471-S492 WeakPolarHBondContact O-CA 3.35Å; Q471-S492 WeakPolarHBondContact O-CB 3.44Å; Q471-V493 PolarHBondContact N-O 2.79Å; Q471-V493 PolarHBondContact O-N 3.15Å; Q471-F549 HydrophobicContact CB-CD1 3.9Å; Q471-F549 HydrophobicContact CB-CE1 3.75Å; Q471-F549 HydrophobicContact CG-CD1 3.79Å; Q471-F549 HydrophobicContact CG-CE1 3.52Å; Q471-F549 HydrophobicContact CG-CZ 4.4Å; Q471-F549 PolarHBondContact NE2-O 2.89Å; Q471-F549 PolarHBondContact OE1-O 2.64Å
472	L	91	Very high	78.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	133.4	179	165.7	161	0	0	0	108.8	T421 D423 A433 I441 V469 L490 Y491	T421-L472 HydrophobicContact CG2-CB 3.37Å; T421-L472 HydrophobicContact CG2-CD1 4.4Å; T421-L472 HydrophobicContact CG2-CG 4.44Å; T421-L472 PolarHBondContact OG1-N 3.39Å; T421-L472 VanDerWaalsContact OG1-N 3.11Å; D423-L472 HydrophobicContact CB-CD2 3.81Å; D423-L472 WeakPolarHBondContact CB-O 3.36Å; A433-L472 HydrophobicContact CB-CD1 4.37Å; A433-L472 HydrophobicContact CB-CD2 3.71Å; I441-L472 HydrophobicContact CB-CD1 4.31Å; I441-L472 HydrophobicContact CD1-CD1 3.85Å; I441-L472 HydrophobicContact CG1-CD1 3.79Å; I441-L472 HydrophobicContact CG2-CD1 3.62Å; V469-L472 HydrophobicContact CG1-CB 4.28Å; L472-L490 HydrophobicContact CD1-CD1 4.4Å; L472-L490 HydrophobicContact CD1-CD2 4.37Å; L472-L490 HydrophobicContact CD2-CD1 3.64Å; L472-L490 HydrophobicContact CG-CD1 3.72Å; L472-L490 HydrophobicContact CG-CG 4.34Å; L472-Y491 CarbonylContact C-O 3.58Å; L472-Y491 VanDerWaalsContact CA-O 3.27Å; L472-Y491 WeakPolarHBondContact CA-O 3.33Å
473	R	88.8	Confident	77.4	Confident	31 Å²	31	56.6 Å²	56.6	12%	0.117	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	136.1	-169.3	-175.5	163.1	173.3	176.4	-6.7	113.9	D366 C367 D423 Y491 F549 D550	D366-R473 WeakPolarHBondContact O-CB 3.28Å; D366-R473 IonicContact OD2-NH1 2.68Å; D366-R473 PolarHBondContact OD2-NH1 2.7Å; C367-R473 PolarHBondContact SG-NE 3.16Å; D423-R473 VanDerWaalsContact OD2-CA 3.3Å; D423-R473 WeakPolarHBondContact OD2-CA 3.44Å; R473-Y491 PolarHBondContact N-O 2.88Å; R473-Y491 PolarHBondContact O-N 2.76Å; R473-F549 HydrophobicContact CB-CE2 4.12Å; R473-F549 HydrophobicContact CB-CZ 3.76Å; R473-D550 IonicContact CZ-OD1 3.89Å; R473-D550 VanDerWaalsContact NH1-CG 3.26Å; R473-D550 IonicContact NH1-OD1 3.73Å; R473-D550 PolarHBondContact NH1-OD1 2.75Å; R473-D550 IonicContact NH2-OD1 3.86Å; R473-D550 PolarHBondContact NH2-OD1 2.77Å
474	W	89	Confident	75.9	Confident	30 Å²	30	60.6 Å²	60.6	11%	0.114	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	139.5	166.3	-66.7	97.9	0	0	0	111	D423 A433 I443 E488 L490	D423-W474 PolarHBondContact O-NE1 2.86Å; D423-W474 PolarHBondContact OD2-N 2.91Å; A433-W474 HydrophobicContact CB-CZ2 3.95Å; I443-W474 HydrophobicContact CD1-CH2 3.99Å; I443-W474 HydrophobicContact CD1-CZ2 4.09Å; W474-E488 HydrophobicContact CB-CG 4.45Å; W474-E488 HydrophobicContact CE3-CB 4.17Å; W474-E488 HydrophobicContact CE3-CG 4.37Å; W474-L490 HydrophobicContact CD2-CB 4.28Å; W474-L490 HydrophobicContact CD2-CD1 3.89Å; W474-L490 HydrophobicContact CE3-CB 3.95Å; W474-L490 HydrophobicContact CE3-CD1 4.41Å; W474-L490 HydrophobicContact CG-CD1 4.12Å; W474-L490 HydrophobicContact CH2-CB 4.11Å; W474-L490 HydrophobicContact CZ2-CB 4.42Å; W474-L490 HydrophobicContact CZ2-CD1 4.29Å; W474-L490 HydrophobicContact CZ2-CD2 4.31Å; W474-L490 HydrophobicContact CZ3-CB 3.87Å
475	N	87.8	Confident	74.5	Confident	25 Å²	25	64.2 Å²	64.2	13%	0.134	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	142.4	172	-176.6	20.7	0	0	0	110.7	Q477 E488 S489 Y491 F551 S556	N475-Q477 PolarHBondContact O-N 3.49Å; N475-E488 WeakPolarHBondContact O-CA 3.44Å; N475-S489 PolarHBondContact N-O 3.1Å; N475-S489 PolarHBondContact O-N 3.21Å; N475-Y491 HydrophobicContact CB-CD2 4Å; N475-Y491 HydrophobicContact CB-CE2 3.79Å; N475-F551 HydrophobicContact CB-CD2 3.72Å; N475-F551 HydrophobicContact CB-CE2 3.58Å; N475-F551 HydrophobicContact CB-CG 4.32Å; N475-F551 HydrophobicContact CB-CZ 4.11Å; N475-F551 WeakPolarHBondContact ND2-CD1 3.28Å; N475-F551 WeakPolarHBondContact ND2-CD2 3.46Å; N475-F551 WeakPolarHBondContact ND2-CE1 3.22Å; N475-F551 VanDerWaalsContact ND2-CG 3.26Å; N475-F551 WeakPolarHBondContact ND2-CG 3.39Å; N475-F551 WeakPolarHBondContact ND2-CZ 3.47Å; N475-S556 PolarHBondContact ND2-O 2.92Å; N475-S556 VanDerWaalsContact ND2-O 3.11Å
476	Q	83.8	Confident	73.2	Confident	67 Å²	67	69 Å²	69	31%	0.313	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	109.3	178.9	-71.7	175.7	15.3	0	0	109.7	I427 E488 S556	I427-Q476 HydrophobicContact CD1-CG 4.09Å; I427-Q476 HydrophobicContact CG1-CG 4.35Å; Q476-E488 HydrophobicContact CG-CG 3.7Å; Q476-E488 WeakPolarHBondContact CG-OE1 3.38Å; Q476-E488 PolarHBondContact NE2-OE1 2.78Å; Q476-S556 WeakPolarHBondContact O-CB 3.36Å; Q476-S556 PolarHBondContact O-OG 2.82Å
477	Q	70.9	Confident	72.8	Confident	23 Å²	23	64.6 Å²	64.6	11%	0.107	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	125.1	172.8	-161.5	167.3	29	0	0	109.8	N475 L479 V487 N557	N475-Q477 PolarHBondContact O-N 3.49Å; Q477-L479 HydrophobicContact CB-CD2 4.35Å; Q477-L479 HydrophobicContact CG-CD2 3.89Å; Q477-L479 HydrophobicContact CG-CG 4.46Å; Q477-L479 PolarHBondContact O-N 3.01Å; Q477-V487 PolarHBondContact N-O 2.88Å; Q477-V487 PolarHBondContact O-N 3.28Å; Q477-V487 VanDerWaalsContact O-N 3.08Å; Q477-N557 PolarHBondContact NE2-OD1 3.36Å
478	E	62.3	Low	72.7	Confident	104 Å²	104	65.1 Å²	65.1	49%	0.486	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	104.4	170.2	-61.5	-171.9	167.9	0	0	107.5	K486	E478-K486 HydrophobicContact CG-CD 4.28Å; E478-K486 HydrophobicContact CG-CG 4.33Å; E478-K486 WeakPolarHBondContact OE1-CE 3.37Å; E478-K486 IonicContact OE1-NZ 2.86Å; E478-K486 PolarHBondContact OE1-NZ 2.89Å
479	L	57.8	Low	72.7	Confident	103 Å²	103	64.4 Å²	64.4	54%	0.539	32%	0.32	S	S	.	.			trans	-93.7	-7.8	-174.5	-69.1	178.9	0	0	0	113.5	Q477 V487	Q477-L479 HydrophobicContact CB-CD2 4.35Å; Q477-L479 HydrophobicContact CG-CD2 3.89Å; Q477-L479 HydrophobicContact CG-CG 4.46Å; Q477-L479 PolarHBondContact O-N 3.01Å; L479-V487 HydrophobicContact CD1-CB 3.74Å; L479-V487 HydrophobicContact CD1-CG1 4.26Å; L479-V487 HydrophobicContact CD1-CG2 3.86Å; L479-V487 HydrophobicContact CG-CB 4.46Å
480	S	43.3	Very low	72.7	Confident	31 Å²	31	64.5 Å²	64.5	22%	0.217	32%	0.321	C	S	.	.			trans	-115.4	132.9	-171.3	53	0	0	0	0	111.9	T482 G483 E484 E485	S480-T482 PolarHBondContact O-N 2.91Å; S480-T482 VanDerWaalsContact O-N 3.09Å; S480-G483 PolarHBondContact O-N 2.74Å; S480-G483 PolarHBondContact OG-N 3.06Å; S480-E484 PolarHBondContact OG-N 3.05Å; S480-E485 PolarHBondContact OG-N 2.88Å; S480-E485 PolarHBondContact OG-O 3.05Å
481	F	49	Very low	72.9	Confident	231 Å²	231	61.7 Å²	61.7	100%	1.013	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-9.6	169.3	-82.8	-89.9	0	0	0	113.3
482	T	51.2	Low	73.1	Confident	103 Å²	103	61.7 Å²	61.7	63%	0.632	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-14.5	173.4	55	0	0	0	0	113.5	S480 E484	S480-T482 PolarHBondContact O-N 2.91Å; S480-T482 VanDerWaalsContact O-N 3.09Å; T482-E484 PolarHBondContact O-N 2.94Å
483	G	53.1	Low	73.2	Confident	36 Å²	36	61.7 Å²	61.7	37%	0.371	31%	0.31	S	S	.	.	S	Bend	trans	74.8	0.1	-179.8	0	0	0	0	0	116	S480	S480-G483 PolarHBondContact O-N 2.74Å; S480-G483 PolarHBondContact OG-N 3.06Å
484	E	52.8	Low	73.3	Confident	168 Å²	168	60.2 Å²	60.2	79%	0.785	31%	0.305	S	S	*	.			trans	-82.1	-28.5	-171.1	-64.9	179.8	138.4	0	0	113.6	S480 T482	S480-E484 PolarHBondContact OG-N 3.05Å; T482-E484 PolarHBondContact O-N 2.94Å
485	E	59.1	Low	73.2	Confident	143 Å²	143	60.2 Å²	60.2	67%	0.668	31%	0.311	S	S	*	.			trans	-106.2	104	175.4	-69	-170.4	164.3	0	0	111.1	S480	S480-E485 PolarHBondContact OG-N 2.88Å; S480-E485 PolarHBondContact OG-O 3.05Å
486	K	64.5	Low	73.3	Confident	100 Å²	100	60.3 Å²	60.3	44%	0.435	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.4	165.6	-55.8	-155.7	-173.8	-152.6	0	109.2	I427 E478	I427-K486 HydrophobicContact CD1-CB 4.46Å; E478-K486 HydrophobicContact CG-CD 4.28Å; E478-K486 HydrophobicContact CG-CG 4.33Å; E478-K486 WeakPolarHBondContact OE1-CE 3.37Å; E478-K486 IonicContact OE1-NZ 2.86Å; E478-K486 PolarHBondContact OE1-NZ 2.89Å
487	V	78.6	Confident	73.5	Confident	62 Å²	62	57.1 Å²	57.1	38%	0.376	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.9	179.5	177.2	0	0	0	0	108.6	Q477 L479	Q477-V487 PolarHBondContact N-O 2.88Å; Q477-V487 PolarHBondContact O-N 3.28Å; Q477-V487 VanDerWaalsContact O-N 3.08Å; L479-V487 HydrophobicContact CD1-CB 3.74Å; L479-V487 HydrophobicContact CD1-CG1 4.26Å; L479-V487 HydrophobicContact CD1-CG2 3.86Å; L479-V487 HydrophobicContact CG-CB 4.46Å
488	E	85.1	Confident	74.5	Confident	26 Å²	26	57.1 Å²	57.1	12%	0.121	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	141.4	171.1	-118.3	158.9	-132.4	0	0	110.7	S425 S426 I427 W474 N475 Q476	S425-E488 WeakPolarHBondContact CA-OE2 3.39Å; S425-E488 WeakPolarHBondContact CB-OE2 3.49Å; S425-E488 PolarHBondContact OG-OE2 2.87Å; S426-E488 WeakPolarHBondContact CA-OE1 3.28Å; S426-E488 VanDerWaalsContact CB-OE1 3.29Å; S426-E488 WeakPolarHBondContact CB-OE1 3.31Å; S426-E488 PolarHBondContact N-OE1 2.54Å; S426-E488 PolarHBondContact N-OE2 3.14Å; I427-E488 HydrophobicContact CD1-CB 4.05Å; I427-E488 HydrophobicContact CD1-CG 4.24Å; I427-E488 HydrophobicContact CG1-CG 4.48Å; I427-E488 WeakPolarHBondContact CG1-OE1 3.5Å; I427-E488 VanDerWaalsContact N-CD 3.29Å; I427-E488 PolarHBondContact N-OE1 2.92Å; I427-E488 PolarHBondContact N-OE2 2.8Å; W474-E488 HydrophobicContact CB-CG 4.45Å; W474-E488 HydrophobicContact CE3-CB 4.17Å; W474-E488 HydrophobicContact CE3-CG 4.37Å; N475-E488 WeakPolarHBondContact O-CA 3.44Å; Q476-E488 HydrophobicContact CG-CG 3.7Å; Q476-E488 WeakPolarHBondContact CG-OE1 3.38Å; Q476-E488 PolarHBondContact NE2-OE1 2.78Å
489	S	88.7	Confident	76	Confident	10 Å²	10	52.3 Å²	52.3	7%	0.07	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.7	175.3	-68.8	0	0	0	0	109.2	N475 Y491 K501	N475-S489 PolarHBondContact N-O 3.1Å; N475-S489 PolarHBondContact O-N 3.21Å; S489-Y491 VanDerWaalsContact O-CD2 3.24Å; S489-Y491 WeakPolarHBondContact O-CD2 3.4Å; S489-Y491 VanDerWaalsContact O-CE2 3.28Å; S489-Y491 WeakPolarHBondContact O-CE2 3.44Å; S489-K501 WeakPolarHBondContact OG-CE 3.26Å; S489-K501 PolarHBondContact OG-NZ 2.93Å
490	L	91.6	Very high	77.7	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137	-179.8	-177.3	63	0	0	0	109.3	A433 I441 I443 L472 W474 W502	A433-L490 HydrophobicContact CB-CD1 4Å; A433-L490 HydrophobicContact CB-CD2 3.88Å; I441-L490 HydrophobicContact CG2-CD2 4Å; I443-L490 HydrophobicContact CD1-CD2 4.17Å; I443-L490 HydrophobicContact CG1-CD2 4.37Å; L472-L490 HydrophobicContact CD1-CD1 4.4Å; L472-L490 HydrophobicContact CD1-CD2 4.37Å; L472-L490 HydrophobicContact CD2-CD1 3.64Å; L472-L490 HydrophobicContact CG-CD1 3.72Å; L472-L490 HydrophobicContact CG-CG 4.34Å; W474-L490 HydrophobicContact CD2-CB 4.28Å; W474-L490 HydrophobicContact CD2-CD1 3.89Å; W474-L490 HydrophobicContact CE3-CB 3.95Å; W474-L490 HydrophobicContact CE3-CD1 4.41Å; W474-L490 HydrophobicContact CG-CD1 4.12Å; W474-L490 HydrophobicContact CH2-CB 4.11Å; W474-L490 HydrophobicContact CZ2-CB 4.42Å; W474-L490 HydrophobicContact CZ2-CD1 4.29Å; W474-L490 HydrophobicContact CZ2-CD2 4.31Å; W474-L490 HydrophobicContact CZ3-CB 3.87Å; L490-W502 HydrophobicContact CB-CB 4.06Å; L490-W502 HydrophobicContact CD2-CB 4.38Å; L490-W502 HydrophobicContact CG-CB 4.34Å; L490-W502 PolarHBondContact O-N 3.07Å
491	Y	92.9	Very high	80	Confident	1 Å²	1	47.5 Å²	47.5	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.1	-177.8	-63.3	-101.2	0	0	0	109.3	L472 R473 N475 S489 C500 K501 L514 F551	L472-Y491 CarbonylContact C-O 3.58Å; L472-Y491 VanDerWaalsContact CA-O 3.27Å; L472-Y491 WeakPolarHBondContact CA-O 3.33Å; R473-Y491 PolarHBondContact N-O 2.88Å; R473-Y491 PolarHBondContact O-N 2.76Å; N475-Y491 HydrophobicContact CB-CD2 4Å; N475-Y491 HydrophobicContact CB-CE2 3.79Å; S489-Y491 VanDerWaalsContact O-CD2 3.24Å; S489-Y491 WeakPolarHBondContact O-CD2 3.4Å; S489-Y491 VanDerWaalsContact O-CE2 3.28Å; S489-Y491 WeakPolarHBondContact O-CE2 3.44Å; Y491-C500 CarbonylContact C-O 3.52Å; Y491-C500 VanDerWaalsContact CA-O 3.3Å; Y491-C500 WeakPolarHBondContact CA-O 3.38Å; Y491-K501 HydrophobicContact CD1-CB 4.38Å; Y491-K501 HydrophobicContact CD1-CG 4.28Å; Y491-K501 HydrophobicContact CE1-CB 4.3Å; Y491-K501 HydrophobicContact CE1-CD 4.1Å; Y491-K501 HydrophobicContact CE1-CG 3.91Å; Y491-K501 WeakPolarHBondContact OH-CE 3.31Å; Y491-L514 HydrophobicContact CD1-CD1 3.49Å; Y491-L514 VanDerWaalsContact CD1-CD1 3.49Å; Y491-L514 HydrophobicContact CE1-CD1 3.58Å; Y491-F551 HydrophobicContact CD1-CE2 4.25Å; Y491-F551 AromaticContact CD1-CZ 3.6Å; Y491-F551 HydrophobicContact CD1-CZ 3.6Å; Y491-F551 AromaticContact CD2-CE2 3.81Å; Y491-F551 HydrophobicContact CD2-CE2 3.81Å; Y491-F551 AromaticContact CD2-CZ 3.81Å; Y491-F551 HydrophobicContact CD2-CZ 3.81Å; Y491-F551 HydrophobicContact CE1-CE1 4.49Å; Y491-F551 AromaticContact CE1-CZ 3.74Å; Y491-F551 HydrophobicContact CE1-CZ 3.74Å; Y491-F551 HydrophobicContact CE2-CE2 4.3Å; Y491-F551 AromaticContact CE2-CZ 4Å; Y491-F551 HydrophobicContact CE2-CZ 4Å; Y491-F551 AromaticContact CG-CE2 3.8Å; Y491-F551 HydrophobicContact CG-CE2 3.8Å; Y491-F551 AromaticContact CG-CZ 3.62Å; Y491-F551 HydrophobicContact CG-CZ 3.62Å; Y491-F551 AromaticContact CZ-CZ 3.95Å
492	S	93.9	Very high	82.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	156.5	176	66.2	0	0	0	0	113.8	H465 Q471 I499 C500 W502	H465-S492 PolarHBondContact NE2-OG 2.68Å; Q471-S492 CarbonylContact O-C 3.54Å; Q471-S492 VanDerWaalsContact O-CA 3.24Å; Q471-S492 WeakPolarHBondContact O-CA 3.35Å; Q471-S492 WeakPolarHBondContact O-CB 3.44Å; S492-I499 CarbonylContact O-C 3.43Å; S492-I499 WeakPolarHBondContact O-CA 3.27Å; S492-C500 PolarHBondContact N-O 2.86Å; S492-C500 PolarHBondContact O-N 2.79Å; S492-W502 PolarHBondContact OG-NE1 3.22Å
493	V	93.1	Very high	83.8	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.7	171.2	167.5	0	0	0	0	109.1	W470 Q471 I499 G546 F549	W470-V493 PolarHBondContact N-O 3.09Å; Q471-V493 PolarHBondContact N-O 2.79Å; Q471-V493 PolarHBondContact O-N 3.15Å; V493-I499 HydrophobicContact CG2-CB 4.3Å; V493-I499 HydrophobicContact CG2-CD1 4.16Å; V493-I499 HydrophobicContact CG2-CG1 3.96Å; V493-I499 HydrophobicContact CG2-CG2 3.91Å; V493-G546 VanDerWaalsContact CG1-C 3.44Å; V493-G546 WeakPolarHBondContact CG1-O 3.41Å; V493-F549 HydrophobicContact CB-CD1 3.8Å; V493-F549 HydrophobicContact CB-CE1 4.12Å; V493-F549 HydrophobicContact CG2-CB 4.03Å; V493-F549 HydrophobicContact CG2-CD1 3.19Å; V493-F549 HydrophobicContact CG2-CE1 3.75Å; V493-F549 HydrophobicContact CG2-CG 3.77Å
494	G	90.1	Very high	85.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	159.9	-179.6	0	0	0	0	0	113.9	P468 D496 G497 R498	P468-G494 WeakPolarHBondContact O-CA 3.41Å; G494-D496 PolarHBondContact O-N 3.01Å; G494-G497 PolarHBondContact O-N 3.24Å; G494-R498 PolarHBondContact N-O 2.88Å
495	A	88.3	Confident	86.6	Confident	30 Å²	30	33 Å²	33	25%	0.248	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-18.2	172.3	0	0	0	0	0	113.9	P468 G497 P545	P468-A495 PolarHBondContact O-N 2.68Å; A495-G497 PolarHBondContact O-N 2.87Å; A495-P545 WeakPolarHBondContact O-CB 3.35Å; A495-P545 WeakPolarHBondContact O-CG 3.45Å
496	D	88.9	Confident	87.3	Confident	26 Å²	26	34.4 Å²	34.4	14%	0.139	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	6.4	175.6	65.4	-5.4	0	0	0	114.4	H465 L466 G494 R498 L543	H465-D496 WeakPolarHBondContact CA-OD2 3.46Å; H465-D496 IonicContact CE1-OD1 2.84Å; H465-D496 IonicContact CG-OD1 2.73Å; H465-D496 IonicContact ND1-OD1 3.23Å; H465-D496 PolarHBondContact ND1-OD1 2.86Å; H465-D496 IonicContact ND1-OD2 2.88Å; L466-D496 HydrophobicContact CB-CB 4.19Å; L466-D496 PolarHBondContact N-OD2 3.3Å; L466-D496 VanDerWaalsContact N-OD2 3.1Å; G494-D496 PolarHBondContact O-N 3.01Å; D496-R498 PolarHBondContact O-N 2.9Å; D496-R498 PolarHBondContact OD1-N 2.97Å; D496-R498 IonicContact OD1-NE 3.54Å; D496-R498 IonicContact OD2-CZ 3.81Å; D496-R498 VanDerWaalsContact OD2-CZ 3.24Å; D496-R498 IonicContact OD2-NE 2.63Å; D496-R498 PolarHBondContact OD2-NE 3.38Å; D496-R498 IonicContact OD2-NH2 3.17Å; D496-R498 PolarHBondContact OD2-NH2 2.77Å; D496-L543 WeakPolarHBondContact O-CD1 3.41Å
497	G	88.6	Confident	87.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	71.8	16.7	176.5	0	0	0	0	0	113.7	G494 A495 L517 T544	G494-G497 PolarHBondContact O-N 3.24Å; A495-G497 PolarHBondContact O-N 2.87Å; G497-L517 WeakPolarHBondContact O-CB 3.28Å; G497-L517 PolarHBondContact O-N 3.44Å; G497-T544 VanDerWaalsContact CA-O 3.25Å; G497-T544 WeakPolarHBondContact CA-O 3.45Å
498	R	91.7	Very high	87.8	Confident	24 Å²	24	30.8 Å²	30.8	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	143.1	174.7	-62.3	-170.1	-67.2	147	-8.7	111	K463 R464 H465 G494 D496 D513 K516 L543	K463-R498 PolarHBondContact O-NH1 3.29Å; K463-R498 PolarHBondContact O-NH2 2.85Å; K463-R498 VanDerWaalsContact O-NH2 3.12Å; R464-R498 PolarHBondContact O-NH2 3.34Å; H465-R498 PolarHBondContact CE1-O 3.35Å; G494-R498 PolarHBondContact N-O 2.88Å; D496-R498 PolarHBondContact O-N 2.9Å; D496-R498 PolarHBondContact OD1-N 2.97Å; D496-R498 IonicContact OD1-NE 3.54Å; D496-R498 IonicContact OD2-CZ 3.81Å; D496-R498 VanDerWaalsContact OD2-CZ 3.24Å; D496-R498 IonicContact OD2-NE 2.63Å; D496-R498 PolarHBondContact OD2-NE 3.38Å; D496-R498 IonicContact OD2-NH2 3.17Å; D496-R498 PolarHBondContact OD2-NH2 2.77Å; R498-D513 WeakPolarHBondContact CD-OD1 3.34Å; R498-D513 IonicContact CZ-OD1 2.71Å; R498-D513 IonicContact NE-OD1 2.77Å; R498-D513 IonicContact NH1-OD1 3.13Å; R498-D513 PolarHBondContact NH1-OD1 3.48Å; R498-K516 HydrophobicContact CG-CG 4.43Å; R498-L543 HydrophobicContact CG-CD1 4.41Å
499	I	93.4	Very high	87.9	Confident	2 Å²	2	30 Å²	30	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	121.3	170	-43.8	-164.7	0	0	0	106	S492 V493 L514 M515 L517 Y559 T561	S492-I499 CarbonylContact O-C 3.43Å; S492-I499 WeakPolarHBondContact O-CA 3.27Å; V493-I499 HydrophobicContact CG2-CB 4.3Å; V493-I499 HydrophobicContact CG2-CD1 4.16Å; V493-I499 HydrophobicContact CG2-CG1 3.96Å; V493-I499 HydrophobicContact CG2-CG2 3.91Å; I499-L514 WeakPolarHBondContact O-CA 3.45Å; I499-L514 WeakPolarHBondContact O-CB 3.41Å; I499-L514 PolarHBondContact O-N 2.82Å; I499-M515 HydrophobicContact CB-CB 4.1Å; I499-M515 HydrophobicContact CD1-CB 4.15Å; I499-M515 HydrophobicContact CD1-CG 4.4Å; I499-M515 HydrophobicContact CG1-CB 4.09Å; I499-M515 PolarHBondContact N-O 2.79Å; I499-M515 PolarHBondContact O-N 3.1Å; I499-L517 HydrophobicContact CD1-CD1 4.26Å; I499-L517 HydrophobicContact CD1-CD2 4.18Å; I499-L517 HydrophobicContact CD1-CG 4.27Å; I499-L517 HydrophobicContact CG1-CD1 4.34Å; I499-L517 HydrophobicContact CG1-CG 4.36Å; I499-Y559 HydrophobicContact CD1-CE2 3.72Å; I499-Y559 HydrophobicContact CG2-CE2 4.13Å; I499-T561 HydrophobicContact CD1-CG2 3.79Å
500	C	93.2	Very high	87.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.5	-168	-67.7	0	0	0	0	111.3	H465 Y491 S492 C511 T512	H465-C500 PolarHBondContact CE1-SG 2.86Å; Y491-C500 CarbonylContact C-O 3.52Å; Y491-C500 VanDerWaalsContact CA-O 3.3Å; Y491-C500 WeakPolarHBondContact CA-O 3.38Å; S492-C500 PolarHBondContact N-O 2.86Å; S492-C500 PolarHBondContact O-N 2.79Å; C500-C511 HydrophobicContact CB-CB 4.33Å; C500-T512 WeakPolarHBondContact CA-O 3.43Å
501	K	92.6	Very high	87.8	Confident	34 Å²	34	31.3 Å²	31.3	15%	0.148	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	133.1	164.4	-166.9	177.7	-175.5	-174.5	0	108.8	S489 Y491 C511 T512 L514	S489-K501 WeakPolarHBondContact OG-CE 3.26Å; S489-K501 PolarHBondContact OG-NZ 2.93Å; Y491-K501 HydrophobicContact CD1-CB 4.38Å; Y491-K501 HydrophobicContact CD1-CG 4.28Å; Y491-K501 HydrophobicContact CE1-CB 4.3Å; Y491-K501 HydrophobicContact CE1-CD 4.1Å; Y491-K501 HydrophobicContact CE1-CG 3.91Å; Y491-K501 WeakPolarHBondContact OH-CE 3.31Å; K501-C511 CarbonylContact O-C 3.49Å; K501-C511 WeakPolarHBondContact O-CA 3.41Å; K501-C511 VanDerWaalsContact O-CB 3.22Å; K501-C511 WeakPolarHBondContact O-CB 3.29Å; K501-T512 PolarHBondContact N-O 2.71Å; K501-T512 PolarHBondContact O-N 2.73Å; K501-L514 HydrophobicContact CB-CD1 3.95Å; K501-L514 HydrophobicContact CB-CD2 3.95Å; K501-L514 HydrophobicContact CB-CG 3.85Å
502	W	91.8	Very high	87.7	Confident	3 Å²	3	34.4 Å²	34.4	1%	0.011	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	144.6	-179.1	-65.1	89.2	0	0	0	111.5	I441 C461 L490 S492 L509 D510 C511	I441-W502 HydrophobicContact CD1-CD2 4.2Å; I441-W502 HydrophobicContact CD1-CG 4.47Å; I441-W502 HydrophobicContact CD1-CZ2 3.79Å; C461-W502 HydrophobicContact CB-CZ3 4.32Å; L490-W502 HydrophobicContact CB-CB 4.06Å; L490-W502 HydrophobicContact CD2-CB 4.38Å; L490-W502 HydrophobicContact CG-CB 4.34Å; L490-W502 PolarHBondContact O-N 3.07Å; S492-W502 PolarHBondContact OG-NE1 3.22Å; W502-L509 HydrophobicContact CB-CD2 4.27Å; W502-L509 HydrophobicContact CB-CG 4.4Å; W502-L509 HydrophobicContact CD2-CD2 4.02Å; W502-L509 HydrophobicContact CD2-CG 4.49Å; W502-L509 HydrophobicContact CE3-CB 4.3Å; W502-L509 HydrophobicContact CE3-CD2 3.54Å; W502-L509 HydrophobicContact CE3-CG 3.71Å; W502-L509 HydrophobicContact CG-CD2 4.36Å; W502-L509 HydrophobicContact CZ3-CD2 4.19Å; W502-L509 HydrophobicContact CZ3-CG 4.43Å; W502-D510 WeakPolarHBondContact CA-O 3.4Å; W502-C511 HydrophobicContact CD2-CB 3.57Å; W502-C511 HydrophobicContact CE3-CB 3.53Å; W502-C511 HydrophobicContact CG-CB 4.19Å; W502-C511 HydrophobicContact CH2-CB 3.99Å; W502-C511 HydrophobicContact CZ2-CB 3.99Å; W502-C511 HydrophobicContact CZ3-CB 3.74Å
503	F	87.4	Confident	87.5	Confident	81 Å²	81	37.2 Å²	37.2	36%	0.355	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	153.4	-178.4	56.5	-71.1	0	0	0	110.2	I505 D510 T512	F503-I505 HydrophobicContact CD2-CD1 4.05Å; F503-I505 HydrophobicContact CD2-CG1 3.71Å; F503-I505 HydrophobicContact CE2-CD1 3.41Å; F503-I505 VanDerWaalsContact CE2-CD1 3.41Å; F503-I505 HydrophobicContact CE2-CG1 3.62Å; F503-I505 HydrophobicContact CZ-CD1 4.03Å; F503-D510 WeakPolarHBondContact CD1-O 3.34Å; F503-D510 HydrophobicContact CZ-CB 4.41Å; F503-D510 PolarHBondContact N-O 3.34Å; F503-D510 PolarHBondContact O-N 2.9Å; F503-T512 HydrophobicContact CE1-CG2 4.08Å; F503-T512 HydrophobicContact CZ-CG2 4.4Å
504	V	85	Confident	87.3	Confident	80 Å²	80	38.3 Å²	38.3	49%	0.485	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.4	-178.3	178.9	0	0	0	0	109.3	I456 G508 L509	I456-V504 HydrophobicContact CD1-CB 4.25Å; I456-V504 HydrophobicContact CD1-CG1 3.67Å; I456-V504 HydrophobicContact CD1-CG2 3.49Å; I456-V504 VanDerWaalsContact CD1-CG2 3.49Å; V504-G508 WeakPolarHBondContact CA-O 3.3Å; V504-L509 HydrophobicContact CG2-CD1 3.91Å
505	I	79.5	Confident	87.3	Confident	69 Å²	69	38.5 Å²	38.5	35%	0.354	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125.2	171.7	-39.3	177.7	0	0	0	108.5	F503 G507 G508 D510	F503-I505 HydrophobicContact CD2-CD1 4.05Å; F503-I505 HydrophobicContact CD2-CG1 3.71Å; F503-I505 HydrophobicContact CE2-CD1 3.41Å; F503-I505 VanDerWaalsContact CE2-CD1 3.41Å; F503-I505 HydrophobicContact CE2-CG1 3.62Å; F503-I505 HydrophobicContact CZ-CD1 4.03Å; I505-G507 PolarHBondContact O-N 3.43Å; I505-G508 PolarHBondContact N-O 3Å; I505-G508 PolarHBondContact O-N 2.9Å; I505-D510 HydrophobicContact CD1-CB 3.62Å; I505-D510 HydrophobicContact CG1-CB 4.11Å
506	N	74.1	Confident	87.4	Confident	172 Å²	172	41.2 Å²	41.2	92%	0.92	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	25.2	172	-57.3	-17.1	0	0	0	115.3
507	G	73.7	Confident	87.5	Confident	55 Å²	55	40 Å²	40	57%	0.567	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.2	-8.3	-176.6	0	0	0	0	0	115.5	I505	I505-G507 PolarHBondContact O-N 3.43Å
508	G	79.9	Confident	87.3	Confident	32 Å²	32	45.2 Å²	45.2	33%	0.33	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	166.4	170.7	0	0	0	0	0	112.8	V504 I505	V504-G508 WeakPolarHBondContact CA-O 3.3Å; I505-G508 PolarHBondContact N-O 3Å; I505-G508 PolarHBondContact O-N 2.9Å
509	L	87.5	Confident	86.8	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.052	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.7	170.9	-145.9	72.3	0	0	0	110	I441 I443 I456 C461 W502 V504	I441-L509 HydrophobicContact CB-CD2 4.28Å; I441-L509 HydrophobicContact CG2-CD2 3.87Å; I443-L509 HydrophobicContact CD1-CD1 3.75Å; I456-L509 HydrophobicContact CG2-CB 3.9Å; I456-L509 HydrophobicContact CG2-CD1 4Å; C461-L509 WeakPolarHBondContact CB-O 3.21Å; W502-L509 HydrophobicContact CB-CD2 4.27Å; W502-L509 HydrophobicContact CB-CG 4.4Å; W502-L509 HydrophobicContact CD2-CD2 4.02Å; W502-L509 HydrophobicContact CD2-CG 4.49Å; W502-L509 HydrophobicContact CE3-CB 4.3Å; W502-L509 HydrophobicContact CE3-CD2 3.54Å; W502-L509 HydrophobicContact CE3-CG 3.71Å; W502-L509 HydrophobicContact CG-CD2 4.36Å; W502-L509 HydrophobicContact CZ3-CD2 4.19Å; W502-L509 HydrophobicContact CZ3-CG 4.43Å; V504-L509 HydrophobicContact CG2-CD1 3.91Å
510	D	87.8	Confident	85.5	Confident	38 Å²	38	53.8 Å²	53.8	20%	0.203	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	163.7	170	-170.2	27	0	0	0	110.3	C461 K463 W502 F503 I505	C461-D510 PolarHBondContact SG-OD1 3.38Å; C461-D510 VanDerWaalsContact SG-OD1 3.41Å; K463-D510 IonicContact NZ-OD1 3.91Å; K463-D510 PolarHBondContact NZ-OD1 2.77Å; K463-D510 IonicContact NZ-OD2 3.99Å; K463-D510 PolarHBondContact NZ-OD2 3.19Å; W502-D510 WeakPolarHBondContact CA-O 3.4Å; F503-D510 WeakPolarHBondContact CD1-O 3.34Å; F503-D510 HydrophobicContact CZ-CB 4.41Å; F503-D510 PolarHBondContact N-O 3.34Å; F503-D510 PolarHBondContact O-N 2.9Å; I505-D510 HydrophobicContact CD1-CB 3.62Å; I505-D510 HydrophobicContact CG1-CB 4.11Å
511	C	90.3	Very high	83.8	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	163.1	179	67.5	0	0	0	0	115.3	K463 C500 K501 W502	K463-C511 WeakPolarHBondContact CB-SG 3.48Å; K463-C511 VanDerWaalsContact CD-O 3.22Å; K463-C511 WeakPolarHBondContact CD-O 3.41Å; K463-C511 PolarHBondContact NZ-O 3.49Å; C500-C511 HydrophobicContact CB-CB 4.33Å; K501-C511 CarbonylContact O-C 3.49Å; K501-C511 WeakPolarHBondContact O-CA 3.41Å; K501-C511 VanDerWaalsContact O-CB 3.22Å; K501-C511 WeakPolarHBondContact O-CB 3.29Å; W502-C511 HydrophobicContact CD2-CB 3.57Å; W502-C511 HydrophobicContact CE3-CB 3.53Å; W502-C511 HydrophobicContact CG-CB 4.19Å; W502-C511 HydrophobicContact CH2-CB 3.99Å; W502-C511 HydrophobicContact CZ2-CB 3.99Å; W502-C511 HydrophobicContact CZ3-CB 3.74Å
512	T	90.7	Very high	81.6	Confident	67 Å²	67	62.5 Å²	62.5	41%	0.411	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.4	163.2	46.7	0	0	0	0	109.4	C500 K501 F503 L514	C500-T512 WeakPolarHBondContact CA-O 3.43Å; K501-T512 PolarHBondContact N-O 2.71Å; K501-T512 PolarHBondContact O-N 2.73Å; F503-T512 HydrophobicContact CE1-CG2 4.08Å; F503-T512 HydrophobicContact CZ-CG2 4.4Å; T512-L514 PolarHBondContact O-N 3.15Å; T512-L514 VanDerWaalsContact O-N 3.14Å
513	D	90.5	Very high	79.1	Confident	58 Å²	58	68.4 Å²	68.4	31%	0.31	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	110	170.9	-59.1	-39.9	0	0	0	108.2	R498 K516	R498-D513 WeakPolarHBondContact CD-OD1 3.34Å; R498-D513 IonicContact CZ-OD1 2.71Å; R498-D513 IonicContact NE-OD1 2.77Å; R498-D513 IonicContact NH1-OD1 3.13Å; R498-D513 PolarHBondContact NH1-OD1 3.48Å; D513-K516 VanDerWaalsContact CG-CE 3.41Å; D513-K516 WeakPolarHBondContact OD2-CE 3.48Å; D513-K516 IonicContact OD2-NZ 3.23Å; D513-K516 PolarHBondContact OD2-NZ 2.86Å
514	L	89.2	Confident	77	Confident	23 Å²	23	71.6 Å²	71.6	12%	0.12	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-44	174.4	-68.8	177.1	0	0	0	111.7	Y491 I499 K501 T512 G576	Y491-L514 HydrophobicContact CD1-CD1 3.49Å; Y491-L514 VanDerWaalsContact CD1-CD1 3.49Å; Y491-L514 HydrophobicContact CE1-CD1 3.58Å; I499-L514 WeakPolarHBondContact O-CA 3.45Å; I499-L514 WeakPolarHBondContact O-CB 3.41Å; I499-L514 PolarHBondContact O-N 2.82Å; K501-L514 HydrophobicContact CB-CD1 3.95Å; K501-L514 HydrophobicContact CB-CD2 3.95Å; K501-L514 HydrophobicContact CB-CG 3.85Å; T512-L514 PolarHBondContact O-N 3.15Å; T512-L514 VanDerWaalsContact O-N 3.14Å; L514-G576 WeakPolarHBondContact O-CA 3.38Å
515	M	89.9	Confident	74.9	Confident	5 Å²	5	79.9 Å²	79.9	3%	0.025	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	147.4	-176.4	-177.9	58	75.3	0	0	110	I499 Y559 N575 F579	I499-M515 HydrophobicContact CB-CB 4.1Å; I499-M515 HydrophobicContact CD1-CB 4.15Å; I499-M515 HydrophobicContact CD1-CG 4.4Å; I499-M515 HydrophobicContact CG1-CB 4.09Å; I499-M515 PolarHBondContact N-O 2.79Å; I499-M515 PolarHBondContact O-N 3.1Å; M515-Y559 WeakPolarHBondContact CB-OH 3.35Å; M515-N575 WeakPolarHBondContact CE-O 3.36Å; M515-F579 HydrophobicContact CE-CD1 4.25Å; M515-F579 HydrophobicContact CE-CE1 4.45Å; M515-F579 HydrophobicContact CG-CE1 4.09Å; M515-F579 HydrophobicContact SD-CD1 4.22Å; M515-F579 HydrophobicContact SD-CE1 3.83Å
516	K	90.7	Very high	72.9	Confident	87 Å²	87	85.6 Å²	85.6	38%	0.378	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	108.2	174.6	-57.6	-165.2	179.5	-167.8	0	108.5	R498 D513 K518 L543	R498-K516 HydrophobicContact CG-CG 4.43Å; D513-K516 VanDerWaalsContact CG-CE 3.41Å; D513-K516 WeakPolarHBondContact OD2-CE 3.48Å; D513-K516 IonicContact OD2-NZ 3.23Å; D513-K516 PolarHBondContact OD2-NZ 2.86Å; K516-K518 PolarHBondContact O-N 2.71Å; K516-L543 HydrophobicContact CB-CD2 3.94Å
517	L	89	Confident	70.9	Confident	1 Å²	1	83.9 Å²	83.9	1%	0.005	44%	0.436	C	S	.	.			trans	-69.4	100.1	-175.8	-64.3	169.9	0	0	0	109.1	G497 I499 L543 T544 G546 T561 T563 F579	G497-L517 WeakPolarHBondContact O-CB 3.28Å; G497-L517 PolarHBondContact O-N 3.44Å; I499-L517 HydrophobicContact CD1-CD1 4.26Å; I499-L517 HydrophobicContact CD1-CD2 4.18Å; I499-L517 HydrophobicContact CD1-CG 4.27Å; I499-L517 HydrophobicContact CG1-CD1 4.34Å; I499-L517 HydrophobicContact CG1-CG 4.36Å; L517-L543 CarbonylContact O-C 2.87Å; L517-L543 WeakPolarHBondContact O-CA 3.39Å; L517-T544 WeakPolarHBondContact CB-O 3.22Å; L517-T544 PolarHBondContact O-N 3Å; L517-G546 VanDerWaalsContact CD1-CA 3.44Å; L517-T561 HydrophobicContact CD2-CG2 3.83Å; L517-T563 HydrophobicContact CD1-CG2 4.46Å; L517-T563 HydrophobicContact CD2-CG2 4.37Å; L517-F579 HydrophobicContact CD2-CE1 4.02Å; L517-F579 HydrophobicContact CD2-CZ 4.33Å
518	K	86.4	Confident	69.3	Low	109 Å²	109	89.7 Å²	89.7	47%	0.474	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-92	136.2	-179.9	-70.3	171.8	-179.1	179.2	0	110.6	K516 M520 S541 L543	K516-K518 PolarHBondContact O-N 2.71Å; K518-M520 PolarHBondContact O-N 2.94Å; K518-S541 WeakPolarHBondContact CE-OG 3.27Å; K518-L543 HydrophobicContact CG-CD2 3.91Å
519	K	79.4	Confident	67.2	Low	98 Å²	98	97 Å²	97	43%	0.426	47%	0.474	S	S	.	.			trans	-54.3	120.4	171.6	-175.6	172.5	-163.6	80.6	0	110.9	N521 V542 T544 E565	K519-N521 PolarHBondContact O-N 3.4Å; K519-V542 WeakPolarHBondContact CB-O 3.41Å; K519-V542 PolarHBondContact N-O 2.91Å; K519-T544 WeakPolarHBondContact CA-OG1 3.19Å; K519-T544 WeakPolarHBondContact CB-OG1 3.41Å; K519-T544 PolarHBondContact N-OG1 3.48Å; K519-E565 WeakPolarHBondContact CG-OE1 3.17Å; K519-E565 IonicContact NZ-OE1 2.64Å; K519-E565 PolarHBondContact NZ-OE1 3.26Å; K519-E565 IonicContact NZ-OE2 2.64Å
520	M	68.1	Low	64.8	Low	108 Å²	108	104 Å²	104	53%	0.532	51%	0.511	S	S	.	.			trans	-85.9	92	-179.9	-169.1	61.4	172.3	0	0	110.1	K518 N522	K518-M520 PolarHBondContact O-N 2.94Å; M520-N522 PolarHBondContact O-N 2.77Å
521	N	57.1	Low	62.1	Low	97 Å²	97	111.9 Å²	111.9	52%	0.519	54%	0.544	S	S	.	.			trans	-60.8	103.8	177.4	-75.3	-17.7	0	0	0	110.8	K519 T523	K519-N521 PolarHBondContact O-N 3.4Å; N521-T523 VanDerWaalsContact C-N 3.25Å; N521-T523 PolarHBondContact O-N 3.21Å
522	N	46.7	Very low	60	Low	120 Å²	120	117.5 Å²	117.5	64%	0.642	58%	0.58	S	S	*	*			trans	-68.2	83.6	169.2	-75.8	-31.2	0	0	0	109.5	M520 L524 R584	M520-N522 PolarHBondContact O-N 2.77Å; N522-L524 VanDerWaalsContact C-N 3.29Å; N522-L524 PolarHBondContact O-N 3.48Å; N522-R584 PolarHBondContact OD1-NH1 3.4Å
523	T	38.3	Very low	57.3	Low	127 Å²	127	121.1 Å²	121.1	78%	0.779	59%	0.592	S	S	*	*			trans	-65	93.4	164.1	40.7	0	0	0	0	108.6	N521 R525	N521-T523 VanDerWaalsContact C-N 3.25Å; N521-T523 PolarHBondContact O-N 3.21Å; T523-R525 PolarHBondContact O-N 3.14Å
524	L	42.9	Very low	54.8	Low	147 Å²	147	126.2 Å²	126.2	77%	0.77	61%	0.612	S	S	*	*			trans	-46.8	127.8	170.2	-78.4	166.9	0	0	0	109.2	N522 K526	N522-L524 VanDerWaalsContact C-N 3.29Å; N522-L524 PolarHBondContact O-N 3.48Å; L524-K526 PolarHBondContact O-N 3.22Å
525	R	42	Very low	52	Low	255 Å²	255	130.8 Å²	130.8	96%	0.962	64%	0.641	S	S	*	*			trans	-63.3	81.7	172.7	-70.3	179.8	174	-179.7	-2.6	109.7	T523	T523-R525 PolarHBondContact O-N 3.14Å
526	K	37	Very low	49.4	Very low	189 Å²	189	135.6 Å²	135.6	82%	0.822	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-76.5	139.6	164.4	-76.2	-170.3	173.6	-177.8	0	108.8	L524	L524-K526 PolarHBondContact O-N 3.22Å
527	T	32.1	Very low	46.7	Very low	135 Å²	135	138.8 Å²	138.8	83%	0.828	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-59.6	156.2	-168.3	-30.9	0	0	0	0	112.9	Q529	T527-Q529 PolarHBondContact O-N 3.19Å
528	E	39.5	Very low	43.9	Very low	178 Å²	178	144.3 Å²	144.3	83%	0.832	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-50.8	124.1	174.9	-55.4	173.8	142	0	0	112.5
529	Q	37.1	Very low	41.7	Very low	186 Å²	186	144 Å²	144	87%	0.869	74%	0.742	S	S	*	*			trans	-165.3	99	147.3	-113.1	161.6	63.4	0	0	113.6	T527	T527-Q529 PolarHBondContact O-N 3.19Å
530	N	36.7	Very low	40	Very low	155 Å²	155	146.1 Å²	146.1	83%	0.829	76%	0.758	S	S	*	*			trans	18.9	102.6	147.9	-59.8	-20.9	0	0	0	119.7
531	K	30.7	Very low	39.5	Very low	205 Å²	205	144.1 Å²	144.1	89%	0.891	75%	0.754	S	S	*	*				-174.9	143.4	114.6	-102.5	168.7	-176.3	179.7	0	112.2
532	P	45.5	Very low	40.5	Very low	117 Å²	117	144.1 Å²	144.1	76%	0.76	76%	0.758	S	S	*	*			trans	-92.6	141.4	170.1	36.4	-32.2	0	0	0	111.6
533	E	33.9	Very low	42.4	Very low	143 Å²	143	141.5 Å²	141.5	67%	0.668	74%	0.743	S	S	*	*				170.3	137.9	105.8	-84.2	-140.9	138.4	0	0	113
534	K	39.4	Very low	44.8	Very low	165 Å²	165	135.8 Å²	135.8	72%	0.717	71%	0.708	S	S	*	*			trans	48.6	74.7	141.6	-57.6	170.4	-171.5	146.8	0	119.4
535	T	28.9	Very low	47	Very low	119 Å²	119	130.8 Å²	130.8	73%	0.73	68%	0.684	S	S	*	*				-136.7	115.9	117.8	29.3	0	0	0	0	109.3	E537	T535-E537 PolarHBondContact O-N 3.46Å
536	A	36.9	Very low	49.2	Very low	107 Å²	107	118.6 Å²	118.6	88%	0.884	64%	0.638	S	S	*	*			trans	-81.5	71.8	166.1	0	0	0	0	0	108.1	C538	A536-C538 PolarHBondContact O-N 3.05Å; A536-C538 VanDerWaalsContact O-N 3.11Å
537	E	32.3	Very low	51.7	Low	154 Å²	154	110.4 Å²	110.4	72%	0.72	60%	0.603	S	S	*	*			trans	-59.3	117.7	171.3	-66.8	-168.3	161.5	0	0	108.2	T535 V539	T535-E537 PolarHBondContact O-N 3.46Å; E537-V539 PolarHBondContact O-N 2.81Å
538	C	32	Very low	54.5	Low	116 Å²	116	104 Å²	104	78%	0.784	56%	0.564	S	S	*	*			trans	-72.6	83	177.1	-170.4	0	0	0	0	108.1	A536 L540	A536-C538 PolarHBondContact O-N 3.05Å; A536-C538 VanDerWaalsContact O-N 3.11Å; C538-L540 VanDerWaalsContact C-N 3.32Å; C538-L540 PolarHBondContact O-N 2.88Å
539	V	39.2	Very low	57.1	Low	103 Å²	103	95.5 Å²	95.5	62%	0.624	52%	0.524	S	S	*	.			trans	-61.3	97.9	173.7	-179.8	0	0	0	0	107.2	E537 S541	E537-V539 PolarHBondContact O-N 2.81Å; V539-S541 PolarHBondContact O-N 3.25Å
540	L	42.9	Very low	59.7	Low	143 Å²	143	87 Å²	87	75%	0.749	49%	0.485	S	S	*	.			trans	-50.1	116.8	176.7	-67.8	169.5	0	0	0	108	C538 V542	C538-L540 VanDerWaalsContact C-N 3.32Å; C538-L540 PolarHBondContact O-N 2.88Å; L540-V542 VanDerWaalsContact C-N 3.27Å; L540-V542 PolarHBondContact O-N 2.84Å
541	S	57.8	Low	62.3	Low	66 Å²	66	80 Å²	80	46%	0.462	45%	0.447	S	S	.	.			trans	-72.6	86.9	-176.7	64.8	0	0	0	0	109.3	K518 V539 L543	K518-S541 WeakPolarHBondContact CE-OG 3.27Å; V539-S541 PolarHBondContact O-N 3.25Å; S541-L543 PolarHBondContact O-N 2.91Å
542	V	79	Confident	65.1	Low	97 Å²	97	71.2 Å²	71.2	59%	0.588	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-51.9	130.1	178	-178.3	0	0	0	0	108.8	K519 L540	K519-V542 WeakPolarHBondContact CB-O 3.41Å; K519-V542 PolarHBondContact N-O 2.91Å; L540-V542 VanDerWaalsContact C-N 3.27Å; L540-V542 PolarHBondContact O-N 2.84Å
543	L	86	Confident	67.1	Low	65 Å²	65	68.7 Å²	68.7	34%	0.34	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-79.4	137.9	175.4	-58.4	-175.5	0	0	0	109.7	D496 R498 K516 L517 K518 S541	D496-L543 WeakPolarHBondContact O-CD1 3.41Å; R498-L543 HydrophobicContact CG-CD1 4.41Å; K516-L543 HydrophobicContact CB-CD2 3.94Å; L517-L543 CarbonylContact O-C 2.87Å; L517-L543 WeakPolarHBondContact O-CA 3.39Å; K518-L543 HydrophobicContact CG-CD2 3.91Å; S541-L543 PolarHBondContact O-N 2.91Å
544	T	88.4	Confident	69.5	Low	6 Å²	6	66.4 Å²	66.4	4%	0.037	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-99.5	132.2	175.3	-62.1	0	0	0	0	107.8	G497 L517 K519 G546 W564 E565	G497-T544 VanDerWaalsContact CA-O 3.25Å; G497-T544 WeakPolarHBondContact CA-O 3.45Å; L517-T544 WeakPolarHBondContact CB-O 3.22Å; L517-T544 PolarHBondContact O-N 3Å; K519-T544 WeakPolarHBondContact CA-OG1 3.19Å; K519-T544 WeakPolarHBondContact CB-OG1 3.41Å; K519-T544 PolarHBondContact N-OG1 3.48Å; T544-G546 PolarHBondContact O-N 2.82Å; T544-W564 HydrophobicContact CG2-CB 4.28Å; T544-E565 HydrophobicContact CG2-CB 4.25Å; T544-E565 HydrophobicContact CG2-CG 3.62Å; T544-E565 PolarHBondContact OG1-OE1 3.03Å
545	P	89.1	Confident	71.8	Confident	42 Å²	42	61.1 Å²	61.1	27%	0.273	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-56.5	132.9	176.9	-24.2	33	0	0	0	111.8	A495 W564	A495-P545 WeakPolarHBondContact O-CB 3.35Å; A495-P545 WeakPolarHBondContact O-CG 3.45Å; P545-W564 HydrophobicContact CB-CB 4.23Å; P545-W564 HydrophobicContact CG-CB 4.41Å; P545-W564 PolarHBondContact O-N 2.63Å
546	G	89	Confident	74.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	143.9	160.4	0	0	0	0	0	108.8	W470 V493 L517 T544 G562	W470-G546 VanDerWaalsContact CD1-O 3.27Å; V493-G546 VanDerWaalsContact CG1-C 3.44Å; V493-G546 WeakPolarHBondContact CG1-O 3.41Å; L517-G546 VanDerWaalsContact CD1-CA 3.44Å; T544-G546 PolarHBondContact O-N 2.82Å; G546-G562 WeakPolarHBondContact CA-O 3.27Å
547	L	89.4	Confident	76.9	Confident	16 Å²	16	53.6 Å²	53.6	8%	0.084	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-42.4	173.1	-70.2	-176.9	0	0	0	111.5	W470 G562 W564 P589 V590	W470-L547 VanDerWaalsContact CB-O 3.24Å; W470-L547 WeakPolarHBondContact CB-O 3.36Å; W470-L547 HydrophobicContact CD2-CD2 4.12Å; W470-L547 HydrophobicContact CG-CD2 3.99Å; L547-G562 PolarHBondContact N-O 2.78Å; L547-W564 HydrophobicContact CD1-CE3 3.88Å; L547-W564 HydrophobicContact CD1-CZ3 4.19Å; L547-W564 HydrophobicContact CD2-CE3 3.97Å; L547-W564 HydrophobicContact CD2-CZ3 4.19Å; L547-W564 HydrophobicContact CG-CE3 4.16Å; L547-P589 HydrophobicContact CD1-CB 3.6Å; L547-V590 WeakPolarHBondContact CB-O 3.44Å
548	C	90.7	Very high	79.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	162.7	-175	56.7	0	0	0	0	113.3	V365 T561 G562 V590	V365-C548 HydrophobicContact CG1-CB 3.98Å; C548-T561 CarbonylContact O-C 3.5Å; C548-T561 VanDerWaalsContact O-CA 3.23Å; C548-T561 WeakPolarHBondContact O-CA 3.3Å; C548-T561 WeakPolarHBondContact O-CB 3.44Å; C548-T561 PolarHBondContact O-OG1 2.83Å; C548-G562 PolarHBondContact O-N 2.88Å; C548-V590 PolarHBondContact SG-O 2.9Å; C548-V590 VanDerWaalsContact SG-O 3.37Å
549	F	93.3	Very high	82.6	Confident	1 Å²	1	42.2 Å²	42.2	0%	0.004	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	138.2	171.5	73.2	-75.9	0	0	0	112.7	Q471 R473 V493 F551 Y559 L560	Q471-F549 HydrophobicContact CB-CD1 3.9Å; Q471-F549 HydrophobicContact CB-CE1 3.75Å; Q471-F549 HydrophobicContact CG-CD1 3.79Å; Q471-F549 HydrophobicContact CG-CE1 3.52Å; Q471-F549 HydrophobicContact CG-CZ 4.4Å; Q471-F549 PolarHBondContact NE2-O 2.89Å; Q471-F549 PolarHBondContact OE1-O 2.64Å; R473-F549 HydrophobicContact CB-CE2 4.12Å; R473-F549 HydrophobicContact CB-CZ 3.76Å; V493-F549 HydrophobicContact CB-CD1 3.8Å; V493-F549 HydrophobicContact CB-CE1 4.12Å; V493-F549 HydrophobicContact CG2-CB 4.03Å; V493-F549 HydrophobicContact CG2-CD1 3.19Å; V493-F549 HydrophobicContact CG2-CE1 3.75Å; V493-F549 HydrophobicContact CG2-CG 3.77Å; F549-F551 HydrophobicContact CD2-CE2 4.3Å; F549-F551 HydrophobicContact CE2-CD2 4.23Å; F549-F551 AromaticContact CE2-CE2 3.73Å; F549-F551 HydrophobicContact CE2-CE2 3.73Å; F549-F551 HydrophobicContact CE2-CZ 4.39Å; F549-Y559 HydrophobicContact CB-CD2 4.44Å; F549-L560 CarbonylContact C-O 3.51Å; F549-L560 WeakPolarHBondContact CA-O 3.4Å; F549-L560 WeakPolarHBondContact CB-O 3.5Å
550	D	92	Very high	85.2	Confident	7 Å²	7	37.3 Å²	37.3	4%	0.037	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.5	176.5	-165.2	-8.2	0	0	0	111.7	R473 Y559 L560 I593 T594 W595	R473-D550 IonicContact CZ-OD1 3.89Å; R473-D550 VanDerWaalsContact NH1-CG 3.26Å; R473-D550 IonicContact NH1-OD1 3.73Å; R473-D550 PolarHBondContact NH1-OD1 2.75Å; R473-D550 IonicContact NH2-OD1 3.86Å; R473-D550 PolarHBondContact NH2-OD1 2.77Å; D550-Y559 CarbonylContact O-C 3.58Å; D550-Y559 VanDerWaalsContact O-CA 3.23Å; D550-Y559 WeakPolarHBondContact O-CA 3.35Å; D550-Y559 WeakPolarHBondContact O-CB 3.5Å; D550-L560 PolarHBondContact N-O 3.21Å; D550-L560 PolarHBondContact O-N 2.9Å; D550-I593 HydrophobicContact CB-CG2 4.3Å; D550-T594 WeakPolarHBondContact OD2-CA 3.42Å; D550-W595 PolarHBondContact O-NE1 3.44Å; D550-W595 VanDerWaalsContact O-NE1 3.14Å; D550-W595 PolarHBondContact OD2-N 3.44Å
551	F	91.8	Very high	87.6	Confident	7 Å²	7	30.5 Å²	30.5	3%	0.031	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	136.5	176.9	-81.5	-70	0	0	0	111.9	N475 Y491 F549 S556 Y559 W595	N475-F551 HydrophobicContact CB-CD2 3.72Å; N475-F551 HydrophobicContact CB-CE2 3.58Å; N475-F551 HydrophobicContact CB-CG 4.32Å; N475-F551 HydrophobicContact CB-CZ 4.11Å; N475-F551 WeakPolarHBondContact ND2-CD1 3.28Å; N475-F551 WeakPolarHBondContact ND2-CD2 3.46Å; N475-F551 WeakPolarHBondContact ND2-CE1 3.22Å; N475-F551 VanDerWaalsContact ND2-CG 3.26Å; N475-F551 WeakPolarHBondContact ND2-CG 3.39Å; N475-F551 WeakPolarHBondContact ND2-CZ 3.47Å; Y491-F551 HydrophobicContact CD1-CE2 4.25Å; Y491-F551 AromaticContact CD1-CZ 3.6Å; Y491-F551 HydrophobicContact CD1-CZ 3.6Å; Y491-F551 AromaticContact CD2-CE2 3.81Å; Y491-F551 HydrophobicContact CD2-CE2 3.81Å; Y491-F551 AromaticContact CD2-CZ 3.81Å; Y491-F551 HydrophobicContact CD2-CZ 3.81Å; Y491-F551 HydrophobicContact CE1-CE1 4.49Å; Y491-F551 AromaticContact CE1-CZ 3.74Å; Y491-F551 HydrophobicContact CE1-CZ 3.74Å; Y491-F551 HydrophobicContact CE2-CE2 4.3Å; Y491-F551 AromaticContact CE2-CZ 4Å; Y491-F551 HydrophobicContact CE2-CZ 4Å; Y491-F551 AromaticContact CG-CE2 3.8Å; Y491-F551 HydrophobicContact CG-CE2 3.8Å; Y491-F551 AromaticContact CG-CZ 3.62Å; Y491-F551 HydrophobicContact CG-CZ 3.62Å; Y491-F551 AromaticContact CZ-CZ 3.95Å; F549-F551 HydrophobicContact CD2-CE2 4.3Å; F549-F551 HydrophobicContact CE2-CD2 4.23Å; F549-F551 AromaticContact CE2-CE2 3.73Å; F549-F551 HydrophobicContact CE2-CE2 3.73Å; F549-F551 HydrophobicContact CE2-CZ 4.39Å; F551-S556 WeakPolarHBondContact CE1-O 3.47Å; F551-Y559 HydrophobicContact CD1-CD1 4.49Å; F551-Y559 AromaticContact CE1-CD1 3.95Å; F551-Y559 HydrophobicContact CE1-CD1 3.95Å; F551-Y559 HydrophobicContact CE1-CG 4.25Å; F551-W595 VanDerWaalsContact C-CD1 3.49Å
552	H	90.3	Very high	89.3	Confident	21 Å²	21	27.3 Å²	27.3	10%	0.097	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	127.7	179.6	175.8	-105.6	0	0	0	111.2	S554 D555 I558 W595	H552-S554 PolarHBondContact ND1-N 2.88Å; H552-S554 PolarHBondContact O-N 2.91Å; H552-D555 WeakPolarHBondContact ND1-CB 3.37Å; H552-D555 PolarHBondContact ND1-N 2.95Å; H552-D555 VanDerWaalsContact ND1-N 3.11Å; H552-D555 CarbonylContact O-C 3.08Å; H552-D555 PolarHBondContact O-N 3.41Å; H552-D555 VanDerWaalsContact O-N 3.09Å; H552-I558 HydrophobicContact CB-CB 4.09Å; H552-I558 HydrophobicContact CB-CG2 4.09Å; H552-I558 PolarHBondContact N-O 2.63Å; H552-W595 HydrophobicContact CB-CZ2 4.14Å; H552-W595 AromaticContact CD2-CH2 3.86Å; H552-W595 AromaticContact CD2-CZ3 3.92Å
553	P	85.9	Confident	90	Very high	65 Å²	65	22.8 Å²	22.8	42%	0.422	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-15.7	-170.1	-28.6	35.4	0	0	0	116.5	W595	P553-W595 HydrophobicContact CG-CB 3.69Å; P553-W595 HydrophobicContact CG-CG 4.28Å
554	S	85.8	Confident	90.2	Very high	94 Å²	94	26.4 Å²	26.4	66%	0.657	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.2	3.5	179.6	-47.7	0	0	0	0	114.3	H552	H552-S554 PolarHBondContact ND1-N 2.88Å; H552-S554 PolarHBondContact O-N 2.91Å
555	D	86.4	Confident	90.2	Very high	55 Å²	55	28.9 Å²	28.9	29%	0.294	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	101.3	174.8	-175.7	-7.2	0	0	0	110.1	H552 N557 I558	H552-D555 WeakPolarHBondContact ND1-CB 3.37Å; H552-D555 PolarHBondContact ND1-N 2.95Å; H552-D555 VanDerWaalsContact ND1-N 3.11Å; H552-D555 CarbonylContact O-C 3.08Å; H552-D555 PolarHBondContact O-N 3.41Å; H552-D555 VanDerWaalsContact O-N 3.09Å; D555-N557 PolarHBondContact O-N 3.04Å; D555-N557 VanDerWaalsContact O-N 3.1Å; D555-N557 WeakPolarHBondContact OD1-CB 3.19Å; D555-N557 PolarHBondContact OD1-N 2.9Å; D555-I558 HydrophobicContact CB-CB 4.46Å; D555-I558 HydrophobicContact CB-CD1 4.45Å; D555-I558 HydrophobicContact CB-CG1 4.5Å; D555-I558 PolarHBondContact O-N 2.97Å; D555-I558 VanDerWaalsContact O-N 3.11Å; D555-I558 VanDerWaalsContact OD2-CD1 3.24Å; D555-I558 WeakPolarHBondContact OD2-CD1 3.34Å; D555-I558 WeakPolarHBondContact OD2-CG1 3.48Å
556	S	84.9	Confident	90.3	Very high	21 Å²	21	27 Å²	27	15%	0.147	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	-10.9	-179.6	54	0	0	0	0	114.1	N475 Q476 F551	N475-S556 PolarHBondContact ND2-O 2.92Å; N475-S556 VanDerWaalsContact ND2-O 3.11Å; Q476-S556 WeakPolarHBondContact O-CB 3.36Å; Q476-S556 PolarHBondContact O-OG 2.82Å; F551-S556 WeakPolarHBondContact CE1-O 3.47Å
557	N	88.4	Confident	90.5	Very high	46 Å²	46	28.1 Å²	28.1	25%	0.246	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-7.1	175.5	-58.5	-69.5	0	0	0	113.8	Q477 D555 S572 C573	Q477-N557 PolarHBondContact NE2-OD1 3.36Å; D555-N557 PolarHBondContact O-N 3.04Å; D555-N557 VanDerWaalsContact O-N 3.1Å; D555-N557 WeakPolarHBondContact OD1-CB 3.19Å; D555-N557 PolarHBondContact OD1-N 2.9Å; N557-S572 CarbonylContact O-C 3.49Å; N557-S572 WeakPolarHBondContact O-CA 3.32Å; N557-S572 PolarHBondContact O-OG 3.44Å; N557-S572 VanDerWaalsContact O-OG 3.11Å; N557-C573 PolarHBondContact O-N 3.34Å
558	I	91.3	Very high	90.7	Very high	30 Å²	30	27.4 Å²	27.4	15%	0.154	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.2	177.4	-66.7	177.1	0	0	0	110.2	H552 D555 K570	H552-I558 HydrophobicContact CB-CB 4.09Å; H552-I558 HydrophobicContact CB-CG2 4.09Å; H552-I558 PolarHBondContact N-O 2.63Å; D555-I558 HydrophobicContact CB-CB 4.46Å; D555-I558 HydrophobicContact CB-CD1 4.45Å; D555-I558 HydrophobicContact CB-CG1 4.5Å; D555-I558 PolarHBondContact O-N 2.97Å; D555-I558 VanDerWaalsContact O-N 3.11Å; D555-I558 VanDerWaalsContact OD2-CD1 3.24Å; D555-I558 WeakPolarHBondContact OD2-CD1 3.34Å; D555-I558 WeakPolarHBondContact OD2-CG1 3.48Å; I558-K570 HydrophobicContact CG2-CG 4.39Å
559	Y	92.8	Very high	90.9	Very high	1 Å²	1	27.8 Å²	27.8	0%	0.004	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	152.6	172.3	61.8	-84.5	0	0	0	111.8	I499 M515 F549 D550 F551 C571	I499-Y559 HydrophobicContact CD1-CE2 3.72Å; I499-Y559 HydrophobicContact CG2-CE2 4.13Å; M515-Y559 WeakPolarHBondContact CB-OH 3.35Å; F549-Y559 HydrophobicContact CB-CD2 4.44Å; D550-Y559 CarbonylContact O-C 3.58Å; D550-Y559 VanDerWaalsContact O-CA 3.23Å; D550-Y559 WeakPolarHBondContact O-CA 3.35Å; D550-Y559 WeakPolarHBondContact O-CB 3.5Å; F551-Y559 HydrophobicContact CD1-CD1 4.49Å; F551-Y559 AromaticContact CE1-CD1 3.95Å; F551-Y559 HydrophobicContact CE1-CD1 3.95Å; F551-Y559 HydrophobicContact CE1-CG 4.25Å; Y559-C571 HydrophobicContact CD1-CB 4.26Å; Y559-C571 HydrophobicContact CD2-CB 3.85Å; Y559-C571 HydrophobicContact CE1-CB 3.83Å; Y559-C571 HydrophobicContact CE2-CB 3.36Å; Y559-C571 HydrophobicContact CG-CB 4.27Å; Y559-C571 PolarHBondContact N-O 3.3Å; Y559-C571 VanDerWaalsContact N-O 3.13Å; Y559-C571 PolarHBondContact O-N 2.85Å
560	L	94.1	Very high	90.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	155.8	166.5	-59	179.2	0	0	0	109.3	F549 D550 I568 H569 K570 Y583 I593 W595 F603	F549-L560 CarbonylContact C-O 3.51Å; F549-L560 WeakPolarHBondContact CA-O 3.4Å; F549-L560 WeakPolarHBondContact CB-O 3.5Å; D550-L560 PolarHBondContact N-O 3.21Å; D550-L560 PolarHBondContact O-N 2.9Å; L560-I568 HydrophobicContact CB-CG2 4.27Å; L560-H569 CarbonylContact C-O 3.56Å; L560-H569 WeakPolarHBondContact CA-O 3.47Å; L560-K570 HydrophobicContact CD2-CB 3.95Å; L560-K570 HydrophobicContact CD2-CG 4Å; L560-Y583 HydrophobicContact CD2-CE2 3.96Å; L560-I593 HydrophobicContact CB-CD1 4.38Å; L560-I593 HydrophobicContact CB-CG2 4.09Å; L560-I593 HydrophobicContact CD1-CG2 3.82Å; L560-W595 HydrophobicContact CD1-CD2 4.32Å; L560-W595 HydrophobicContact CD1-CH2 4.11Å; L560-W595 HydrophobicContact CD1-CZ2 3.52Å; L560-W595 HydrophobicContact CD2-CZ2 3.95Å; L560-W595 HydrophobicContact CG-CH2 4.37Å; L560-W595 HydrophobicContact CG-CZ2 3.49Å; L560-W595 VanDerWaalsContact CG-CZ2 3.49Å; L560-F603 HydrophobicContact CD1-CB 4.16Å; L560-F603 HydrophobicContact CD1-CD1 3.63Å; L560-F603 HydrophobicContact CD1-CD2 3.45Å; L560-F603 VanDerWaalsContact CD1-CD2 3.45Å; L560-F603 HydrophobicContact CD1-CE1 3.75Å; L560-F603 HydrophobicContact CD1-CE2 3.57Å; L560-F603 HydrophobicContact CD1-CG 3.48Å; L560-F603 VanDerWaalsContact CD1-CG 3.48Å; L560-F603 HydrophobicContact CD1-CZ 3.72Å
561	T	93.6	Very high	90.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	134.4	170.9	-179.4	0	0	0	0	112.1	I499 L517 C548 I568 H569	I499-T561 HydrophobicContact CD1-CG2 3.79Å; L517-T561 HydrophobicContact CD2-CG2 3.83Å; C548-T561 CarbonylContact O-C 3.5Å; C548-T561 VanDerWaalsContact O-CA 3.23Å; C548-T561 WeakPolarHBondContact O-CA 3.3Å; C548-T561 WeakPolarHBondContact O-CB 3.44Å; C548-T561 PolarHBondContact O-OG1 2.83Å; T561-I568 WeakPolarHBondContact O-CA 3.49Å; T561-H569 HydrophobicContact CG2-CB 4.01Å; T561-H569 PolarHBondContact N-O 3.27Å; T561-H569 PolarHBondContact O-N 3.11Å
562	G	93.2	Very high	90.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	131.8	-178.1	0	0	0	0	0	111.5	G546 L547 C548 I593	G546-G562 WeakPolarHBondContact CA-O 3.27Å; L547-G562 PolarHBondContact N-O 2.78Å; C548-G562 PolarHBondContact O-N 2.88Å; G562-I593 VanDerWaalsContact N-CD1 3.29Å
563	T	92.8	Very high	90.6	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	159.7	-177.5	62.6	0	0	0	0	112.6	L517 E565 G566 N567 V590	L517-T563 HydrophobicContact CD1-CG2 4.46Å; L517-T563 HydrophobicContact CD2-CG2 4.37Å; T563-E565 PolarHBondContact O-N 2.83Å; T563-E565 VanDerWaalsContact O-N 3.08Å; T563-E565 PolarHBondContact OG1-N 3.38Å; T563-G566 PolarHBondContact O-N 2.84Å; T563-N567 PolarHBondContact N-O 3.05Å; T563-N567 VanDerWaalsContact N-O 3.07Å; T563-N567 PolarHBondContact OG1-N 3.34Å; T563-N567 PolarHBondContact OG1-O 2.65Å; T563-V590 PolarHBondContact O-N 3.39Å; T563-V590 VanDerWaalsContact O-N 3.12Å
564	W	90.3	Very high	90.5	Very high	141 Å²	141	30.5 Å²	30.5	53%	0.534	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.2	168	-165.4	-87.7	0	0	0	113.9	T544 P545 L547 P589	T544-W564 HydrophobicContact CG2-CB 4.28Å; P545-W564 HydrophobicContact CB-CB 4.23Å; P545-W564 HydrophobicContact CG-CB 4.41Å; P545-W564 PolarHBondContact O-N 2.63Å; L547-W564 HydrophobicContact CD1-CE3 3.88Å; L547-W564 HydrophobicContact CD1-CZ3 4.19Å; L547-W564 HydrophobicContact CD2-CE3 3.97Å; L547-W564 HydrophobicContact CD2-CZ3 4.19Å; L547-W564 HydrophobicContact CG-CE3 4.16Å; W564-P589 HydrophobicContact CD2-CB 4.15Å; W564-P589 HydrophobicContact CD2-CG 3.6Å; W564-P589 HydrophobicContact CE3-CB 4.07Å; W564-P589 HydrophobicContact CE3-CG 3.91Å; W564-P589 HydrophobicContact CG-CB 4.48Å; W564-P589 HydrophobicContact CG-CG 3.97Å; W564-P589 HydrophobicContact CH2-CG 4.27Å; W564-P589 HydrophobicContact CZ2-CG 3.99Å; W564-P589 HydrophobicContact CZ3-CB 4.48Å; W564-P589 HydrophobicContact CZ3-CG 4.23Å; W564-P589 WeakPolarHBondContact O-CG 3.28Å
565	E	90	Very high	90.2	Very high	58 Å²	58	28.6 Å²	28.6	27%	0.271	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	7.6	-177.6	-73	175.2	-170.3	0	0	114.4	K519 T544 T563 N567	K519-E565 WeakPolarHBondContact CG-OE1 3.17Å; K519-E565 IonicContact NZ-OE1 2.64Å; K519-E565 PolarHBondContact NZ-OE1 3.26Å; K519-E565 IonicContact NZ-OE2 2.64Å; T544-E565 HydrophobicContact CG2-CB 4.25Å; T544-E565 HydrophobicContact CG2-CG 3.62Å; T544-E565 PolarHBondContact OG1-OE1 3.03Å; T563-E565 PolarHBondContact O-N 2.83Å; T563-E565 VanDerWaalsContact O-N 3.08Å; T563-E565 PolarHBondContact OG1-N 3.38Å; E565-N567 PolarHBondContact O-N 3.23Å
566	G	90.4	Very high	89.7	Confident	2 Å²	2	27.3 Å²	27.3	2%	0.021	15%	0.152	C	C	.	.	S	Bend	trans	76.8	2	-178.3	0	0	0	0	0	114.7	T563 C588	T563-G566 PolarHBondContact O-N 2.84Å; G566-C588 WeakPolarHBondContact CA-O 3.31Å; G566-C588 PolarHBondContact N-O 3.1Å
567	N	92.8	Very high	89.4	Confident	24 Å²	24	34.6 Å²	34.6	13%	0.128	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.8	172.9	-57.6	-77.6	0	0	0	110.3	T563 E565 T582 R584	T563-N567 PolarHBondContact N-O 3.05Å; T563-N567 VanDerWaalsContact N-O 3.07Å; T563-N567 PolarHBondContact OG1-N 3.34Å; T563-N567 PolarHBondContact OG1-O 2.65Å; E565-N567 PolarHBondContact O-N 3.23Å; N567-T582 HydrophobicContact CB-CG2 4.17Å; N567-R584 WeakPolarHBondContact OD1-CG 3.5Å
568	I	94.8	Very high	89.2	Confident	1 Å²	1	39 Å²	39	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123	168.7	-56.9	171.1	0	0	0	107.8	L560 T561 T582 Y583 V590 I593 F603 S605 W615	L560-I568 HydrophobicContact CB-CG2 4.27Å; T561-I568 WeakPolarHBondContact O-CA 3.49Å; I568-T582 CarbonylContact O-C 3.55Å; I568-T582 VanDerWaalsContact O-CA 3.29Å; I568-T582 WeakPolarHBondContact O-CA 3.24Å; I568-Y583 HydrophobicContact CB-CD2 4.26Å; I568-Y583 HydrophobicContact CG2-CD2 4.08Å; I568-Y583 PolarHBondContact N-O 3.49Å; I568-Y583 VanDerWaalsContact N-O 3.09Å; I568-Y583 PolarHBondContact O-N 2.67Å; I568-V590 HydrophobicContact CD1-CG1 4.28Å; I568-V590 HydrophobicContact CG1-CG1 4.18Å; I568-V590 HydrophobicContact CG1-CG2 3.98Å; I568-I593 HydrophobicContact CB-CD1 4.46Å; I568-I593 HydrophobicContact CD1-CD1 4.38Å; I568-I593 HydrophobicContact CD1-CG1 4.4Å; I568-I593 HydrophobicContact CG1-CD1 4.12Å; I568-I593 HydrophobicContact CG2-CD1 3.67Å; I568-F603 HydrophobicContact CD1-CE2 4.4Å; I568-S605 VanDerWaalsContact CD1-CB 3.45Å; I568-S605 WeakPolarHBondContact CD1-OG 3.22Å; I568-W615 HydrophobicContact CD1-CZ2 4.3Å
569	H	93.4	Very high	89	Confident	7 Å²	7	40.1 Å²	40.1	3%	0.032	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.9	178.9	-57.7	-69.7	0	0	0	110.9	L560 T561 F579 T582	L560-H569 CarbonylContact C-O 3.56Å; L560-H569 WeakPolarHBondContact CA-O 3.47Å; T561-H569 HydrophobicContact CG2-CB 4.01Å; T561-H569 PolarHBondContact N-O 3.27Å; T561-H569 PolarHBondContact O-N 3.11Å; H569-F579 HydrophobicContact CB-CB 4.29Å; H569-F579 HydrophobicContact CB-CD1 3.82Å; H569-F579 HydrophobicContact CB-CE1 4.28Å; H569-F579 HydrophobicContact CB-CG 3.96Å; H569-F579 AromaticContact CE1-CD2 3.83Å; H569-F579 AromaticContact CE1-CE2 3.7Å; H569-F579 AromaticContact CG-CD1 3.98Å; H569-F579 AromaticContact CG-CD2 3.99Å; H569-F579 AromaticContact CG-CG 3.91Å; H569-F579 AromaticContact ND1-CD2 3.43Å; H569-F579 WeakPolarHBondContact ND1-CD2 3.45Å; H569-F579 AromaticContact ND1-CE2 3.72Å; H569-F579 AromaticContact ND1-CG 3.72Å; H569-T582 WeakPolarHBondContact ND1-CG2 3.42Å; H569-T582 PolarHBondContact ND1-OG1 3.4Å
570	K	93.3	Very high	88.8	Confident	17 Å²	17	44.5 Å²	44.5	7%	0.074	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.5	167.8	-167.5	-178.7	-171.1	179.1	0	107.5	I558 L560 L580 E581 Y583 D618	I558-K570 HydrophobicContact CG2-CG 4.39Å; L560-K570 HydrophobicContact CD2-CB 3.95Å; L560-K570 HydrophobicContact CD2-CG 4Å; K570-L580 HydrophobicContact CB-CB 4.37Å; K570-L580 HydrophobicContact CG-CB 4.37Å; K570-L580 WeakPolarHBondContact O-CB 3.24Å; K570-L580 PolarHBondContact O-N 3.38Å; K570-E581 HydrophobicContact CB-CB 3.71Å; K570-E581 HydrophobicContact CD-CB 3.84Å; K570-E581 WeakPolarHBondContact CD-OE2 3.48Å; K570-E581 HydrophobicContact CG-CB 4.44Å; K570-E581 PolarHBondContact N-O 2.95Å; K570-E581 IonicContact NZ-OE2 2.76Å; K570-E581 PolarHBondContact NZ-OE2 3.22Å; K570-Y583 HydrophobicContact CB-CE2 4.33Å; K570-D618 IonicContact NZ-OD1 2.7Å; K570-D618 PolarHBondContact NZ-OD1 2.93Å
571	C	91.9	Very high	88.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	166	-170.9	-68.5	0	0	0	0	110.7	Y559	Y559-C571 HydrophobicContact CD1-CB 4.26Å; Y559-C571 HydrophobicContact CD2-CB 3.85Å; Y559-C571 HydrophobicContact CE1-CB 3.83Å; Y559-C571 HydrophobicContact CE2-CB 3.36Å; Y559-C571 HydrophobicContact CG-CB 4.27Å; Y559-C571 PolarHBondContact N-O 3.3Å; Y559-C571 VanDerWaalsContact N-O 3.13Å; Y559-C571 PolarHBondContact O-N 2.85Å
572	S	90.4	Very high	88.6	Confident	18 Å²	18	47.7 Å²	47.7	13%	0.126	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.9	171.2	174.6	0	0	0	0	111.7	N557 S574 N575	N557-S572 CarbonylContact O-C 3.49Å; N557-S572 WeakPolarHBondContact O-CA 3.32Å; N557-S572 PolarHBondContact O-OG 3.44Å; N557-S572 VanDerWaalsContact O-OG 3.11Å; S572-S574 PolarHBondContact O-N 3.11Å; S572-S574 PolarHBondContact OG-N 3.42Å; S572-N575 PolarHBondContact O-N 2.89Å
573	C	85.8	Confident	88.6	Confident	21 Å²	21	47.8 Å²	47.8	14%	0.142	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.6	173	-64.1	0	0	0	0	113.2	N557	N557-C573 PolarHBondContact O-N 3.34Å
574	S	84.3	Confident	88.6	Confident	103 Å²	103	53 Å²	53	72%	0.72	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-15.2	-180	-50.2	0	0	0	0	113.9	S572	S572-S574 PolarHBondContact O-N 3.11Å; S572-S574 PolarHBondContact OG-N 3.42Å
575	N	78.8	Confident	88.7	Confident	53 Å²	53	50.2 Å²	50.2	28%	0.283	26%	0.258	S	S	.	.	B	Isolated β-bridge	trans	-126.7	95	-177.3	179.1	4	0	0	0	111.2	M515 S572 H577 Q578	M515-N575 WeakPolarHBondContact CE-O 3.36Å; S572-N575 PolarHBondContact O-N 2.89Å; N575-H577 VanDerWaalsContact C-N 3.35Å; N575-H577 PolarHBondContact O-N 3.49Å; N575-H577 PolarHBondContact OD1-N 2.85Å; N575-Q578 PolarHBondContact OD1-N 2.92Å
576	G	76.2	Confident	88.8	Confident	29 Å²	29	48 Å²	48	30%	0.299	25%	0.248	S	C	.	.	S	Bend	trans	-89	16.3	-179	0	0	0	0	0	116.8	L514	L514-G576 WeakPolarHBondContact O-CA 3.38Å
577	H	78.1	Confident	88.8	Confident	173 Å²	173	56.1 Å²	56.1	80%	0.801	28%	0.283	S	S	*	.	S	Bend	trans	-124.3	-20.9	-172.2	-66.3	-17.4	0	0	0	114.5	N575	N575-H577 VanDerWaalsContact C-N 3.35Å; N575-H577 PolarHBondContact O-N 3.49Å; N575-H577 PolarHBondContact OD1-N 2.85Å
578	Q	84.4	Confident	88.8	Confident	138 Å²	138	57.1 Å²	57.1	65%	0.645	29%	0.291	S	S	*	.			trans	-141.9	143.1	-178.1	-64	-178.7	-7.8	0	0	110.9	N575	N575-Q578 PolarHBondContact OD1-N 2.92Å
579	F	87.9	Confident	88.7	Confident	55 Å²	55	58 Å²	58	24%	0.241	30%	0.297	C	S	.	.			trans	-74.6	139.9	167.5	-45.6	-51.1	0	0	0	109.3	M515 L517 H569	M515-F579 HydrophobicContact CE-CD1 4.25Å; M515-F579 HydrophobicContact CE-CE1 4.45Å; M515-F579 HydrophobicContact CG-CE1 4.09Å; M515-F579 HydrophobicContact SD-CD1 4.22Å; M515-F579 HydrophobicContact SD-CE1 3.83Å; L517-F579 HydrophobicContact CD2-CE1 4.02Å; L517-F579 HydrophobicContact CD2-CZ 4.33Å; H569-F579 HydrophobicContact CB-CB 4.29Å; H569-F579 HydrophobicContact CB-CD1 3.82Å; H569-F579 HydrophobicContact CB-CE1 4.28Å; H569-F579 HydrophobicContact CB-CG 3.96Å; H569-F579 AromaticContact CE1-CD2 3.83Å; H569-F579 AromaticContact CE1-CE2 3.7Å; H569-F579 AromaticContact CG-CD1 3.98Å; H569-F579 AromaticContact CG-CD2 3.99Å; H569-F579 AromaticContact CG-CG 3.91Å; H569-F579 AromaticContact ND1-CD2 3.43Å; H569-F579 WeakPolarHBondContact ND1-CD2 3.45Å; H569-F579 AromaticContact ND1-CE2 3.72Å; H569-F579 AromaticContact ND1-CG 3.72Å
580	L	89.4	Confident	88.7	Confident	93 Å²	93	57.7 Å²	57.7	49%	0.487	30%	0.295	S	S	.	.	S	Bend	trans	-72.8	-40.7	175.2	-58.3	178.6	0	0	0	111.2	K570	K570-L580 HydrophobicContact CB-CB 4.37Å; K570-L580 HydrophobicContact CG-CB 4.37Å; K570-L580 WeakPolarHBondContact O-CB 3.24Å; K570-L580 PolarHBondContact O-N 3.38Å
581	E	90.8	Very high	88.6	Confident	37 Å²	37	58.3 Å²	58.3	17%	0.173	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	164.2	-178	-160.1	170.6	-176.7	0	0	109.3	K570 Y583	K570-E581 HydrophobicContact CB-CB 3.71Å; K570-E581 HydrophobicContact CD-CB 3.84Å; K570-E581 WeakPolarHBondContact CD-OE2 3.48Å; K570-E581 HydrophobicContact CG-CB 4.44Å; K570-E581 PolarHBondContact N-O 2.95Å; K570-E581 IonicContact NZ-OE2 2.76Å; K570-E581 PolarHBondContact NZ-OE2 3.22Å; E581-Y583 HydrophobicContact CG-CE1 4.44Å; E581-Y583 PolarHBondContact OE2-OH 3.01Å
582	T	92.4	Very high	88.6	Confident	30 Å²	30	58.4 Å²	58.4	18%	0.184	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	110.2	175.2	-61.5	0	0	0	0	110.7	N567 I568 H569 R584	N567-T582 HydrophobicContact CB-CG2 4.17Å; I568-T582 CarbonylContact O-C 3.55Å; I568-T582 VanDerWaalsContact O-CA 3.29Å; I568-T582 WeakPolarHBondContact O-CA 3.24Å; H569-T582 WeakPolarHBondContact ND1-CG2 3.42Å; H569-T582 PolarHBondContact ND1-OG1 3.4Å; T582-R584 HydrophobicContact CG2-CG 3.96Å
583	Y	93.2	Very high	88.8	Confident	1 Å²	1	57.5 Å²	57.5	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135	175.8	-47.3	-85.9	0	0	0	109.3	L560 I568 K570 E581 F603 W615 C619	L560-Y583 HydrophobicContact CD2-CE2 3.96Å; I568-Y583 HydrophobicContact CB-CD2 4.26Å; I568-Y583 HydrophobicContact CG2-CD2 4.08Å; I568-Y583 PolarHBondContact N-O 3.49Å; I568-Y583 VanDerWaalsContact N-O 3.09Å; I568-Y583 PolarHBondContact O-N 2.67Å; K570-Y583 HydrophobicContact CB-CE2 4.33Å; E581-Y583 HydrophobicContact CG-CE1 4.44Å; E581-Y583 PolarHBondContact OE2-OH 3.01Å; Y583-F603 HydrophobicContact CD1-CZ 4.43Å; Y583-F603 AromaticContact CD2-CZ 3.84Å; Y583-F603 HydrophobicContact CD2-CZ 3.84Å; Y583-F603 HydrophobicContact CE1-CZ 4.28Å; Y583-F603 HydrophobicContact CE2-CE1 4.12Å; Y583-F603 AromaticContact CE2-CZ 3.65Å; Y583-F603 HydrophobicContact CE2-CZ 3.65Å; Y583-F603 HydrophobicContact CG-CZ 4.23Å; Y583-F603 AromaticContact CZ-CE1 3.99Å; Y583-F603 AromaticContact CZ-CZ 3.87Å; Y583-W615 AromaticContact CD1-CE3 3.9Å; Y583-W615 HydrophobicContact CD1-CE3 3.9Å; Y583-W615 HydrophobicContact CD1-CZ3 4.03Å; Y583-W615 HydrophobicContact CG-CE3 4.25Å; Y583-W615 HydrophobicContact CG-CZ3 4.23Å; Y583-C619 WeakPolarHBondContact CD1-O 3.46Å; Y583-C619 WeakPolarHBondContact CE1-O 2.99Å
584	R	92	Very high	89.1	Confident	113 Å²	113	57.1 Å²	57.1	43%	0.426	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	104.3	-172.8	-57.5	-167.5	-175.6	-171.8	-2.2	110.5	N522 N567 T582	N522-R584 PolarHBondContact OD1-NH1 3.4Å; N567-R584 WeakPolarHBondContact OD1-CG 3.5Å; T582-R584 HydrophobicContact CG2-CG 3.96Å
585	K	91.8	Very high	89.5	Confident	81 Å²	81	52.5 Å²	52.5	35%	0.352	26%	0.258	S	S	.	.			trans	-151	-40.5	-179	174.9	63.8	177.2	178.8	0	113	F587 Q613 W615 P622	K585-F587 WeakPolarHBondContact O-CE2 3.43Å; K585-Q613 HydrophobicContact CG-CG 3.84Å; K585-W615 HydrophobicContact CB-CH2 3.47Å; K585-W615 VanDerWaalsContact CB-CH2 3.47Å; K585-W615 HydrophobicContact CB-CZ2 3.8Å; K585-W615 HydrophobicContact CG-CH2 4.35Å; K585-W615 HydrophobicContact CG-CZ2 4.46Å; K585-P622 HydrophobicContact CD-CG 4.2Å; K585-P622 HydrophobicContact CG-CG 4.09Å
586	H	92	Very high	90	Very high	12 Å²	12	50 Å²	50	6%	0.056	24%	0.244	C	C	.	.			trans	-69.3	147.8	175.7	-70.4	-65.3	0	0	0	111.4	V590 S605 S607 D609 T611 Q613	H586-V590 HydrophobicContact CB-CG2 4.26Å; H586-S605 PolarHBondContact NE2-OG 3.34Å; H586-S607 WeakPolarHBondContact ND1-CB 3.47Å; H586-D609 WeakPolarHBondContact CA-OD2 3.44Å; H586-D609 WeakPolarHBondContact CB-OD2 3.39Å; H586-D609 IonicContact CE1-OD1 3.01Å; H586-D609 IonicContact CG-OD2 2.87Å; H586-D609 IonicContact ND1-OD1 2.85Å; H586-D609 PolarHBondContact ND1-OD1 2.63Å; H586-D609 IonicContact ND1-OD2 3.91Å; H586-D609 PolarHBondContact ND1-OD2 3.45Å; H586-T611 PolarHBondContact CE1-O 2.75Å; H586-T611 PolarHBondContact CE1-OG1 3.47Å; H586-T611 PolarHBondContact ND1-OG1 2.94Å; H586-Q613 VanDerWaalsContact CE1-CG 3.47Å; H586-Q613 WeakPolarHBondContact CE1-CG 3.39Å
587	F	91.7	Very high	90.5	Very high	172 Å²	172	52 Å²	52	75%	0.754	25%	0.252	S	S	*	.	S	Bend	trans	-108.1	-8.3	-179.2	-60.7	-80.2	0	0	0	113.1	K585 D609	K585-F587 WeakPolarHBondContact O-CE2 3.43Å; F587-D609 PolarHBondContact N-OD2 3.26Å
588	C	93.1	Very high	90.9	Very high	46 Å²	46	48.1 Å²	48.1	31%	0.311	24%	0.237	S	C	.	.	S	Bend	trans	-130.3	175.8	-179.4	-65.8	0	0	0	0	109.7	G566 V590 S607 D609	G566-C588 WeakPolarHBondContact CA-O 3.31Å; G566-C588 PolarHBondContact N-O 3.1Å; C588-V590 PolarHBondContact O-N 2.82Å; C588-S607 PolarHBondContact O-OG 3.01Å; C588-S607 VanDerWaalsContact O-OG 3.11Å; C588-D609 HydrophobicContact CB-CB 3.91Å
589	P	91.8	Very high	91	Very high	19 Å²	19	44 Å²	44	12%	0.123	22%	0.217	C	C	.	.			trans	-51.5	139.2	179.2	-28.5	35.9	0	0	0	113.1	L547 W564 N591 S607 S608	L547-P589 HydrophobicContact CD1-CB 3.6Å; W564-P589 HydrophobicContact CD2-CB 4.15Å; W564-P589 HydrophobicContact CD2-CG 3.6Å; W564-P589 HydrophobicContact CE3-CB 4.07Å; W564-P589 HydrophobicContact CE3-CG 3.91Å; W564-P589 HydrophobicContact CG-CB 4.48Å; W564-P589 HydrophobicContact CG-CG 3.97Å; W564-P589 HydrophobicContact CH2-CG 4.27Å; W564-P589 HydrophobicContact CZ2-CG 3.99Å; W564-P589 HydrophobicContact CZ3-CB 4.48Å; W564-P589 HydrophobicContact CZ3-CG 4.23Å; W564-P589 WeakPolarHBondContact O-CG 3.28Å; P589-N591 PolarHBondContact O-OD1 2.89Å; P589-S607 VanDerWaalsContact O-CA 3.31Å; P589-S607 WeakPolarHBondContact O-CA 3.47Å; P589-S607 VanDerWaalsContact O-CB 3.27Å; P589-S607 WeakPolarHBondContact O-CB 3.14Å; P589-S607 PolarHBondContact O-OG 2.93Å; P589-S608 PolarHBondContact O-N 2.82Å
590	V	94.1	Very high	91	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	109.8	173.7	-172.1	0	0	0	0	108.1	L547 C548 T563 I568 H586 C588 I593 C606	L547-V590 WeakPolarHBondContact CB-O 3.44Å; C548-V590 PolarHBondContact SG-O 2.9Å; C548-V590 VanDerWaalsContact SG-O 3.37Å; T563-V590 PolarHBondContact O-N 3.39Å; T563-V590 VanDerWaalsContact O-N 3.12Å; I568-V590 HydrophobicContact CD1-CG1 4.28Å; I568-V590 HydrophobicContact CG1-CG1 4.18Å; I568-V590 HydrophobicContact CG1-CG2 3.98Å; H586-V590 HydrophobicContact CB-CG2 4.26Å; C588-V590 PolarHBondContact O-N 2.82Å; V590-I593 HydrophobicContact CG1-CD1 4.22Å; V590-I593 HydrophobicContact CG1-CG1 3.82Å; V590-C606 WeakPolarHBondContact CG1-O 3.36Å
591	N	90.7	Very high	91	Very high	31 Å²	31	41.7 Å²	41.7	17%	0.166	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-41.6	-168.7	-60.9	-27.2	0	0	0	111.6	P589 C606 S608 V632 G633	P589-N591 PolarHBondContact O-OD1 2.89Å; N591-C606 PolarHBondContact N-O 3.05Å; N591-S608 PolarHBondContact ND2-N 3.11Å; N591-S608 PolarHBondContact ND2-OG 3.49Å; N591-S608 PolarHBondContact OD1-OG 3.09Å; N591-V632 PolarHBondContact ND2-O 2.87Å; N591-G633 VanDerWaalsContact CB-O 3.22Å; N591-G633 WeakPolarHBondContact CB-O 3.41Å
592	C	91.3	Very high	91.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.007	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	149.3	176.2	-175.3	0	0	0	0	110.7	S605 C606 E634 V635	C592-S605 WeakPolarHBondContact O-CA 3.48Å; C592-C606 PolarHBondContact O-N 2.79Å; C592-E634 HydrophobicContact CB-CG 4.36Å; C592-V635 HydrophobicContact CB-CG1 4.41Å
593	I	94.2	Very high	91.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.7	170.2	-65.9	163.5	0	0	0	106.1	D550 L560 G562 I568 V590 F603 L604	D550-I593 HydrophobicContact CB-CG2 4.3Å; L560-I593 HydrophobicContact CB-CD1 4.38Å; L560-I593 HydrophobicContact CB-CG2 4.09Å; L560-I593 HydrophobicContact CD1-CG2 3.82Å; G562-I593 VanDerWaalsContact N-CD1 3.29Å; I568-I593 HydrophobicContact CB-CD1 4.46Å; I568-I593 HydrophobicContact CD1-CD1 4.38Å; I568-I593 HydrophobicContact CD1-CG1 4.4Å; I568-I593 HydrophobicContact CG1-CD1 4.12Å; I568-I593 HydrophobicContact CG2-CD1 3.67Å; V590-I593 HydrophobicContact CG1-CD1 4.22Å; V590-I593 HydrophobicContact CG1-CG1 3.82Å; I593-F603 HydrophobicContact CG2-CD2 4.11Å; I593-L604 CarbonylContact C-O 3.56Å; I593-L604 WeakPolarHBondContact CA-O 3.38Å
594	T	92.4	Very high	91.3	Very high	12 Å²	12	38.7 Å²	38.7	7%	0.074	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	122.3	175.2	-176.1	0	0	0	0	113.2	D550 F603 L604 V635 W637	D550-T594 WeakPolarHBondContact OD2-CA 3.42Å; T594-F603 CarbonylContact O-C 3.51Å; T594-F603 VanDerWaalsContact O-CA 3.28Å; T594-F603 WeakPolarHBondContact O-CA 3.12Å; T594-F603 WeakPolarHBondContact O-CB 3.44Å; T594-L604 HydrophobicContact CG2-CB 3.97Å; T594-L604 PolarHBondContact N-O 3.32Å; T594-L604 PolarHBondContact O-N 3.3Å; T594-V635 HydrophobicContact CG2-CG1 4.16Å; T594-V635 WeakPolarHBondContact CG2-O 3.39Å; T594-W637 PolarHBondContact O-NE1 2.88Å
595	W	92.8	Very high	91.5	Very high	6 Å²	6	33.3 Å²	33.3	2%	0.023	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	145	170	-70.3	108	0	0	0	110.8	D550 F551 H552 P553 L560 P597 P600 F603 Q617 W637	D550-W595 PolarHBondContact O-NE1 3.44Å; D550-W595 VanDerWaalsContact O-NE1 3.14Å; D550-W595 PolarHBondContact OD2-N 3.44Å; F551-W595 VanDerWaalsContact C-CD1 3.49Å; H552-W595 HydrophobicContact CB-CZ2 4.14Å; H552-W595 AromaticContact CD2-CH2 3.86Å; H552-W595 AromaticContact CD2-CZ3 3.92Å; P553-W595 HydrophobicContact CG-CB 3.69Å; P553-W595 HydrophobicContact CG-CG 4.28Å; L560-W595 HydrophobicContact CD1-CD2 4.32Å; L560-W595 HydrophobicContact CD1-CH2 4.11Å; L560-W595 HydrophobicContact CD1-CZ2 3.52Å; L560-W595 HydrophobicContact CD2-CZ2 3.95Å; L560-W595 HydrophobicContact CG-CH2 4.37Å; L560-W595 HydrophobicContact CG-CZ2 3.49Å; L560-W595 VanDerWaalsContact CG-CZ2 3.49Å; W595-P597 WeakPolarHBondContact O-CD 3.01Å; W595-P600 WeakPolarHBondContact CZ3-O 3.48Å; W595-F603 HydrophobicContact CD2-CB 3.95Å; W595-F603 HydrophobicContact CE3-CB 3.74Å; W595-F603 HydrophobicContact CE3-CD1 4.02Å; W595-F603 HydrophobicContact CE3-CG 4.3Å; W595-F603 HydrophobicContact CG-CB 4.35Å; W595-F603 AromaticContact CH2-CD1 3.95Å; W595-F603 HydrophobicContact CH2-CD1 3.95Å; W595-F603 HydrophobicContact CH2-CE1 4.42Å; W595-F603 HydrophobicContact CZ3-CB 4.28Å; W595-F603 AromaticContact CZ3-CD1 3.65Å; W595-F603 HydrophobicContact CZ3-CD1 3.65Å; W595-F603 HydrophobicContact CZ3-CE1 4.47Å; W595-F603 HydrophobicContact CZ3-CG 4.37Å; W595-Q617 HydrophobicContact CH2-CB 4.45Å; W595-Q617 HydrophobicContact CZ3-CB 4.41Å; W595-W637 VanDerWaalsContact C-CD1 3.47Å
596	C	90.6	Very high	91.6	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.007	16%	0.158	C	C	.	.			trans	-72.5	118.5	175.5	-175.4	0	0	0	0	109.7	L598 H599 V602 W637	C596-L598 PolarHBondContact O-N 2.87Å; C596-H599 HydrophobicContact CB-CB 4.37Å; C596-H599 CarbonylContact O-C 3.53Å; C596-H599 PolarHBondContact O-N 3.07Å; C596-V602 HydrophobicContact CB-CB 4.25Å; C596-V602 HydrophobicContact CB-CG1 4.3Å; C596-V602 WeakPolarHBondContact CB-O 3.4Å; C596-V602 PolarHBondContact N-O 2.69Å; C596-W637 HydrophobicContact CB-CD2 4.06Å; C596-W637 HydrophobicContact CB-CG 4.33Å; C596-W637 HydrophobicContact CB-CZ2 3.98Å
597	P	85.4	Confident	91.7	Very high	71 Å²	71	28.9 Å²	28.9	46%	0.461	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.8	-176.9	27.3	-34.8	0	0	0	113.1	W595 W637	W595-P597 WeakPolarHBondContact O-CD 3.01Å; P597-W637 HydrophobicContact CG-CB 4.34Å
598	L	86.4	Confident	91.7	Very high	92 Å²	92	22.9 Å²	22.9	48%	0.482	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-8.7	-178.3	-63.6	170.6	0	0	0	113.4	C596 A642	C596-L598 PolarHBondContact O-N 2.87Å; L598-A642 HydrophobicContact CB-CB 3.92Å; L598-A642 HydrophobicContact CD1-CB 4.07Å
599	H	87.4	Confident	91.6	Very high	51 Å²	51	22.1 Å²	22.1	24%	0.236	13%	0.127	C	C	.	.			trans	-147.1	100.4	179.2	-166.8	-58.9	0	0	0	111.1	C596 D601 V602	C596-H599 HydrophobicContact CB-CB 4.37Å; C596-H599 CarbonylContact O-C 3.53Å; C596-H599 PolarHBondContact O-N 3.07Å; H599-D601 VanDerWaalsContact C-N 3.34Å; H599-D601 IonicContact CE1-OD2 2.79Å; H599-D601 PolarHBondContact ND1-N 3.22Å; H599-D601 PolarHBondContact O-N 3.5Å; H599-V602 PolarHBondContact O-N 2.7Å; H599-V602 VanDerWaalsContact O-N 3.14Å
600	P	86.6	Confident	91.7	Very high	45 Å²	45	22.5 Å²	22.5	29%	0.292	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-37	-168.7	22	-32.8	0	0	0	113.8	W595 V602	W595-P600 WeakPolarHBondContact CZ3-O 3.48Å; P600-V602 PolarHBondContact O-N 2.83Å
601	D	90.1	Very high	91.7	Very high	55 Å²	55	23.6 Å²	23.6	29%	0.294	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-2.6	179.9	-49.9	-5.4	0	0	0	115.3	H599 K616 Q617	H599-D601 VanDerWaalsContact C-N 3.34Å; H599-D601 IonicContact CE1-OD2 2.79Å; H599-D601 PolarHBondContact ND1-N 3.22Å; H599-D601 PolarHBondContact O-N 3.5Å; D601-K616 VanDerWaalsContact CB-CE 3.49Å; D601-K616 HydrophobicContact CB-CG 4.09Å; D601-K616 CarbonylContact O-C 3.54Å; D601-K616 WeakPolarHBondContact O-CA 3.47Å; D601-K616 WeakPolarHBondContact O-CG 3.1Å; D601-K616 WeakPolarHBondContact OD2-CE 3.26Å; D601-K616 IonicContact OD2-NZ 2.68Å; D601-K616 PolarHBondContact OD2-NZ 2.85Å; D601-K616 VanDerWaalsContact OD2-NZ 3.14Å; D601-Q617 HydrophobicContact CB-CB 4.33Å; D601-Q617 WeakPolarHBondContact O-CB 3.31Å; D601-Q617 PolarHBondContact O-N 2.89Å
602	V	93.6	Very high	91.9	Very high	5 Å²	5	22.1 Å²	22.1	3%	0.03	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.4	-165.6	172.4	0	0	0	0	111.6	C596 H599 P600 L614 W615 W637 F722	C596-V602 HydrophobicContact CB-CB 4.25Å; C596-V602 HydrophobicContact CB-CG1 4.3Å; C596-V602 WeakPolarHBondContact CB-O 3.4Å; C596-V602 PolarHBondContact N-O 2.69Å; H599-V602 PolarHBondContact O-N 2.7Å; H599-V602 VanDerWaalsContact O-N 3.14Å; P600-V602 PolarHBondContact O-N 2.83Å; V602-L614 HydrophobicContact CG1-CD1 3.65Å; V602-W615 WeakPolarHBondContact CA-O 3.2Å; V602-W637 HydrophobicContact CG1-CH2 4.31Å; V602-W637 HydrophobicContact CG1-CZ2 3.87Å; V602-F722 HydrophobicContact CG2-CE2 4.45Å
603	F	94.8	Very high	92.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	155.6	175.5	66.7	-86.2	0	0	0	112.9	L560 I568 Y583 I593 T594 W595 W615	L560-F603 HydrophobicContact CD1-CB 4.16Å; L560-F603 HydrophobicContact CD1-CD1 3.63Å; L560-F603 HydrophobicContact CD1-CD2 3.45Å; L560-F603 VanDerWaalsContact CD1-CD2 3.45Å; L560-F603 HydrophobicContact CD1-CE1 3.75Å; L560-F603 HydrophobicContact CD1-CE2 3.57Å; L560-F603 HydrophobicContact CD1-CG 3.48Å; L560-F603 VanDerWaalsContact CD1-CG 3.48Å; L560-F603 HydrophobicContact CD1-CZ 3.72Å; I568-F603 HydrophobicContact CD1-CE2 4.4Å; Y583-F603 HydrophobicContact CD1-CZ 4.43Å; Y583-F603 AromaticContact CD2-CZ 3.84Å; Y583-F603 HydrophobicContact CD2-CZ 3.84Å; Y583-F603 HydrophobicContact CE1-CZ 4.28Å; Y583-F603 HydrophobicContact CE2-CE1 4.12Å; Y583-F603 AromaticContact CE2-CZ 3.65Å; Y583-F603 HydrophobicContact CE2-CZ 3.65Å; Y583-F603 HydrophobicContact CG-CZ 4.23Å; Y583-F603 AromaticContact CZ-CE1 3.99Å; Y583-F603 AromaticContact CZ-CZ 3.87Å; I593-F603 HydrophobicContact CG2-CD2 4.11Å; T594-F603 CarbonylContact O-C 3.51Å; T594-F603 VanDerWaalsContact O-CA 3.28Å; T594-F603 WeakPolarHBondContact O-CA 3.12Å; T594-F603 WeakPolarHBondContact O-CB 3.44Å; W595-F603 HydrophobicContact CD2-CB 3.95Å; W595-F603 HydrophobicContact CE3-CB 3.74Å; W595-F603 HydrophobicContact CE3-CD1 4.02Å; W595-F603 HydrophobicContact CE3-CG 4.3Å; W595-F603 HydrophobicContact CG-CB 4.35Å; W595-F603 AromaticContact CH2-CD1 3.95Å; W595-F603 HydrophobicContact CH2-CD1 3.95Å; W595-F603 HydrophobicContact CH2-CE1 4.42Å; W595-F603 HydrophobicContact CZ3-CB 4.28Å; W595-F603 AromaticContact CZ3-CD1 3.65Å; W595-F603 HydrophobicContact CZ3-CD1 3.65Å; W595-F603 HydrophobicContact CZ3-CE1 4.47Å; W595-F603 HydrophobicContact CZ3-CG 4.37Å; F603-W615 HydrophobicContact CD1-CB 3.74Å; F603-W615 HydrophobicContact CD2-CB 3.84Å; F603-W615 AromaticContact CD2-CD1 3.51Å; F603-W615 AromaticContact CD2-CG 3.88Å; F603-W615 HydrophobicContact CD2-CG 3.88Å; F603-W615 HydrophobicContact CE1-CB 3.41Å; F603-W615 VanDerWaalsContact CE1-CB 3.41Å; F603-W615 HydrophobicContact CE1-CG 4.11Å; F603-W615 HydrophobicContact CE2-CB 3.52Å; F603-W615 AromaticContact CE2-CD1 3.19Å; F603-W615 HydrophobicContact CE2-CD2 4.07Å; F603-W615 AromaticContact CE2-CG 3.31Å; F603-W615 HydrophobicContact CE2-CG 3.31Å; F603-W615 AromaticContact CE2-NE1 3.81Å; F603-W615 HydrophobicContact CG-CB 3.95Å; F603-W615 HydrophobicContact CG-CG 4.48Å; F603-W615 HydrophobicContact CZ-CB 3.29Å; F603-W615 AromaticContact CZ-CD1 3.85Å; F603-W615 HydrophobicContact CZ-CD2 4.05Å; F603-W615 AromaticContact CZ-CG 3.45Å; F603-W615 HydrophobicContact CZ-CG 3.45Å; F603-W615 VanDerWaalsContact CZ-CG 3.45Å; F603-W615 PolarHBondContact N-O 2.88Å; F603-W615 PolarHBondContact O-N 3.27Å
604	L	94.9	Very high	92.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	154.2	168.9	-73.4	164.2	0	0	0	109.9	I593 T594 I612 Q613 L614 V635 W637 F645	I593-L604 CarbonylContact C-O 3.56Å; I593-L604 WeakPolarHBondContact CA-O 3.38Å; T594-L604 HydrophobicContact CG2-CB 3.97Å; T594-L604 PolarHBondContact N-O 3.32Å; T594-L604 PolarHBondContact O-N 3.3Å; L604-I612 HydrophobicContact CD2-CG2 3.92Å; L604-Q613 CarbonylContact C-O 3.52Å; L604-Q613 WeakPolarHBondContact CA-O 3.42Å; L604-L614 HydrophobicContact CD2-CB 4.1Å; L604-L614 HydrophobicContact CD2-CD1 3.81Å; L604-L614 HydrophobicContact CG-CD1 4.21Å; L604-V635 HydrophobicContact CB-CG1 4.3Å; L604-V635 HydrophobicContact CB-CG2 4.33Å; L604-V635 HydrophobicContact CD1-CG2 3.91Å; L604-W637 HydrophobicContact CD1-CD2 3.77Å; L604-W637 VanDerWaalsContact CD1-CE2 3.4Å; L604-W637 HydrophobicContact CD1-CE3 4.21Å; L604-W637 HydrophobicContact CD1-CG 4.32Å; L604-W637 HydrophobicContact CD1-CH2 4.06Å; L604-W637 HydrophobicContact CD1-CZ2 3.59Å; L604-W637 HydrophobicContact CD1-CZ3 4.33Å; L604-W637 HydrophobicContact CD2-CZ2 4.32Å; L604-W637 HydrophobicContact CG-CH2 4.21Å; L604-W637 HydrophobicContact CG-CZ2 3.5Å; L604-F645 HydrophobicContact CD1-CB 3.6Å; L604-F645 HydrophobicContact CD1-CD1 4.06Å; L604-F645 HydrophobicContact CD1-CD2 3.95Å; L604-F645 HydrophobicContact CD1-CG 3.61Å
605	S	95	Very high	92.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.3	162	64.2	0	0	0	0	110.8	I568 H586 C592 I612 Q613 W615	I568-S605 VanDerWaalsContact CD1-CB 3.45Å; I568-S605 WeakPolarHBondContact CD1-OG 3.22Å; H586-S605 PolarHBondContact NE2-OG 3.34Å; C592-S605 WeakPolarHBondContact O-CA 3.48Å; S605-I612 CarbonylContact O-C 3.56Å; S605-I612 WeakPolarHBondContact O-CA 3.23Å; S605-Q613 PolarHBondContact N-O 3.08Å; S605-Q613 PolarHBondContact O-N 2.98Å; S605-W615 PolarHBondContact OG-NE1 3.14Å
606	C	94	Very high	92.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.5	173.9	78.2	0	0	0	0	111.6	V590 N591 C592 I612 V632 V635	V590-C606 WeakPolarHBondContact CG1-O 3.36Å; N591-C606 PolarHBondContact N-O 3.05Å; C592-C606 PolarHBondContact O-N 2.79Å; C606-I612 HydrophobicContact CB-CG1 4.31Å; C606-V632 HydrophobicContact CB-CB 3.87Å; C606-V632 HydrophobicContact CB-CG1 3.61Å; C606-V635 HydrophobicContact CB-CB 3.97Å; C606-V635 HydrophobicContact CB-CG1 3.69Å
607	S	94.1	Very high	92	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	158.5	-175.5	178.4	0	0	0	0	112.3	H586 C588 P589 D609 S610 T611 V632	H586-S607 WeakPolarHBondContact ND1-CB 3.47Å; C588-S607 PolarHBondContact O-OG 3.01Å; C588-S607 VanDerWaalsContact O-OG 3.11Å; P589-S607 VanDerWaalsContact O-CA 3.31Å; P589-S607 WeakPolarHBondContact O-CA 3.47Å; P589-S607 VanDerWaalsContact O-CB 3.27Å; P589-S607 WeakPolarHBondContact O-CB 3.14Å; P589-S607 PolarHBondContact O-OG 2.93Å; S607-D609 WeakPolarHBondContact CB-OD1 3.13Å; S607-D609 PolarHBondContact O-N 3.2Å; S607-D609 PolarHBondContact OG-N 3.14Å; S607-S610 PolarHBondContact O-N 3.04Å; S607-S610 VanDerWaalsContact O-N 3.1Å; S607-T611 PolarHBondContact N-O 3.01Å; S607-V632 PolarHBondContact O-N 2.93Å
608	S	92	Very high	92	Very high	46 Å²	46	28.4 Å²	28.4	32%	0.322	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-3.9	168.5	-54.1	0	0	0	0	114.2	P589 N591 S610	P589-S608 PolarHBondContact O-N 2.82Å; N591-S608 PolarHBondContact ND2-N 3.11Å; N591-S608 PolarHBondContact ND2-OG 3.49Å; N591-S608 PolarHBondContact OD1-OG 3.09Å; S608-S610 PolarHBondContact O-N 2.75Å
609	D	92.3	Very high	92.2	Very high	30 Å²	30	26.3 Å²	26.3	16%	0.16	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	5.4	167.5	66.5	25	0	0	0	114.1	H586 F587 C588 S607 T611	H586-D609 WeakPolarHBondContact CA-OD2 3.44Å; H586-D609 WeakPolarHBondContact CB-OD2 3.39Å; H586-D609 IonicContact CE1-OD1 3.01Å; H586-D609 IonicContact CG-OD2 2.87Å; H586-D609 IonicContact ND1-OD1 2.85Å; H586-D609 PolarHBondContact ND1-OD1 2.63Å; H586-D609 IonicContact ND1-OD2 3.91Å; H586-D609 PolarHBondContact ND1-OD2 3.45Å; F587-D609 PolarHBondContact N-OD2 3.26Å; C588-D609 HydrophobicContact CB-CB 3.91Å; S607-D609 WeakPolarHBondContact CB-OD1 3.13Å; S607-D609 PolarHBondContact O-N 3.2Å; S607-D609 PolarHBondContact OG-N 3.14Å; D609-T611 PolarHBondContact O-N 2.9Å; D609-T611 WeakPolarHBondContact OD1-CB 3.46Å; D609-T611 PolarHBondContact OD1-N 3.18Å; D609-T611 PolarHBondContact OD1-OG1 3.24Å
610	S	92.6	Very high	92.2	Very high	27 Å²	27	29 Å²	29	19%	0.189	16%	0.162	C	C	.	.	S	Bend	trans	66.6	18.7	-179.3	-41.1	0	0	0	0	114	S607 S608 S628 Q630	S607-S610 PolarHBondContact O-N 3.04Å; S607-S610 VanDerWaalsContact O-N 3.1Å; S608-S610 PolarHBondContact O-N 2.75Å; S610-S628 PolarHBondContact O-N 3.48Å; S610-Q630 VanDerWaalsContact CB-O 3.28Å; S610-Q630 WeakPolarHBondContact CB-O 3.3Å; S610-Q630 PolarHBondContact OG-O 3.29Å
611	T	94	Very high	92.4	Very high	23 Å²	23	32.8 Å²	32.8	14%	0.141	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	152.7	174.5	77	0	0	0	0	112.9	H586 S607 D609 Q613 F626	H586-T611 PolarHBondContact CE1-O 2.75Å; H586-T611 PolarHBondContact CE1-OG1 3.47Å; H586-T611 PolarHBondContact ND1-OG1 2.94Å; S607-T611 PolarHBondContact N-O 3.01Å; D609-T611 PolarHBondContact O-N 2.9Å; D609-T611 WeakPolarHBondContact OD1-CB 3.46Å; D609-T611 PolarHBondContact OD1-N 3.18Å; D609-T611 PolarHBondContact OD1-OG1 3.24Å; T611-Q613 PolarHBondContact OG1-NE2 3.5Å; T611-F626 WeakPolarHBondContact CA-O 3.06Å; T611-F626 WeakPolarHBondContact CB-O 3.27Å
612	I	95.2	Very high	92.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.1	171	-51.2	172.4	0	0	0	106.8	L604 S605 C606 F626 V632 V635 F645 A647	L604-I612 HydrophobicContact CD2-CG2 3.92Å; S605-I612 CarbonylContact O-C 3.56Å; S605-I612 WeakPolarHBondContact O-CA 3.23Å; C606-I612 HydrophobicContact CB-CG1 4.31Å; I612-F626 HydrophobicContact CB-CB 4.29Å; I612-F626 HydrophobicContact CB-CD2 4.17Å; I612-F626 HydrophobicContact CG2-CD2 4.27Å; I612-F626 PolarHBondContact N-O 3.36Å; I612-F626 PolarHBondContact O-N 3.12Å; I612-V632 HydrophobicContact CD1-CG1 4.27Å; I612-V632 HydrophobicContact CD1-CG2 4.38Å; I612-V632 HydrophobicContact CG1-CG1 4.23Å; I612-V632 HydrophobicContact CG1-CG2 3.95Å; I612-V635 HydrophobicContact CG2-CG2 4.07Å; I612-F645 HydrophobicContact CD1-CE2 4.03Å; I612-F645 HydrophobicContact CG2-CE2 4.26Å; I612-A647 HydrophobicContact CD1-CB 3.44Å; I612-A647 VanDerWaalsContact CD1-CB 3.44Å
613	Q	95.3	Very high	92.5	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.009	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.8	-176.7	-56.4	-64.2	-40.9	0	0	109.2	K585 H586 L604 S605 T611 W615 P622 S625	K585-Q613 HydrophobicContact CG-CG 3.84Å; H586-Q613 VanDerWaalsContact CE1-CG 3.47Å; H586-Q613 WeakPolarHBondContact CE1-CG 3.39Å; L604-Q613 CarbonylContact C-O 3.52Å; L604-Q613 WeakPolarHBondContact CA-O 3.42Å; S605-Q613 PolarHBondContact N-O 3.08Å; S605-Q613 PolarHBondContact O-N 2.98Å; T611-Q613 PolarHBondContact OG1-NE2 3.5Å; Q613-W615 HydrophobicContact CB-CZ2 3.9Å; Q613-W615 VanDerWaalsContact CB-NE1 3.35Å; Q613-W615 HydrophobicContact CG-CZ2 4.3Å; Q613-W615 VanDerWaalsContact O-CD1 3.24Å; Q613-W615 PolarHBondContact O-NE1 3.3Å; Q613-P622 HydrophobicContact CB-CB 4.24Å; Q613-S625 PolarHBondContact NE2-OG 3.07Å; Q613-S625 VanDerWaalsContact OE1-CB 3.25Å; Q613-S625 PolarHBondContact OE1-OG 3.47Å
614	L	95.4	Very high	92.4	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126.5	170.2	-179	68.5	0	0	0	108.9	V602 L604 P622 L623 L624 F626 W637 L658	V602-L614 HydrophobicContact CG1-CD1 3.65Å; L604-L614 HydrophobicContact CD2-CB 4.1Å; L604-L614 HydrophobicContact CD2-CD1 3.81Å; L604-L614 HydrophobicContact CG-CD1 4.21Å; L614-P622 CarbonylContact O-C 3.51Å; L614-P622 WeakPolarHBondContact O-CA 3.34Å; L614-P622 WeakPolarHBondContact O-CB 3.19Å; L614-L623 HydrophobicContact CD2-CB 4.41Å; L614-L623 HydrophobicContact CD2-CD1 4.43Å; L614-L623 HydrophobicContact CG-CB 4.45Å; L614-L623 HydrophobicContact CG-CD1 4.5Å; L614-L623 PolarHBondContact O-N 2.77Å; L614-L624 HydrophobicContact CB-CB 4.12Å; L614-L624 HydrophobicContact CD2-CB 4.36Å; L614-L624 HydrophobicContact CD2-CD1 4.04Å; L614-L624 HydrophobicContact CD2-CG 4.38Å; L614-L624 PolarHBondContact N-O 2.85Å; L614-L624 PolarHBondContact O-N 3.01Å; L614-F626 HydrophobicContact CB-CE2 4.04Å; L614-W637 HydrophobicContact CD1-CH2 3.72Å; L614-W637 HydrophobicContact CD1-CZ2 3.66Å; L614-L658 HydrophobicContact CD2-CD1 4.19Å
615	W	95.1	Very high	92.3	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	152.8	-175.8	-57.3	91.9	0	0	0	111.5	I568 Y583 K585 V602 F603 S605 Q613 I620 P622	I568-W615 HydrophobicContact CD1-CZ2 4.3Å; Y583-W615 AromaticContact CD1-CE3 3.9Å; Y583-W615 HydrophobicContact CD1-CE3 3.9Å; Y583-W615 HydrophobicContact CD1-CZ3 4.03Å; Y583-W615 HydrophobicContact CG-CE3 4.25Å; Y583-W615 HydrophobicContact CG-CZ3 4.23Å; K585-W615 HydrophobicContact CB-CH2 3.47Å; K585-W615 VanDerWaalsContact CB-CH2 3.47Å; K585-W615 HydrophobicContact CB-CZ2 3.8Å; K585-W615 HydrophobicContact CG-CH2 4.35Å; K585-W615 HydrophobicContact CG-CZ2 4.46Å; V602-W615 WeakPolarHBondContact CA-O 3.2Å; F603-W615 HydrophobicContact CD1-CB 3.74Å; F603-W615 HydrophobicContact CD2-CB 3.84Å; F603-W615 AromaticContact CD2-CD1 3.51Å; F603-W615 AromaticContact CD2-CG 3.88Å; F603-W615 HydrophobicContact CD2-CG 3.88Å; F603-W615 HydrophobicContact CE1-CB 3.41Å; F603-W615 VanDerWaalsContact CE1-CB 3.41Å; F603-W615 HydrophobicContact CE1-CG 4.11Å; F603-W615 HydrophobicContact CE2-CB 3.52Å; F603-W615 AromaticContact CE2-CD1 3.19Å; F603-W615 HydrophobicContact CE2-CD2 4.07Å; F603-W615 AromaticContact CE2-CG 3.31Å; F603-W615 HydrophobicContact CE2-CG 3.31Å; F603-W615 AromaticContact CE2-NE1 3.81Å; F603-W615 HydrophobicContact CG-CB 3.95Å; F603-W615 HydrophobicContact CG-CG 4.48Å; F603-W615 HydrophobicContact CZ-CB 3.29Å; F603-W615 AromaticContact CZ-CD1 3.85Å; F603-W615 HydrophobicContact CZ-CD2 4.05Å; F603-W615 AromaticContact CZ-CG 3.45Å; F603-W615 HydrophobicContact CZ-CG 3.45Å; F603-W615 VanDerWaalsContact CZ-CG 3.45Å; F603-W615 PolarHBondContact N-O 2.88Å; F603-W615 PolarHBondContact O-N 3.27Å; S605-W615 PolarHBondContact OG-NE1 3.14Å; Q613-W615 HydrophobicContact CB-CZ2 3.9Å; Q613-W615 VanDerWaalsContact CB-NE1 3.35Å; Q613-W615 HydrophobicContact CG-CZ2 4.3Å; Q613-W615 VanDerWaalsContact O-CD1 3.24Å; Q613-W615 PolarHBondContact O-NE1 3.3Å; W615-I620 WeakPolarHBondContact CZ3-O 3.24Å; W615-P622 HydrophobicContact CD2-CB 4.16Å; W615-P622 HydrophobicContact CE3-CB 3.99Å; W615-P622 HydrophobicContact CH2-CB 4.33Å; W615-P622 HydrophobicContact CH2-CG 4.47Å; W615-P622 HydrophobicContact CZ2-CB 4.47Å; W615-P622 HydrophobicContact CZ3-CB 4.07Å; W615-P622 HydrophobicContact CZ3-CG 4.38Å
616	K	93.6	Very high	92.2	Very high	70 Å²	70	40.4 Å²	40.4	30%	0.304	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.5	158.4	-159.7	-175.2	176.3	-179.9	0	109.1	D601 C619 L623	D601-K616 VanDerWaalsContact CB-CE 3.49Å; D601-K616 HydrophobicContact CB-CG 4.09Å; D601-K616 CarbonylContact O-C 3.54Å; D601-K616 WeakPolarHBondContact O-CA 3.47Å; D601-K616 WeakPolarHBondContact O-CG 3.1Å; D601-K616 WeakPolarHBondContact OD2-CE 3.26Å; D601-K616 IonicContact OD2-NZ 2.68Å; D601-K616 PolarHBondContact OD2-NZ 2.85Å; D601-K616 VanDerWaalsContact OD2-NZ 3.14Å; K616-C619 HydrophobicContact CB-CB 4.16Å; K616-C619 WeakPolarHBondContact O-CB 3.28Å; K616-C619 PolarHBondContact O-N 3.04Å; K616-C619 VanDerWaalsContact O-N 3.13Å; K616-L623 HydrophobicContact CB-CD1 4.07Å; K616-L623 HydrophobicContact CB-CD2 4.25Å; K616-L623 HydrophobicContact CB-CG 4.18Å
617	Q	84.2	Confident	92.1	Very high	33 Å²	33	45 Å²	45	15%	0.154	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48	139.2	162.4	173.9	150.4	-64.5	0	0	110.4	W595 D601 C619	W595-Q617 HydrophobicContact CH2-CB 4.45Å; W595-Q617 HydrophobicContact CZ3-CB 4.41Å; D601-Q617 HydrophobicContact CB-CB 4.33Å; D601-Q617 WeakPolarHBondContact O-CB 3.31Å; D601-Q617 PolarHBondContact O-N 2.89Å; Q617-C619 PolarHBondContact O-N 2.84Å
618	D	85.7	Confident	91.8	Very high	112 Å²	112	45.4 Å²	45.4	60%	0.599	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	11.5	-179.1	-41.3	-35.1	0	0	0	114.1	K570	K570-D618 IonicContact NZ-OD1 2.7Å; K570-D618 PolarHBondContact NZ-OD1 2.93Å
619	C	89.5	Confident	91.6	Very high	48 Å²	48	49.9 Å²	49.9	32%	0.324	28%	0.277	S	S	.	.			trans	-112.9	103.9	171.5	-63.9	0	0	0	0	110.9	Y583 K616 Q617 N621	Y583-C619 WeakPolarHBondContact CD1-O 3.46Å; Y583-C619 WeakPolarHBondContact CE1-O 2.99Å; K616-C619 HydrophobicContact CB-CB 4.16Å; K616-C619 WeakPolarHBondContact O-CB 3.28Å; K616-C619 PolarHBondContact O-N 3.04Å; K616-C619 VanDerWaalsContact O-N 3.13Å; Q617-C619 PolarHBondContact O-N 2.84Å; C619-N621 PolarHBondContact O-N 3.06Å; C619-N621 VanDerWaalsContact O-N 3.1Å
620	I	89	Confident	91.4	Very high	108 Å²	108	52 Å²	52	55%	0.554	29%	0.286	S	S	*	.	S	Bend	trans	-61.1	-21.3	-179.3	-59.1	171.9	0	0	0	113	W615	W615-I620 WeakPolarHBondContact CZ3-O 3.24Å
621	N	91.2	Very high	91.3	Very high	125 Å²	125	53.5 Å²	53.5	67%	0.668	30%	0.295	S	S	*	.	S	Bend	trans	-104.9	146.6	174.3	-66.8	-40.1	0	0	0	110.6	C619	C619-N621 PolarHBondContact O-N 3.06Å; C619-N621 VanDerWaalsContact O-N 3.1Å
622	P	92.6	Very high	91.1	Very high	31 Å²	31	52.4 Å²	52.4	20%	0.201	29%	0.288	C	S	.	.			trans	-66.4	150.8	174.9	32	-38.3	0	0	0	111.4	K585 Q613 L614 W615	K585-P622 HydrophobicContact CD-CG 4.2Å; K585-P622 HydrophobicContact CG-CG 4.09Å; Q613-P622 HydrophobicContact CB-CB 4.24Å; L614-P622 CarbonylContact O-C 3.51Å; L614-P622 WeakPolarHBondContact O-CA 3.34Å; L614-P622 WeakPolarHBondContact O-CB 3.19Å; W615-P622 HydrophobicContact CD2-CB 4.16Å; W615-P622 HydrophobicContact CE3-CB 3.99Å; W615-P622 HydrophobicContact CH2-CB 4.33Å; W615-P622 HydrophobicContact CH2-CG 4.47Å; W615-P622 HydrophobicContact CZ2-CB 4.47Å; W615-P622 HydrophobicContact CZ3-CB 4.07Å; W615-P622 HydrophobicContact CZ3-CG 4.38Å
623	L	92.1	Very high	90.7	Very high	63 Å²	63	54 Å²	54	33%	0.33	31%	0.305	S	S	.	.	S	Bend	trans	-71.7	-46.8	171	-63.9	-177.3	0	0	0	111.4	L614 K616	L614-L623 HydrophobicContact CD2-CB 4.41Å; L614-L623 HydrophobicContact CD2-CD1 4.43Å; L614-L623 HydrophobicContact CG-CB 4.45Å; L614-L623 HydrophobicContact CG-CD1 4.5Å; L614-L623 PolarHBondContact O-N 2.77Å; K616-L623 HydrophobicContact CB-CD1 4.07Å; K616-L623 HydrophobicContact CB-CD2 4.25Å; K616-L623 HydrophobicContact CB-CG 4.18Å
624	L	92.3	Very high	90.4	Very high	66 Å²	66	54.1 Å²	54.1	35%	0.346	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	152.7	-178.8	-65.1	174.5	0	0	0	110	L614 F626 L658	L614-L624 HydrophobicContact CB-CB 4.12Å; L614-L624 HydrophobicContact CD2-CB 4.36Å; L614-L624 HydrophobicContact CD2-CD1 4.04Å; L614-L624 HydrophobicContact CD2-CG 4.38Å; L614-L624 PolarHBondContact N-O 2.85Å; L614-L624 PolarHBondContact O-N 3.01Å; L624-F626 HydrophobicContact CB-CE1 4.08Å; L624-F626 HydrophobicContact CB-CE2 4.14Å; L624-F626 HydrophobicContact CB-CZ 3.58Å; L624-F626 HydrophobicContact CD1-CE1 4.12Å; L624-F626 HydrophobicContact CD1-CZ 3.76Å; L624-F626 HydrophobicContact CG-CZ 4.32Å; L624-L658 HydrophobicContact CD1-CD2 4.31Å
625	S	92.9	Very high	90.2	Very high	55 Å²	55	53.9 Å²	53.9	39%	0.385	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	105.5	180	173.7	0	0	0	0	107.9	Q613	Q613-S625 PolarHBondContact NE2-OG 3.07Å; Q613-S625 VanDerWaalsContact OE1-CB 3.25Å; Q613-S625 PolarHBondContact OE1-OG 3.47Å
626	F	93.4	Very high	90	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	148.9	172.8	-41.2	-75.7	0	0	0	109	T611 I612 L614 L624 F645 W656 L658 F662	T611-F626 WeakPolarHBondContact CA-O 3.06Å; T611-F626 WeakPolarHBondContact CB-O 3.27Å; I612-F626 HydrophobicContact CB-CB 4.29Å; I612-F626 HydrophobicContact CB-CD2 4.17Å; I612-F626 HydrophobicContact CG2-CD2 4.27Å; I612-F626 PolarHBondContact N-O 3.36Å; I612-F626 PolarHBondContact O-N 3.12Å; L614-F626 HydrophobicContact CB-CE2 4.04Å; L624-F626 HydrophobicContact CB-CE1 4.08Å; L624-F626 HydrophobicContact CB-CE2 4.14Å; L624-F626 HydrophobicContact CB-CZ 3.58Å; L624-F626 HydrophobicContact CD1-CE1 4.12Å; L624-F626 HydrophobicContact CD1-CZ 3.76Å; L624-F626 HydrophobicContact CG-CZ 4.32Å; F626-F645 HydrophobicContact CD2-CE1 4.4Å; F626-F645 AromaticContact CD2-CZ 3.72Å; F626-F645 HydrophobicContact CD2-CZ 3.72Å; F626-F645 HydrophobicContact CE2-CE1 4.04Å; F626-F645 AromaticContact CE2-CZ 3.81Å; F626-F645 HydrophobicContact CE2-CZ 3.81Å; F626-F645 HydrophobicContact CG-CZ 4.2Å; F626-F645 HydrophobicContact CZ-CE1 4.35Å; F626-F645 HydrophobicContact CZ-CZ 4.39Å; F626-W656 HydrophobicContact CB-CH2 3.9Å; F626-W656 HydrophobicContact CB-CZ2 4.25Å; F626-W656 HydrophobicContact CB-CZ3 4.05Å; F626-W656 HydrophobicContact CD1-CE3 4.05Å; F626-W656 HydrophobicContact CD1-CH2 4.5Å; F626-W656 AromaticContact CD1-CZ3 3.81Å; F626-W656 HydrophobicContact CD1-CZ3 3.81Å; F626-W656 HydrophobicContact CG-CE3 4.38Å; F626-W656 HydrophobicContact CG-CZ3 4.19Å; F626-L658 HydrophobicContact CE1-CD2 3.72Å; F626-L658 HydrophobicContact CE2-CD2 4.39Å; F626-L658 HydrophobicContact CZ-CD2 3.42Å; F626-L658 VanDerWaalsContact CZ-CD2 3.42Å; F626-F662 WeakPolarHBondContact CD1-O 3.38Å; F626-F662 HydrophobicContact CE1-CB 4.47Å
627	T	91.9	Very high	89.9	Confident	96 Å²	96	51.8 Å²	51.8	59%	0.589	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.8	179.2	-55.5	0	0	0	0	108
628	S	88.8	Confident	90.1	Very high	9 Å²	9	50.5 Å²	50.5	6%	0.063	29%	0.289	C	S	.	.			trans	-110.1	165.7	176.7	-175.2	0	0	0	0	110.8	S610 Q630 N649 E654	S610-S628 PolarHBondContact O-N 3.48Å; S628-Q630 PolarHBondContact O-N 3.37Å; S628-N649 PolarHBondContact OG-ND2 3.29Å; S628-E654 VanDerWaalsContact OG-CD 3.23Å; S628-E654 PolarHBondContact OG-OE1 2.88Å; S628-E654 PolarHBondContact OG-OE2 3.11Å
629	N	86.3	Confident	90	Very high	141 Å²	141	47.4 Å²	47.4	75%	0.754	28%	0.275	S	S	*	.	S	Bend	trans	-73.6	-13.1	-176.5	-70.5	-37.5	0	0	0	113.8
630	Q	89.3	Confident	89.7	Confident	75 Å²	75	48.8 Å²	48.8	35%	0.35	28%	0.275	S	S	.	.	S	Bend	trans	-145.8	163	-174.9	-75.8	-172.8	-1.9	0	0	111.6	S610 S628 V632 N649	S610-Q630 VanDerWaalsContact CB-O 3.28Å; S610-Q630 WeakPolarHBondContact CB-O 3.3Å; S610-Q630 PolarHBondContact OG-O 3.29Å; S628-Q630 PolarHBondContact O-N 3.37Å; Q630-V632 PolarHBondContact O-N 3.08Å; Q630-N649 HydrophobicContact CB-CB 3.83Å
631	P	89.9	Confident	89.5	Confident	58 Å²	58	46.2 Å²	46.2	38%	0.377	26%	0.261	S	S	.	.			trans	-51.7	124.9	171.6	-30.4	38.4	0	0	0	112.1	G633	P631-G633 PolarHBondContact O-N 2.9Å
632	V	90.7	Very high	89.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	114.1	-176.5	-168.2	0	0	0	0	109.4	N591 C606 S607 I612 Q630 A647 N649	N591-V632 PolarHBondContact ND2-O 2.87Å; C606-V632 HydrophobicContact CB-CB 3.87Å; C606-V632 HydrophobicContact CB-CG1 3.61Å; S607-V632 PolarHBondContact O-N 2.93Å; I612-V632 HydrophobicContact CD1-CG1 4.27Å; I612-V632 HydrophobicContact CD1-CG2 4.38Å; I612-V632 HydrophobicContact CG1-CG1 4.23Å; I612-V632 HydrophobicContact CG1-CG2 3.95Å; Q630-V632 PolarHBondContact O-N 3.08Å; V632-A647 HydrophobicContact CG1-CB 4.04Å; V632-N649 WeakPolarHBondContact CA-OD1 3.37Å; V632-N649 WeakPolarHBondContact CG2-OD1 3.24Å
633	G	86.4	Confident	89.1	Confident	34 Å²	34	42.4 Å²	42.4	35%	0.351	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-48.8	179.6	0	0	0	0	0	112.1	N591 P631 V648	N591-G633 VanDerWaalsContact CB-O 3.22Å; N591-G633 WeakPolarHBondContact CB-O 3.41Å; P631-G633 PolarHBondContact O-N 2.9Å; G633-V648 PolarHBondContact N-O 3.31Å
634	E	87.4	Confident	89	Confident	3 Å²	3	39.6 Å²	39.6	1%	0.014	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	151.8	-175.4	-170.8	168.8	-160.3	0	0	112.1	L363 P369 C592 R636 A647 V648 S679 L680	L363-E634 WeakPolarHBondContact CD2-OE2 3.38Å; P369-E634 WeakPolarHBondContact CA-OE1 3.37Å; P369-E634 WeakPolarHBondContact CB-OE1 3.32Å; P369-E634 WeakPolarHBondContact CB-OE2 3.41Å; C592-E634 HydrophobicContact CB-CG 4.36Å; E634-R636 IonicContact OE1-CZ 3.72Å; E634-R636 IonicContact OE1-NE 2.76Å; E634-R636 PolarHBondContact OE1-NE 2.8Å; E634-R636 IonicContact OE1-NH2 3.23Å; E634-R636 PolarHBondContact OE1-NH2 2.92Å; E634-A647 WeakPolarHBondContact O-CA 3.47Å; E634-V648 PolarHBondContact N-O 3.02Å; E634-V648 PolarHBondContact O-N 3.05Å; E634-S679 WeakPolarHBondContact OE2-CA 3.32Å; E634-L680 HydrophobicContact CB-CB 4.27Å; E634-L680 HydrophobicContact CG-CB 4.18Å; E634-L680 PolarHBondContact OE2-N 3.36Å
635	V	92.3	Very high	89	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	138.4	175.7	64.4	0	0	0	0	110	C592 T594 L604 C606 I612 F645 S646	C592-V635 HydrophobicContact CB-CG1 4.41Å; T594-V635 HydrophobicContact CG2-CG1 4.16Å; T594-V635 WeakPolarHBondContact CG2-O 3.39Å; L604-V635 HydrophobicContact CB-CG1 4.3Å; L604-V635 HydrophobicContact CB-CG2 4.33Å; L604-V635 HydrophobicContact CD1-CG2 3.91Å; C606-V635 HydrophobicContact CB-CB 3.97Å; C606-V635 HydrophobicContact CB-CG1 3.69Å; I612-V635 HydrophobicContact CG2-CG2 4.07Å; V635-F645 HydrophobicContact CG2-CD2 3.87Å; V635-F645 HydrophobicContact CG2-CE2 4.45Å; V635-S646 CarbonylContact C-O 3.59Å; V635-S646 VanDerWaalsContact CA-O 3.31Å; V635-S646 WeakPolarHBondContact CA-O 3.1Å; V635-S646 WeakPolarHBondContact CG2-O 3.38Å
636	R	90.2	Very high	89	Confident	13 Å²	13	33.9 Å²	33.9	5%	0.049	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	139.6	-179.9	-66.4	-59.9	174.5	-168.4	-5.8	112.7	D366 S368 E634 F645 S646 L680 F682	D366-R636 IonicContact OD1-CZ 2.69Å; D366-R636 VanDerWaalsContact OD1-CZ 3.28Å; D366-R636 IonicContact OD1-NH1 2.66Å; D366-R636 PolarHBondContact OD1-NH1 2.81Å; D366-R636 IonicContact OD1-NH2 2.68Å; D366-R636 PolarHBondContact OD1-NH2 2.96Å; S368-R636 PolarHBondContact O-NH2 3.01Å; E634-R636 IonicContact OE1-CZ 3.72Å; E634-R636 IonicContact OE1-NE 2.76Å; E634-R636 PolarHBondContact OE1-NE 2.8Å; E634-R636 IonicContact OE1-NH2 3.23Å; E634-R636 PolarHBondContact OE1-NH2 2.92Å; R636-F645 CarbonylContact O-C 3.53Å; R636-F645 WeakPolarHBondContact O-CA 3.47Å; R636-F645 VanDerWaalsContact O-CB 3.26Å; R636-F645 WeakPolarHBondContact O-CB 3.11Å; R636-S646 PolarHBondContact N-O 2.91Å; R636-S646 PolarHBondContact O-N 2.91Å; R636-L680 HydrophobicContact CG-CG 4.2Å; R636-L680 WeakPolarHBondContact CG-O 3.46Å; R636-F682 HydrophobicContact CB-CD2 3.98Å; R636-F682 HydrophobicContact CB-CE2 4.38Å; R636-F682 WeakPolarHBondContact O-CE2 3.22Å
637	W	91.3	Very high	88.9	Confident	14 Å²	14	33.7 Å²	33.7	5%	0.053	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	147.3	166.2	-73.1	106	0	0	0	112	T594 W595 C596 P597 V602 L604 L614 A642 F645 F682	T594-W637 PolarHBondContact O-NE1 2.88Å; W595-W637 VanDerWaalsContact C-CD1 3.47Å; C596-W637 HydrophobicContact CB-CD2 4.06Å; C596-W637 HydrophobicContact CB-CG 4.33Å; C596-W637 HydrophobicContact CB-CZ2 3.98Å; P597-W637 HydrophobicContact CG-CB 4.34Å; V602-W637 HydrophobicContact CG1-CH2 4.31Å; V602-W637 HydrophobicContact CG1-CZ2 3.87Å; L604-W637 HydrophobicContact CD1-CD2 3.77Å; L604-W637 VanDerWaalsContact CD1-CE2 3.4Å; L604-W637 HydrophobicContact CD1-CE3 4.21Å; L604-W637 HydrophobicContact CD1-CG 4.32Å; L604-W637 HydrophobicContact CD1-CH2 4.06Å; L604-W637 HydrophobicContact CD1-CZ2 3.59Å; L604-W637 HydrophobicContact CD1-CZ3 4.33Å; L604-W637 HydrophobicContact CD2-CZ2 4.32Å; L604-W637 HydrophobicContact CG-CH2 4.21Å; L604-W637 HydrophobicContact CG-CZ2 3.5Å; L614-W637 HydrophobicContact CD1-CH2 3.72Å; L614-W637 HydrophobicContact CD1-CZ2 3.66Å; W637-A642 WeakPolarHBondContact CZ3-O 3.43Å; W637-F645 HydrophobicContact CE3-CB 4.07Å; W637-F645 HydrophobicContact CZ3-CB 4.45Å; W637-F645 HydrophobicContact CZ3-CD1 4.43Å; W637-F682 WeakPolarHBondContact O-CD2 3.46Å
638	S	88.9	Confident	88.8	Confident	6 Å²	6	29.1 Å²	29.1	4%	0.042	17%	0.168	C	C	.	.			trans	-68.5	129.1	163.6	-174.1	0	0	0	0	109.9	K640 V644	S638-K640 PolarHBondContact O-N 2.97Å; S638-K640 VanDerWaalsContact O-N 3.11Å; S638-V644 VanDerWaalsContact CB-O 3.31Å; S638-V644 WeakPolarHBondContact CB-O 3.43Å; S638-V644 PolarHBondContact N-O 3.02Å
639	P	83.1	Confident	88.8	Confident	46 Å²	46	28.8 Å²	28.8	30%	0.299	17%	0.165	S	C	.	.	S	Bend	trans	-69	-7.6	177.7	27.3	-33.8	0	0	0	113.4	F682	P639-F682 VanDerWaalsContact CD-CB 3.46Å; P639-F682 HydrophobicContact CG-CB 4.17Å
640	K	83.6	Confident	88.7	Confident	77 Å²	77	26.3 Å²	26.3	34%	0.335	15%	0.149	S	C	.	.	S	Bend	trans	-111.9	-25.8	-176.2	-61.5	-179.2	-176.5	-173.4	0	114.2	S638 S684 L685 D687	S638-K640 PolarHBondContact O-N 2.97Å; S638-K640 VanDerWaalsContact O-N 3.11Å; K640-S684 VanDerWaalsContact CE-O 3.28Å; K640-S684 WeakPolarHBondContact CE-O 3.49Å; K640-L685 VanDerWaalsContact NZ-C 3.32Å; K640-L685 PolarHBondContact NZ-O 3.34Å; K640-D687 IonicContact NZ-OD1 2.63Å; K640-D687 PolarHBondContact NZ-OD1 2.75Å
641	H	85.3	Confident	88.5	Confident	54 Å²	54	24 Å²	24	25%	0.25	15%	0.145	C	C	.	.			trans	-133.3	111.7	-171.3	-55.7	113.6	0	0	0	110.5	T643 V644	H641-T643 PolarHBondContact O-N 2.9Å; H641-V644 HydrophobicContact CB-CB 3.97Å; H641-V644 HydrophobicContact CB-CG2 3.64Å; H641-V644 PolarHBondContact O-N 3Å; H641-V644 VanDerWaalsContact O-N 3.11Å
642	A	86.4	Confident	88.5	Confident	42 Å²	42	22.8 Å²	22.8	35%	0.347	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-4.9	-174.9	0	0	0	0	0	114.9	L598 W637	L598-A642 HydrophobicContact CB-CB 3.92Å; L598-A642 HydrophobicContact CD1-CB 4.07Å; W637-A642 WeakPolarHBondContact CZ3-O 3.43Å
643	T	88.6	Confident	88.4	Confident	35 Å²	35	22.9 Å²	22.9	22%	0.215	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-11.3	177.9	60.1	0	0	0	0	113.3	H641 D657 L658 N659	H641-T643 PolarHBondContact O-N 2.9Å; T643-D657 VanDerWaalsContact CB-OD1 3.26Å; T643-D657 WeakPolarHBondContact CB-OD1 3.41Å; T643-D657 WeakPolarHBondContact O-CA 3.13Å; T643-D657 PolarHBondContact OG1-OD1 2.91Å; T643-L658 WeakPolarHBondContact O-CG 3.33Å; T643-L658 PolarHBondContact O-N 3.11Å; T643-N659 PolarHBondContact OG1-ND2 2.9Å
644	V	90.5	Very high	88.7	Confident	4 Å²	4	21.4 Å²	21.4	2%	0.024	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.8	-175.9	-176.6	0	0	0	0	109.6	S638 H641 I655 W656 D657 F682 L706	S638-V644 VanDerWaalsContact CB-O 3.31Å; S638-V644 WeakPolarHBondContact CB-O 3.43Å; S638-V644 PolarHBondContact N-O 3.02Å; H641-V644 HydrophobicContact CB-CB 3.97Å; H641-V644 HydrophobicContact CB-CG2 3.64Å; H641-V644 PolarHBondContact O-N 3Å; H641-V644 VanDerWaalsContact O-N 3.11Å; V644-I655 HydrophobicContact CG1-CG2 3.99Å; V644-W656 VanDerWaalsContact CA-O 3.28Å; V644-W656 WeakPolarHBondContact CA-O 3.44Å; V644-D657 HydrophobicContact CG2-CB 3.99Å; V644-F682 HydrophobicContact CG1-CZ 4.35Å; V644-L706 HydrophobicContact CG1-CD1 4.2Å; V644-L706 HydrophobicContact CG1-CD2 4.37Å
645	F	92.7	Very high	88.9	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	158.9	170.3	68.3	-89.6	0	0	0	110.4	L604 I612 F626 V635 R636 W637 W656 L658	L604-F645 HydrophobicContact CD1-CB 3.6Å; L604-F645 HydrophobicContact CD1-CD1 4.06Å; L604-F645 HydrophobicContact CD1-CD2 3.95Å; L604-F645 HydrophobicContact CD1-CG 3.61Å; I612-F645 HydrophobicContact CD1-CE2 4.03Å; I612-F645 HydrophobicContact CG2-CE2 4.26Å; F626-F645 HydrophobicContact CD2-CE1 4.4Å; F626-F645 AromaticContact CD2-CZ 3.72Å; F626-F645 HydrophobicContact CD2-CZ 3.72Å; F626-F645 HydrophobicContact CE2-CE1 4.04Å; F626-F645 AromaticContact CE2-CZ 3.81Å; F626-F645 HydrophobicContact CE2-CZ 3.81Å; F626-F645 HydrophobicContact CG-CZ 4.2Å; F626-F645 HydrophobicContact CZ-CE1 4.35Å; F626-F645 HydrophobicContact CZ-CZ 4.39Å; V635-F645 HydrophobicContact CG2-CD2 3.87Å; V635-F645 HydrophobicContact CG2-CE2 4.45Å; R636-F645 CarbonylContact O-C 3.53Å; R636-F645 WeakPolarHBondContact O-CA 3.47Å; R636-F645 VanDerWaalsContact O-CB 3.26Å; R636-F645 WeakPolarHBondContact O-CB 3.11Å; W637-F645 HydrophobicContact CE3-CB 4.07Å; W637-F645 HydrophobicContact CZ3-CB 4.45Å; W637-F645 HydrophobicContact CZ3-CD1 4.43Å; F645-W656 HydrophobicContact CD1-CB 3.9Å; F645-W656 HydrophobicContact CD2-CB 4.04Å; F645-W656 HydrophobicContact CD2-CG 4.22Å; F645-W656 HydrophobicContact CE1-CB 3.49Å; F645-W656 VanDerWaalsContact CE1-CB 3.49Å; F645-W656 HydrophobicContact CE1-CG 4.12Å; F645-W656 HydrophobicContact CE2-CB 3.65Å; F645-W656 AromaticContact CE2-CD1 3.53Å; F645-W656 HydrophobicContact CE2-CD2 4.17Å; F645-W656 AromaticContact CE2-CG 3.5Å; F645-W656 HydrophobicContact CE2-CG 3.5Å; F645-W656 HydrophobicContact CG-CB 4.15Å; F645-W656 HydrophobicContact CZ-CB 3.36Å; F645-W656 AromaticContact CZ-CD1 3.96Å; F645-W656 AromaticContact CZ-CD2 3.86Å; F645-W656 HydrophobicContact CZ-CD2 3.86Å; F645-W656 HydrophobicContact CZ-CE3 4.33Å; F645-W656 AromaticContact CZ-CG 3.44Å; F645-W656 HydrophobicContact CZ-CG 3.44Å; F645-W656 VanDerWaalsContact CZ-CG 3.44Å; F645-W656 PolarHBondContact N-O 2.82Å; F645-W656 PolarHBondContact O-N 2.99Å; F645-L658 HydrophobicContact CE1-CD2 4.04Å; F645-L658 HydrophobicContact CE1-CG 4.25Å
646	S	91.4	Very high	88.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	151.7	172.7	57.7	0	0	0	0	110	V635 R636 E654 L680 F682	V635-S646 CarbonylContact C-O 3.59Å; V635-S646 VanDerWaalsContact CA-O 3.31Å; V635-S646 WeakPolarHBondContact CA-O 3.1Å; V635-S646 WeakPolarHBondContact CG2-O 3.38Å; R636-S646 PolarHBondContact N-O 2.91Å; R636-S646 PolarHBondContact O-N 2.91Å; S646-E654 CarbonylContact C-O 3.25Å; S646-E654 VanDerWaalsContact CA-O 3.25Å; S646-E654 WeakPolarHBondContact CA-O 3.36Å; S646-L680 WeakPolarHBondContact OG-CD1 3.3Å; S646-L680 WeakPolarHBondContact OG-CD2 3.41Å; S646-L680 WeakPolarHBondContact OG-CG 3.15Å; S646-F682 WeakPolarHBondContact OG-CE2 3.48Å
647	A	91.8	Very high	88.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	145.4	172.7	0	0	0	0	0	110	I612 V632 E634 E654	I612-A647 HydrophobicContact CD1-CB 3.44Å; I612-A647 VanDerWaalsContact CD1-CB 3.44Å; V632-A647 HydrophobicContact CG1-CB 4.04Å; E634-A647 WeakPolarHBondContact O-CA 3.47Å; A647-E654 PolarHBondContact N-O 3.11Å; A647-E654 PolarHBondContact O-N 3.13Å
648	V	89.8	Confident	88.6	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.006	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	126.7	175.9	154.5	0	0	0	0	109.4	G633 E634 L653 M677 L680 V691	G633-V648 PolarHBondContact N-O 3.31Å; E634-V648 PolarHBondContact N-O 3.02Å; E634-V648 PolarHBondContact O-N 3.05Å; V648-L653 HydrophobicContact CG2-CB 4.2Å; V648-L653 HydrophobicContact CG2-CD1 3.73Å; V648-M677 HydrophobicContact CG1-CB 3.65Å; V648-L680 HydrophobicContact CB-CB 4.13Å; V648-L680 HydrophobicContact CB-CD2 4.02Å; V648-L680 HydrophobicContact CG2-CB 3.9Å; V648-L680 HydrophobicContact CG2-CD1 3.8Å; V648-L680 HydrophobicContact CG2-CD2 3.87Å; V648-L680 HydrophobicContact CG2-CG 4.08Å; V648-V691 HydrophobicContact CG2-CG1 4.5Å; V648-V691 HydrophobicContact CG2-CG2 4.49Å
649	N	88.4	Confident	88.5	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	169.4	168.5	-49.2	-36.6	0	0	0	109	S628 Q630 V632 G651 Q652 E654	S628-N649 PolarHBondContact OG-ND2 3.29Å; Q630-N649 HydrophobicContact CB-CB 3.83Å; V632-N649 WeakPolarHBondContact CA-OD1 3.37Å; V632-N649 WeakPolarHBondContact CG2-OD1 3.24Å; N649-G651 PolarHBondContact O-N 3.42Å; N649-G651 VanDerWaalsContact O-N 3.14Å; N649-Q652 PolarHBondContact N-O 3.1Å; N649-Q652 PolarHBondContact O-N 3.43Å; N649-E654 PolarHBondContact ND2-OE1 3.1Å
650	E	84	Confident	88.5	Confident	90 Å²	90	29.7 Å²	29.7	42%	0.421	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-41	175.9	-59.8	-160	133.2	0	0	113	K676 M677	E650-K676 HydrophobicContact CB-CB 4.39Å; E650-K676 HydrophobicContact CB-CD 4.04Å; E650-K676 HydrophobicContact CB-CG 4.18Å; E650-K676 HydrophobicContact CG-CD 4.19Å; E650-K676 CarbonylContact O-C 3.55Å; E650-K676 WeakPolarHBondContact O-CA 3.44Å; E650-K676 IonicContact OE1-NZ 2.7Å; E650-K676 PolarHBondContact OE1-NZ 2.75Å; E650-K676 VanDerWaalsContact OE2-CE 3.27Å; E650-K676 WeakPolarHBondContact OE2-CE 3.42Å; E650-K676 IonicContact OE2-NZ 2.72Å; E650-K676 PolarHBondContact OE2-NZ 3.23Å; E650-M677 PolarHBondContact O-N 3.09Å
651	G	85.4	Confident	88.4	Confident	25 Å²	25	27.2 Å²	27.2	26%	0.258	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-10.3	-175.3	0	0	0	0	0	117.6	N649 A671	N649-G651 PolarHBondContact O-N 3.42Å; N649-G651 VanDerWaalsContact O-N 3.14Å; G651-A671 WeakPolarHBondContact O-CB 3.4Å; G651-A671 PolarHBondContact O-N 3.41Å
652	Q	89.6	Confident	88.4	Confident	34 Å²	34	30.6 Å²	30.6	16%	0.159	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	150.1	-174.9	63.2	-170.7	31.2	0	0	114.7	N649 E654 V668 Q669 M677	N649-Q652 PolarHBondContact N-O 3.1Å; N649-Q652 PolarHBondContact O-N 3.43Å; Q652-E654 HydrophobicContact CG-CG 4.3Å; Q652-E654 PolarHBondContact NE2-OE1 3.2Å; Q652-V668 HydrophobicContact CB-CG1 4.2Å; Q652-V668 HydrophobicContact CG-CG1 4.29Å; Q652-Q669 WeakPolarHBondContact CA-O 3.38Å; Q652-M677 VanDerWaalsContact C-SD 3.55Å
653	L	90.1	Very high	88.3	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.7	165.1	166.2	69.5	0	0	0	109	V648 I655 V668 Q669 M677 L680 V689 V691 Y701	V648-L653 HydrophobicContact CG2-CB 4.2Å; V648-L653 HydrophobicContact CG2-CD1 3.73Å; L653-I655 HydrophobicContact CD1-CD1 3.92Å; L653-I655 HydrophobicContact CD2-CD1 4.34Å; L653-I655 HydrophobicContact CG-CD1 4.16Å; L653-V668 WeakPolarHBondContact O-CA 3.23Å; L653-Q669 HydrophobicContact CB-CB 4.27Å; L653-Q669 HydrophobicContact CD2-CB 4.37Å; L653-Q669 PolarHBondContact N-O 3.21Å; L653-Q669 PolarHBondContact O-N 2.93Å; L653-M677 HydrophobicContact CB-CE 4.13Å; L653-M677 HydrophobicContact CB-SD 3.79Å; L653-M677 PolarHBondContact N-SD 2.9Å; L653-L680 HydrophobicContact CD1-CD1 3.57Å; L653-V689 HydrophobicContact CD1-CG1 4.24Å; L653-V689 HydrophobicContact CD2-CG1 4.24Å; L653-V691 HydrophobicContact CD1-CG2 4.33Å; L653-V691 HydrophobicContact CD2-CG2 4.08Å; L653-Y701 HydrophobicContact CD2-CD2 4.46Å
654	E	91.3	Very high	88.2	Confident	3 Å²	3	37.6 Å²	37.6	1%	0.014	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	132.3	175.3	-63.2	177	179.5	0	0	110.2	S628 S646 A647 N649 Q652 W656 P665 I667 V668	S628-E654 VanDerWaalsContact OG-CD 3.23Å; S628-E654 PolarHBondContact OG-OE1 2.88Å; S628-E654 PolarHBondContact OG-OE2 3.11Å; S646-E654 CarbonylContact C-O 3.25Å; S646-E654 VanDerWaalsContact CA-O 3.25Å; S646-E654 WeakPolarHBondContact CA-O 3.36Å; A647-E654 PolarHBondContact N-O 3.11Å; A647-E654 PolarHBondContact O-N 3.13Å; N649-E654 PolarHBondContact ND2-OE1 3.1Å; Q652-E654 HydrophobicContact CG-CG 4.3Å; Q652-E654 PolarHBondContact NE2-OE1 3.2Å; E654-W656 PolarHBondContact OE2-NE1 3.13Å; E654-W656 VanDerWaalsContact OE2-NE1 3.14Å; E654-P665 HydrophobicContact CB-CB 4.09Å; E654-P665 HydrophobicContact CG-CB 4.44Å; E654-P665 HydrophobicContact CG-CG 4.41Å; E654-I667 CarbonylContact C-O 3.53Å; E654-I667 WeakPolarHBondContact CA-O 3.5Å; E654-V668 HydrophobicContact CG-CG2 4.44Å
655	I	91.3	Very high	88.1	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.4	169.8	-44.5	-63.3	0	0	0	108.5	V644 L653 V666 I667 V689 L703 L706	V644-I655 HydrophobicContact CG1-CG2 3.99Å; L653-I655 HydrophobicContact CD1-CD1 3.92Å; L653-I655 HydrophobicContact CD2-CD1 4.34Å; L653-I655 HydrophobicContact CG-CD1 4.16Å; I655-V666 PolarHBondContact O-N 3.07Å; I655-I667 HydrophobicContact CB-CB 3.97Å; I655-I667 HydrophobicContact CB-CD1 4.43Å; I655-I667 HydrophobicContact CB-CG1 4.38Å; I655-I667 HydrophobicContact CG1-CB 4.01Å; I655-I667 HydrophobicContact CG1-CD1 4.4Å; I655-I667 PolarHBondContact N-O 2.89Å; I655-I667 PolarHBondContact O-N 3.42Å; I655-V689 HydrophobicContact CD1-CG2 4.27Å; I655-L703 HydrophobicContact CD1-CD2 4.05Å; I655-L703 HydrophobicContact CG1-CD2 3.92Å; I655-L703 HydrophobicContact CG2-CD1 4.45Å; I655-L706 HydrophobicContact CG2-CD2 4.45Å
656	W	91.4	Very high	87.8	Confident	1 Å²	1	41.9 Å²	41.9	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.7	-178.7	-65.7	78.1	0	0	0	109	F626 V644 F645 E654 L663 P665	F626-W656 HydrophobicContact CB-CH2 3.9Å; F626-W656 HydrophobicContact CB-CZ2 4.25Å; F626-W656 HydrophobicContact CB-CZ3 4.05Å; F626-W656 HydrophobicContact CD1-CE3 4.05Å; F626-W656 HydrophobicContact CD1-CH2 4.5Å; F626-W656 AromaticContact CD1-CZ3 3.81Å; F626-W656 HydrophobicContact CD1-CZ3 3.81Å; F626-W656 HydrophobicContact CG-CE3 4.38Å; F626-W656 HydrophobicContact CG-CZ3 4.19Å; V644-W656 VanDerWaalsContact CA-O 3.28Å; V644-W656 WeakPolarHBondContact CA-O 3.44Å; F645-W656 HydrophobicContact CD1-CB 3.9Å; F645-W656 HydrophobicContact CD2-CB 4.04Å; F645-W656 HydrophobicContact CD2-CG 4.22Å; F645-W656 HydrophobicContact CE1-CB 3.49Å; F645-W656 VanDerWaalsContact CE1-CB 3.49Å; F645-W656 HydrophobicContact CE1-CG 4.12Å; F645-W656 HydrophobicContact CE2-CB 3.65Å; F645-W656 AromaticContact CE2-CD1 3.53Å; F645-W656 HydrophobicContact CE2-CD2 4.17Å; F645-W656 AromaticContact CE2-CG 3.5Å; F645-W656 HydrophobicContact CE2-CG 3.5Å; F645-W656 HydrophobicContact CG-CB 4.15Å; F645-W656 HydrophobicContact CZ-CB 3.36Å; F645-W656 AromaticContact CZ-CD1 3.96Å; F645-W656 AromaticContact CZ-CD2 3.86Å; F645-W656 HydrophobicContact CZ-CD2 3.86Å; F645-W656 HydrophobicContact CZ-CE3 4.33Å; F645-W656 AromaticContact CZ-CG 3.44Å; F645-W656 HydrophobicContact CZ-CG 3.44Å; F645-W656 VanDerWaalsContact CZ-CG 3.44Å; F645-W656 PolarHBondContact N-O 2.82Å; F645-W656 PolarHBondContact O-N 2.99Å; E654-W656 PolarHBondContact OE2-NE1 3.13Å; E654-W656 VanDerWaalsContact OE2-NE1 3.14Å; W656-L663 WeakPolarHBondContact CH2-O 3.49Å; W656-L663 WeakPolarHBondContact CZ3-O 3.34Å; W656-P665 HydrophobicContact CD2-CB 4.03Å; W656-P665 HydrophobicContact CG-CB 4.32Å; W656-P665 HydrophobicContact CZ2-CB 4.11Å; W656-P665 HydrophobicContact CZ2-CG 4.22Å
657	D	89.8	Confident	87.6	Confident	13 Å²	13	42.6 Å²	42.6	7%	0.07	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	112.9	167.1	176	27.2	0	0	0	110.1	T643 V644 N659 S660 S661 V666	T643-D657 VanDerWaalsContact CB-OD1 3.26Å; T643-D657 WeakPolarHBondContact CB-OD1 3.41Å; T643-D657 WeakPolarHBondContact O-CA 3.13Å; T643-D657 PolarHBondContact OG1-OD1 2.91Å; V644-D657 HydrophobicContact CG2-CB 3.99Å; D657-N659 PolarHBondContact O-N 3.09Å; D657-N659 VanDerWaalsContact O-N 3.11Å; D657-N659 PolarHBondContact OD1-N 2.87Å; D657-S660 PolarHBondContact O-N 2.92Å; D657-S661 PolarHBondContact O-N 3.31Å; D657-S661 VanDerWaalsContact O-O 3.05Å; D657-V666 HydrophobicContact CB-CG2 4.2Å
658	L	87.6	Confident	87.4	Confident	36 Å²	36	45 Å²	45	19%	0.188	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.4	-176.1	-61.5	173.2	0	0	0	113.9	L614 L624 F626 T643 F645	L614-L658 HydrophobicContact CD2-CD1 4.19Å; L624-L658 HydrophobicContact CD1-CD2 4.31Å; F626-L658 HydrophobicContact CE1-CD2 3.72Å; F626-L658 HydrophobicContact CE2-CD2 4.39Å; F626-L658 HydrophobicContact CZ-CD2 3.42Å; F626-L658 VanDerWaalsContact CZ-CD2 3.42Å; T643-L658 WeakPolarHBondContact O-CG 3.33Å; T643-L658 PolarHBondContact O-N 3.11Å; F645-L658 HydrophobicContact CE1-CD2 4.04Å; F645-L658 HydrophobicContact CE1-CG 4.25Å
659	N	86.8	Confident	87.2	Confident	125 Å²	125	46.5 Å²	46.5	67%	0.668	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-30.6	172.1	-65.3	-44.4	0	0	0	112.8	T643 D657	T643-N659 PolarHBondContact OG1-ND2 2.9Å; D657-N659 PolarHBondContact O-N 3.09Å; D657-N659 VanDerWaalsContact O-N 3.11Å; D657-N659 PolarHBondContact OD1-N 2.87Å
660	S	83.1	Confident	87.2	Confident	79 Å²	79	49.9 Å²	49.9	55%	0.552	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-43.1	-175.9	-171.5	0	0	0	0	112	D657	D657-S660 PolarHBondContact O-N 2.92Å
661	S	81.9	Confident	87.1	Confident	26 Å²	26	46.6 Å²	46.6	18%	0.182	27%	0.267	C	S	.	.			trans	-153.5	139.2	-178.7	174.5	0	0	0	0	111.4	D657 L663 D664	D657-S661 PolarHBondContact O-N 3.31Å; D657-S661 VanDerWaalsContact O-O 3.05Å; S661-L663 PolarHBondContact OG-N 3.24Å; S661-D664 WeakPolarHBondContact CB-O 3.29Å; S661-D664 PolarHBondContact OG-N 3.39Å; S661-D664 PolarHBondContact OG-O 2.78Å
662	F	84.1	Confident	86.8	Confident	124 Å²	124	48 Å²	48	54%	0.544	28%	0.276	S	S	.	.	S	Bend	trans	-115.3	4.5	172.1	65.2	-90.6	0	0	0	112.7	F626	F626-F662 WeakPolarHBondContact CD1-O 3.38Å; F626-F662 HydrophobicContact CE1-CB 4.47Å
663	L	84.4	Confident	86.3	Confident	116 Å²	116	53 Å²	53	61%	0.607	31%	0.312	S	S	*	.	S	Bend	trans	-111.2	-52.2	-178.4	-66.6	177.9	0	0	0	111.3	W656 S661	W656-L663 WeakPolarHBondContact CH2-O 3.49Å; W656-L663 WeakPolarHBondContact CZ3-O 3.34Å; S661-L663 PolarHBondContact OG-N 3.24Å
664	D	86.8	Confident	85.7	Confident	109 Å²	109	56.9 Å²	56.9	58%	0.583	35%	0.351	S	S	*	.	S	Bend	trans	-117.7	148.1	-176	-54.1	-73.1	0	0	0	111	S661	S661-D664 WeakPolarHBondContact CB-O 3.29Å; S661-D664 PolarHBondContact OG-N 3.39Å; S661-D664 PolarHBondContact OG-O 2.78Å
665	P	88.3	Confident	85.2	Confident	36 Å²	36	59 Å²	59	23%	0.234	36%	0.362	C	S	.	.			trans	-64.8	149	173.7	27.3	-34.3	0	0	0	111.8	E654 W656 V668	E654-P665 HydrophobicContact CB-CB 4.09Å; E654-P665 HydrophobicContact CG-CB 4.44Å; E654-P665 HydrophobicContact CG-CG 4.41Å; W656-P665 HydrophobicContact CD2-CB 4.03Å; W656-P665 HydrophobicContact CG-CB 4.32Å; W656-P665 HydrophobicContact CZ2-CB 4.11Å; W656-P665 HydrophobicContact CZ2-CG 4.22Å; P665-V668 HydrophobicContact CB-CG2 3.98Å; P665-V668 HydrophobicContact CG-CG2 3.41Å; P665-V668 VanDerWaalsContact CG-CG2 3.41Å
666	V	86.9	Confident	84.8	Confident	58 Å²	58	63.2 Å²	63.2	35%	0.352	38%	0.381	S	S	.	.	S	Bend	trans	-82	-34	-178.8	179.9	0	0	0	0	111.5	I655 D657	I655-V666 PolarHBondContact O-N 3.07Å; D657-V666 HydrophobicContact CB-CG2 4.2Å
667	I	86.3	Confident	84.4	Confident	14 Å²	14	63.5 Å²	63.5	7%	0.072	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.7	175.3	-51.2	175.9	0	0	0	108.1	P346 E654 I655 L703	P346-I667 HydrophobicContact CB-CG2 4.48Å; P346-I667 HydrophobicContact CG-CG2 3.92Å; E654-I667 CarbonylContact C-O 3.53Å; E654-I667 WeakPolarHBondContact CA-O 3.5Å; I655-I667 HydrophobicContact CB-CB 3.97Å; I655-I667 HydrophobicContact CB-CD1 4.43Å; I655-I667 HydrophobicContact CB-CG1 4.38Å; I655-I667 HydrophobicContact CG1-CB 4.01Å; I655-I667 HydrophobicContact CG1-CD1 4.4Å; I655-I667 PolarHBondContact N-O 2.89Å; I655-I667 PolarHBondContact O-N 3.42Å; I667-L703 HydrophobicContact CD1-CD2 4.45Å
668	V	87.8	Confident	83.9	Confident	51 Å²	51	64.7 Å²	64.7	31%	0.309	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	121.4	171.1	-175.1	0	0	0	0	108.7	Q652 L653 E654 P665	Q652-V668 HydrophobicContact CB-CG1 4.2Å; Q652-V668 HydrophobicContact CG-CG1 4.29Å; L653-V668 WeakPolarHBondContact O-CA 3.23Å; E654-V668 HydrophobicContact CG-CG2 4.44Å; P665-V668 HydrophobicContact CB-CG2 3.98Å; P665-V668 HydrophobicContact CG-CG2 3.41Å; P665-V668 VanDerWaalsContact CG-CG2 3.41Å
669	Q	86.8	Confident	83.5	Confident	32 Å²	32	63 Å²	63	15%	0.15	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	108.2	177.6	175.5	55.7	58.5	0	0	109.1	P346 Q652 L653 Y701	P346-Q669 HydrophobicContact CG-CB 3.86Å; P346-Q669 HydrophobicContact CG-CG 4.13Å; Q652-Q669 WeakPolarHBondContact CA-O 3.38Å; L653-Q669 HydrophobicContact CB-CB 4.27Å; L653-Q669 HydrophobicContact CD2-CB 4.37Å; L653-Q669 PolarHBondContact N-O 3.21Å; L653-Q669 PolarHBondContact O-N 2.93Å; Q669-Y701 HydrophobicContact CG-CD1 4.26Å; Q669-Y701 HydrophobicContact CG-CE1 3.66Å
670	P	86.8	Confident	83.4	Confident	73 Å²	73	57.1 Å²	57.1	47%	0.474	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	151.9	178.1	28.7	-35.2	0	0	0	111.9
671	A	83.3	Confident	83.5	Confident	20 Å²	20	53.5 Å²	53.5	17%	0.165	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-69	157.7	170.1	0	0	0	0	0	112.1	G651 M677	G651-A671 WeakPolarHBondContact O-CB 3.4Å; G651-A671 PolarHBondContact O-N 3.41Å; A671-M677 HydrophobicContact CB-CE 4.35Å; A671-M677 HydrophobicContact CB-CG 4.04Å; A671-M677 HydrophobicContact CB-SD 4.42Å
672	A	79.1	Confident	83.5	Confident	54 Å²	54	53.1 Å²	53.1	45%	0.446	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-65.2	146.2	174.6	0	0	0	0	0	111.1	G674 L675	A672-G674 PolarHBondContact O-N 2.89Å; A672-L675 HydrophobicContact CB-CD1 4.06Å; A672-L675 HydrophobicContact CB-CG 4.25Å; A672-L675 PolarHBondContact O-N 3.14Å
673	P	77.9	Confident	83.3	Confident	141 Å²	141	47.3 Å²	47.3	92%	0.916	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	112.3	-173	-27.3	35.7	0	0	0	113.8
674	G	78.6	Confident	82.8	Confident	81 Å²	81	44.7 Å²	44.7	84%	0.835	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.1	-6.6	179.5	0	0	0	0	0	115.4	A672	A672-G674 PolarHBondContact O-N 2.89Å
675	L	80.6	Confident	82.1	Confident	47 Å²	47	45 Å²	45	25%	0.246	29%	0.287	C	S	.	.			trans	-88.5	157.8	167.9	-59.1	-168	0	0	0	110.9	A672 D693 D695	A672-L675 HydrophobicContact CB-CD1 4.06Å; A672-L675 HydrophobicContact CB-CG 4.25Å; A672-L675 PolarHBondContact O-N 3.14Å; L675-D693 HydrophobicContact CD1-CB 4.17Å; L675-D695 HydrophobicContact CD1-CB 4.45Å; L675-D695 HydrophobicContact CD2-CB 3.77Å
676	K	81.8	Confident	81.5	Confident	92 Å²	92	44.2 Å²	44.2	40%	0.4	28%	0.281	S	S	.	.			trans	-116.3	136.7	166.3	-64.1	-175.8	174.9	-167.1	0	110.7	E650 D693 S694	E650-K676 HydrophobicContact CB-CB 4.39Å; E650-K676 HydrophobicContact CB-CD 4.04Å; E650-K676 HydrophobicContact CB-CG 4.18Å; E650-K676 HydrophobicContact CG-CD 4.19Å; E650-K676 CarbonylContact O-C 3.55Å; E650-K676 WeakPolarHBondContact O-CA 3.44Å; E650-K676 IonicContact OE1-NZ 2.7Å; E650-K676 PolarHBondContact OE1-NZ 2.75Å; E650-K676 VanDerWaalsContact OE2-CE 3.27Å; E650-K676 WeakPolarHBondContact OE2-CE 3.42Å; E650-K676 IonicContact OE2-NZ 2.72Å; E650-K676 PolarHBondContact OE2-NZ 3.23Å; K676-D693 CarbonylContact O-C 3.5Å; K676-D693 WeakPolarHBondContact O-CA 3.48Å; K676-S694 PolarHBondContact N-OG 3.47Å; K676-S694 PolarHBondContact O-N 2.84Å
677	M	82.9	Confident	81.2	Confident	7 Å²	7	42.7 Å²	42.7	3%	0.034	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.8	166.7	-68.6	174.1	167.4	0	0	109.4	V648 E650 Q652 L653 A671 V691 D693	V648-M677 HydrophobicContact CG1-CB 3.65Å; E650-M677 PolarHBondContact O-N 3.09Å; Q652-M677 VanDerWaalsContact C-SD 3.55Å; L653-M677 HydrophobicContact CB-CE 4.13Å; L653-M677 HydrophobicContact CB-SD 3.79Å; L653-M677 PolarHBondContact N-SD 2.9Å; A671-M677 HydrophobicContact CB-CE 4.35Å; A671-M677 HydrophobicContact CB-CG 4.04Å; A671-M677 HydrophobicContact CB-SD 4.42Å; M677-V691 HydrophobicContact CB-CG1 3.89Å; M677-V691 HydrophobicContact CE-CG1 4.27Å; M677-V691 HydrophobicContact CG-CG1 3.65Å; M677-V691 HydrophobicContact SD-CG1 3.97Å; M677-D693 WeakPolarHBondContact CG-OD1 3.08Å
678	T	79.8	Confident	81.1	Confident	38 Å²	38	42 Å²	42	23%	0.233	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	-20.8	-173.7	68.4	0	0	0	0	114.8	P361 L363 G692	P361-T678 PolarHBondContact O-OG1 2.98Å; P361-T678 VanDerWaalsContact O-OG1 3.09Å; L363-T678 WeakPolarHBondContact CD2-O 3.4Å; T678-G692 PolarHBondContact N-O 3.5Å; T678-G692 PolarHBondContact OG1-O 3.1Å
679	S	79.3	Confident	80.9	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.007	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	153.3	-167.4	49	0	0	0	0	113.1	L363 E634 V691 G692	L363-S679 VanDerWaalsContact CD2-CB 3.49Å; E634-S679 WeakPolarHBondContact OE2-CA 3.32Å; S679-V691 VanDerWaalsContact O-CA 3.26Å; S679-V691 WeakPolarHBondContact O-CA 3.43Å; S679-V691 WeakPolarHBondContact O-CG1 3.19Å; S679-G692 PolarHBondContact O-N 3.13Å; S679-G692 WeakPolarHBondContact OG-CA 2.84Å; S679-G692 PolarHBondContact OG-N 3.41Å; S679-G692 VanDerWaalsContact OG-N 3.13Å
680	L	85.7	Confident	80.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	112.6	-164.5	178.1	57.3	0	0	0	115.1	P369 E634 R636 S646 V648 L653 V689 V691	P369-L680 VanDerWaalsContact CB-O 3.29Å; P369-L680 WeakPolarHBondContact CB-O 3.22Å; P369-L680 VanDerWaalsContact CD-O 3.29Å; P369-L680 WeakPolarHBondContact CD-O 3.46Å; P369-L680 VanDerWaalsContact CG-O 3.24Å; P369-L680 WeakPolarHBondContact CG-O 3.1Å; E634-L680 HydrophobicContact CB-CB 4.27Å; E634-L680 HydrophobicContact CG-CB 4.18Å; E634-L680 PolarHBondContact OE2-N 3.36Å; R636-L680 HydrophobicContact CG-CG 4.2Å; R636-L680 WeakPolarHBondContact CG-O 3.46Å; S646-L680 WeakPolarHBondContact OG-CD1 3.3Å; S646-L680 WeakPolarHBondContact OG-CD2 3.41Å; S646-L680 WeakPolarHBondContact OG-CG 3.15Å; V648-L680 HydrophobicContact CB-CB 4.13Å; V648-L680 HydrophobicContact CB-CD2 4.02Å; V648-L680 HydrophobicContact CG2-CB 3.9Å; V648-L680 HydrophobicContact CG2-CD1 3.8Å; V648-L680 HydrophobicContact CG2-CD2 3.87Å; V648-L680 HydrophobicContact CG2-CG 4.08Å; L653-L680 HydrophobicContact CD1-CD1 3.57Å; L680-V689 HydrophobicContact CD1-CG1 3.51Å; L680-V691 HydrophobicContact CD1-CG2 4.27Å
681	L	84	Confident	80.7	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140	-178.4	168.2	65.2	0	0	0	111.2	S368 P369 V371 L381 V689 V690	S368-L681 WeakPolarHBondContact OG-CD1 3.46Å; P369-L681 HydrophobicContact CG-CB 3.53Å; V371-L681 HydrophobicContact CB-CB 4.48Å; V371-L681 HydrophobicContact CB-CD2 4.13Å; V371-L681 HydrophobicContact CG1-CD2 3.67Å; L381-L681 HydrophobicContact CD1-CD2 3.98Å; L681-V689 CarbonylContact O-C 3.6Å; L681-V689 WeakPolarHBondContact O-CA 3.37Å; L681-V689 WeakPolarHBondContact O-CG1 3.25Å; L681-V690 HydrophobicContact CB-CB 3.99Å; L681-V690 HydrophobicContact CB-CG2 4.41Å; L681-V690 HydrophobicContact CD2-CB 3.92Å; L681-V690 HydrophobicContact CD2-CG2 3.64Å; L681-V690 HydrophobicContact CG-CB 4.34Å; L681-V690 HydrophobicContact CG-CG2 4.23Å; L681-V690 PolarHBondContact N-O 2.87Å; L681-V690 PolarHBondContact O-N 3.43Å
682	F	83.4	Confident	80.7	Confident	18 Å²	18	33.9 Å²	33.9	8%	0.079	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.6	153.6	-85.4	-80.6	0	0	0	110.7	R636 W637 P639 V644 S646 V689 L703	R636-F682 HydrophobicContact CB-CD2 3.98Å; R636-F682 HydrophobicContact CB-CE2 4.38Å; R636-F682 WeakPolarHBondContact O-CE2 3.22Å; W637-F682 WeakPolarHBondContact O-CD2 3.46Å; P639-F682 VanDerWaalsContact CD-CB 3.46Å; P639-F682 HydrophobicContact CG-CB 4.17Å; V644-F682 HydrophobicContact CG1-CZ 4.35Å; S646-F682 WeakPolarHBondContact OG-CE2 3.48Å; F682-V689 HydrophobicContact CD1-CG2 3.85Å; F682-V689 HydrophobicContact CE1-CG2 3.73Å; F682-V689 HydrophobicContact CG-CG2 4.49Å; F682-V689 HydrophobicContact CZ-CG2 4.27Å; F682-L703 HydrophobicContact CE1-CD1 3.72Å; F682-L703 HydrophobicContact CZ-CD1 4.45Å
683	A	79.7	Confident	80.8	Confident	3 Å²	3	31.8 Å²	31.8	3%	0.025	20%	0.198	C	C	.	.			trans	-63.2	137.1	167.8	0	0	0	0	0	110.3	T686 C688	A683-T686 VanDerWaalsContact CB-OG1 3.23Å; A683-T686 WeakPolarHBondContact CB-OG1 3.4Å; A683-T686 VanDerWaalsContact O-O 3.14Å; A683-C688 HydrophobicContact CB-CB 4.26Å; A683-C688 PolarHBondContact N-O 2.82Å
684	S	72.9	Confident	80.9	Confident	61 Å²	61	26.8 Å²	26.8	43%	0.427	17%	0.166	S	C	.	.	S	Bend	trans	-70.7	-41	-177.1	55.5	0	0	0	0	113	K640	K640-S684 VanDerWaalsContact CE-O 3.28Å; K640-S684 WeakPolarHBondContact CE-O 3.49Å
685	L	72.4	Confident	80.7	Confident	116 Å²	116	27.5 Å²	27.5	61%	0.607	15%	0.151	S	C	*	.	S	Bend	trans	-94.2	-26.8	-174.6	-60.7	-170	0	0	0	114.4	P378 K640	P378-L685 HydrophobicContact CB-CD1 3.6Å; P378-L685 HydrophobicContact CB-CG 4.14Å; P378-L685 HydrophobicContact CG-CD1 3.55Å; K640-L685 VanDerWaalsContact NZ-C 3.32Å; K640-L685 PolarHBondContact NZ-O 3.34Å
686	T	76.6	Confident	80.3	Confident	18 Å²	18	25.3 Å²	25.3	11%	0.11	14%	0.14	C	C	.	.	S	Bend	trans	-115.1	164.6	-175.4	54.6	0	0	0	0	111.2	Y289 A683 C688	Y289-T686 HydrophobicContact CD1-CG2 4.22Å; Y289-T686 HydrophobicContact CD2-CG2 4.46Å; Y289-T686 HydrophobicContact CE1-CG2 3.75Å; Y289-T686 HydrophobicContact CE2-CG2 4.01Å; Y289-T686 WeakPolarHBondContact CE2-OG1 3.46Å; Y289-T686 VanDerWaalsContact CZ-OG1 3.28Å; Y289-T686 VanDerWaalsContact O-CG2 3.24Å; Y289-T686 WeakPolarHBondContact O-CG2 3.44Å; Y289-T686 PolarHBondContact OH-OG1 3.38Å; A683-T686 VanDerWaalsContact CB-OG1 3.23Å; A683-T686 WeakPolarHBondContact CB-OG1 3.4Å; A683-T686 VanDerWaalsContact O-O 3.14Å; T686-C688 PolarHBondContact O-N 2.79Å; T686-C688 VanDerWaalsContact O-N 3.16Å
687	D	80.6	Confident	80.1	Confident	27 Å²	27	23.2 Å²	23.2	14%	0.144	13%	0.132	C	C	.	.	S	Bend	trans	-95	60.3	-179	-61.9	32.5	0	0	0	107.7	K291 K640 L703	K291-D687 WeakPolarHBondContact CE-OD1 3.46Å; K291-D687 WeakPolarHBondContact CE-OD2 3.45Å; K291-D687 IonicContact NZ-OD1 3.71Å; K291-D687 PolarHBondContact NZ-OD1 2.8Å; K291-D687 IonicContact NZ-OD2 3.14Å; K291-D687 PolarHBondContact NZ-OD2 3.12Å; K640-D687 IonicContact NZ-OD1 2.63Å; K640-D687 PolarHBondContact NZ-OD1 2.75Å; D687-L703 PolarHBondContact O-N 2.85Å
688	C	82.8	Confident	80	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	140.7	-171.2	-62.7	0	0	0	0	109.8	Y289 A683 T686 V700 Y701	Y289-C688 HydrophobicContact CD2-CB 4.28Å; Y289-C688 VanDerWaalsContact CD2-SG 3.6Å; Y289-C688 HydrophobicContact CE2-CB 4.02Å; A683-C688 HydrophobicContact CB-CB 4.26Å; A683-C688 PolarHBondContact N-O 2.82Å; T686-C688 PolarHBondContact O-N 2.79Å; T686-C688 VanDerWaalsContact O-N 3.16Å; C688-V700 HydrophobicContact CB-CG1 4.04Å; C688-Y701 CarbonylContact C-O 3.1Å; C688-Y701 VanDerWaalsContact CA-O 3.23Å; C688-Y701 WeakPolarHBondContact CA-O 3.19Å
689	V	84.8	Confident	80.1	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.4	176.2	175	0	0	0	0	107.9	L653 I655 L680 L681 F682 V691 Y701 L703	L653-V689 HydrophobicContact CD1-CG1 4.24Å; L653-V689 HydrophobicContact CD2-CG1 4.24Å; I655-V689 HydrophobicContact CD1-CG2 4.27Å; L680-V689 HydrophobicContact CD1-CG1 3.51Å; L681-V689 CarbonylContact O-C 3.6Å; L681-V689 WeakPolarHBondContact O-CA 3.37Å; L681-V689 WeakPolarHBondContact O-CG1 3.25Å; F682-V689 HydrophobicContact CD1-CG2 3.85Å; F682-V689 HydrophobicContact CE1-CG2 3.73Å; F682-V689 HydrophobicContact CG-CG2 4.49Å; F682-V689 HydrophobicContact CZ-CG2 4.27Å; V689-V691 HydrophobicContact CG1-CG2 4.04Å; V689-Y701 PolarHBondContact N-O 3.06Å; V689-Y701 PolarHBondContact O-N 2.85Å; V689-L703 HydrophobicContact CG2-CD1 3.75Å; V689-L703 HydrophobicContact CG2-CD2 4.01Å; V689-L703 HydrophobicContact CG2-CG 3.92Å
690	V	84.4	Confident	80.3	Confident	5 Å²	5	21.8 Å²	21.8	3%	0.03	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.6	174.9	-163.1	0	0	0	0	108.9	V371 L681 V698 T699 V700	V371-V690 HydrophobicContact CG1-CB 4.45Å; V371-V690 HydrophobicContact CG1-CG1 4.19Å; L681-V690 HydrophobicContact CB-CB 3.99Å; L681-V690 HydrophobicContact CB-CG2 4.41Å; L681-V690 HydrophobicContact CD2-CB 3.92Å; L681-V690 HydrophobicContact CD2-CG2 3.64Å; L681-V690 HydrophobicContact CG-CB 4.34Å; L681-V690 HydrophobicContact CG-CG2 4.23Å; L681-V690 PolarHBondContact N-O 2.87Å; L681-V690 PolarHBondContact O-N 3.43Å; V690-V698 HydrophobicContact CG1-CG1 3.36Å; V690-T699 CarbonylContact C-O 3.53Å; V690-T699 WeakPolarHBondContact CA-O 3.47Å; V690-V700 HydrophobicContact CG1-CG2 4.05Å; V690-V700 HydrophobicContact CG2-CG1 4.36Å; V690-V700 HydrophobicContact CG2-CG2 4.07Å
691	V	84.3	Confident	80.2	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.3	-178.4	178.8	0	0	0	0	109.4	V648 L653 M677 S679 L680 V689 V698 T699 Y701	V648-V691 HydrophobicContact CG2-CG1 4.5Å; V648-V691 HydrophobicContact CG2-CG2 4.49Å; L653-V691 HydrophobicContact CD1-CG2 4.33Å; L653-V691 HydrophobicContact CD2-CG2 4.08Å; M677-V691 HydrophobicContact CB-CG1 3.89Å; M677-V691 HydrophobicContact CE-CG1 4.27Å; M677-V691 HydrophobicContact CG-CG1 3.65Å; M677-V691 HydrophobicContact SD-CG1 3.97Å; S679-V691 VanDerWaalsContact O-CA 3.26Å; S679-V691 WeakPolarHBondContact O-CA 3.43Å; S679-V691 WeakPolarHBondContact O-CG1 3.19Å; L680-V691 HydrophobicContact CD1-CG2 4.27Å; V689-V691 HydrophobicContact CG1-CG2 4.04Å; V691-V698 CarbonylContact O-C 3.55Å; V691-V698 WeakPolarHBondContact O-CA 3.47Å; V691-T699 PolarHBondContact N-O 3.25Å; V691-T699 PolarHBondContact O-N 3.29Å; V691-Y701 HydrophobicContact CB-CE2 4.13Å; V691-Y701 HydrophobicContact CG2-CD2 4.19Å; V691-Y701 HydrophobicContact CG2-CE2 4.15Å
692	G	82.3	Confident	80.1	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	140.2	169.4	0	0	0	0	0	111.7	T678 S679 Q697	T678-G692 PolarHBondContact N-O 3.5Å; T678-G692 PolarHBondContact OG1-O 3.1Å; S679-G692 PolarHBondContact O-N 3.13Å; S679-G692 WeakPolarHBondContact OG-CA 2.84Å; S679-G692 PolarHBondContact OG-N 3.41Å; S679-G692 VanDerWaalsContact OG-N 3.13Å; G692-Q697 WeakPolarHBondContact CA-O 3.44Å
693	D	81.8	Confident	80	Confident	10 Å²	10	23.2 Å²	23.2	5%	0.053	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	148.7	178.7	-64.4	-47.8	0	0	0	111	P361 L675 K676 M677 D695 G696 Q697	P361-D693 WeakPolarHBondContact CD-O 3.41Å; P361-D693 WeakPolarHBondContact CG-O 3.35Å; L675-D693 HydrophobicContact CD1-CB 4.17Å; K676-D693 CarbonylContact O-C 3.5Å; K676-D693 WeakPolarHBondContact O-CA 3.48Å; M677-D693 WeakPolarHBondContact CG-OD1 3.08Å; D693-D695 PolarHBondContact O-N 2.99Å; D693-G696 PolarHBondContact O-N 3.33Å; D693-Q697 PolarHBondContact N-O 3.17Å
694	S	80.6	Confident	79.4	Confident	35 Å²	35	27.4 Å²	27.4	25%	0.245	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-13.1	-173.8	60	0	0	0	0	116.9	C360 K676	C360-S694 PolarHBondContact SG-O 3.23Å; K676-S694 PolarHBondContact N-OG 3.47Å; K676-S694 PolarHBondContact O-N 2.84Å
695	D	74.4	Confident	78.7	Confident	96 Å²	96	29.6 Å²	29.6	51%	0.513	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	5.3	177.5	-171.6	56.7	0	0	0	113.6	L675 D693 Q697	L675-D695 HydrophobicContact CD1-CB 4.45Å; L675-D695 HydrophobicContact CD2-CB 3.77Å; D693-D695 PolarHBondContact O-N 2.99Å; D695-Q697 PolarHBondContact OD2-NE2 2.78Å
696	G	71.9	Confident	78.2	Confident	2 Å²	2	25.5 Å²	25.5	2%	0.021	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	11.3	-179.2	0	0	0	0	0	113.9	Y385 D693	Y385-G696 WeakPolarHBondContact CE1-O 3.22Å; D693-G696 PolarHBondContact O-N 3.33Å
697	Q	77	Confident	76.8	Confident	48 Å²	48	32.6 Å²	32.6	22%	0.224	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	148.8	175.9	-56.4	-169.7	46.1	0	0	110.7	F352 G692 D693 D695	F352-Q697 CarbonylContact O-C 3.53Å; F352-Q697 WeakPolarHBondContact O-CA 3.4Å; G692-Q697 WeakPolarHBondContact CA-O 3.44Å; D693-Q697 PolarHBondContact N-O 3.17Å; D695-Q697 PolarHBondContact OD2-NE2 2.78Å
698	V	81.4	Confident	74.9	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	108.7	-179.1	179.1	0	0	0	0	108.5	S351 F352 V371 V383 V690 V691	S351-V698 WeakPolarHBondContact CA-O 3.42Å; F352-V698 HydrophobicContact CB-CB 4.45Å; F352-V698 HydrophobicContact CD2-CB 4.25Å; F352-V698 HydrophobicContact CD2-CG1 4.16Å; F352-V698 WeakPolarHBondContact CD2-O 3.38Å; F352-V698 PolarHBondContact N-O 2.9Å; F352-V698 PolarHBondContact O-N 3.22Å; V371-V698 HydrophobicContact CG2-CG1 4.25Å; V383-V698 HydrophobicContact CG1-CG2 3.95Å; V383-V698 HydrophobicContact CG2-CG2 4.29Å; V690-V698 HydrophobicContact CG1-CG1 3.36Å; V691-V698 CarbonylContact O-C 3.55Å; V691-V698 WeakPolarHBondContact O-CA 3.47Å
699	T	81.8	Confident	72.5	Confident	10 Å²	10	38.7 Å²	38.7	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.5	-170.1	-58.2	0	0	0	0	111.5	I348 V690 V691 Y701	I348-T699 HydrophobicContact CG1-CG2 4.41Å; I348-T699 HydrophobicContact CG2-CG2 3.88Å; V690-T699 CarbonylContact C-O 3.53Å; V690-T699 WeakPolarHBondContact CA-O 3.47Å; V691-T699 PolarHBondContact N-O 3.25Å; V691-T699 PolarHBondContact O-N 3.29Å; T699-Y701 HydrophobicContact CG2-CD2 4.07Å; T699-Y701 HydrophobicContact CG2-CE1 4.31Å; T699-Y701 HydrophobicContact CG2-CE2 3.53Å
700	V	83.3	Confident	69.9	Low	5 Å²	5	47.3 Å²	47.3	3%	0.03	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.2	175.6	-172.7	0	0	0	0	109.5	Y289 L349 I350 F352 C688 V690	Y289-V700 HydrophobicContact CD2-CG1 4.45Å; L349-V700 PolarHBondContact N-O 2.9Å; I350-V700 HydrophobicContact CB-CB 4.32Å; I350-V700 HydrophobicContact CB-CG2 4.29Å; I350-V700 PolarHBondContact N-O 3.07Å; I350-V700 PolarHBondContact O-N 2.98Å; F352-V700 HydrophobicContact CD2-CG2 4.44Å; F352-V700 HydrophobicContact CE2-CG2 3.55Å; F352-V700 HydrophobicContact CZ-CG2 4.13Å; C688-V700 HydrophobicContact CB-CG1 4.04Å; V690-V700 HydrophobicContact CG1-CG2 4.05Å; V690-V700 HydrophobicContact CG2-CG1 4.36Å; V690-V700 HydrophobicContact CG2-CG2 4.07Å
701	Y	83.6	Confident	67.4	Low	13 Å²	13	51.7 Å²	51.7	5%	0.051	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	138.8	175	-64.8	-91.7	0	0	0	110.6	P346 I348 L653 Q669 C688 V689 V691 T699	P346-Y701 HydrophobicContact CB-CD1 4.5Å; P346-Y701 HydrophobicContact CG-CD1 4.3Å; I348-Y701 HydrophobicContact CD1-CE1 4.23Å; I348-Y701 HydrophobicContact CG1-CD1 3.84Å; I348-Y701 HydrophobicContact CG1-CE1 3.48Å; I348-Y701 VanDerWaalsContact CG1-CE1 3.48Å; L653-Y701 HydrophobicContact CD2-CD2 4.46Å; Q669-Y701 HydrophobicContact CG-CD1 4.26Å; Q669-Y701 HydrophobicContact CG-CE1 3.66Å; C688-Y701 CarbonylContact C-O 3.1Å; C688-Y701 VanDerWaalsContact CA-O 3.23Å; C688-Y701 WeakPolarHBondContact CA-O 3.19Å; V689-Y701 PolarHBondContact N-O 3.06Å; V689-Y701 PolarHBondContact O-N 2.85Å; V691-Y701 HydrophobicContact CB-CE2 4.13Å; V691-Y701 HydrophobicContact CG2-CD2 4.19Å; V691-Y701 HydrophobicContact CG2-CE2 4.15Å; T699-Y701 HydrophobicContact CG2-CD2 4.07Å; T699-Y701 HydrophobicContact CG2-CE1 4.31Å; T699-Y701 HydrophobicContact CG2-CE2 3.53Å
702	Q	83.3	Confident	64.7	Low	27 Å²	27	57.3 Å²	57.3	13%	0.126	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	130.7	167	-169.1	162.8	16.7	0	0	110.3	A288 P346 S347 L349 Q704	A288-Q702 PolarHBondContact O-NE2 2.78Å; A288-Q702 VanDerWaalsContact O-NE2 3.11Å; P346-Q702 WeakPolarHBondContact CA-O 3.47Å; P346-Q702 WeakPolarHBondContact CB-O 2.95Å; S347-Q702 PolarHBondContact O-N 2.97Å; L349-Q702 HydrophobicContact CD1-CB 3.82Å; L349-Q702 HydrophobicContact CD1-CG 4.42Å; L349-Q702 HydrophobicContact CD2-CB 4.13Å; L349-Q702 HydrophobicContact CG-CB 3.84Å; Q702-Q704 HydrophobicContact CG-CG 4.41Å; Q702-Q704 PolarHBondContact O-N 2.7Å
703	L	81	Confident	62	Low	12 Å²	12	64.7 Å²	64.7	6%	0.063	36%	0.361	C	S	.	.			trans	-81.4	109.1	167.3	-58.9	-172.6	0	0	0	108.8	P346 I655 I667 F682 D687 V689 L706	P346-L703 HydrophobicContact CB-CD2 4.49Å; I655-L703 HydrophobicContact CD1-CD2 4.05Å; I655-L703 HydrophobicContact CG1-CD2 3.92Å; I655-L703 HydrophobicContact CG2-CD1 4.45Å; I667-L703 HydrophobicContact CD1-CD2 4.45Å; F682-L703 HydrophobicContact CE1-CD1 3.72Å; F682-L703 HydrophobicContact CZ-CD1 4.45Å; D687-L703 PolarHBondContact O-N 2.85Å; V689-L703 HydrophobicContact CG2-CD1 3.75Å; V689-L703 HydrophobicContact CG2-CD2 4.01Å; V689-L703 HydrophobicContact CG2-CG 3.92Å; L703-L706 HydrophobicContact CB-CD1 4.17Å; L703-L706 HydrophobicContact CD1-CD1 3.84Å
704	Q	67.3	Low	59.6	Low	91 Å²	91	68.8 Å²	68.8	43%	0.425	40%	0.396	S	S	.	.			trans	-94.2	158.8	167.9	-55.5	-164.6	25.5	0	0	109.4	S347 Q702 L706	S347-Q704 PolarHBondContact OG-NE2 2.76Å; Q702-Q704 HydrophobicContact CG-CG 4.41Å; Q702-Q704 PolarHBondContact O-N 2.7Å; Q704-L706 PolarHBondContact O-N 2.86Å
705	N	58.3	Low	57.1	Low	107 Å²	107	76.5 Å²	76.5	57%	0.572	42%	0.421	S	S	*	.			trans	56	18.6	166.6	-58.6	-17.9	0	0	0	117.9	E343 H707	E343-N705 PolarHBondContact O-ND2 2.64Å; N705-H707 PolarHBondContact O-N 3.5Å; N705-H707 VanDerWaalsContact O-N 3.15Å
706	L	61.3	Low	54.8	Low	29 Å²	29	81.4 Å²	81.4	15%	0.152	44%	0.438	C	S	.	.			trans	-60	116.6	156.1	-75	178.4	0	0	0	108.4	V644 I655 L703 Q704 V708	V644-L706 HydrophobicContact CG1-CD1 4.2Å; V644-L706 HydrophobicContact CG1-CD2 4.37Å; I655-L706 HydrophobicContact CG2-CD2 4.45Å; L703-L706 HydrophobicContact CB-CD1 4.17Å; L703-L706 HydrophobicContact CD1-CD1 3.84Å; Q704-L706 PolarHBondContact O-N 2.86Å; L706-V708 PolarHBondContact O-N 2.95Å
707	H	46	Very low	52.7	Low	168 Å²	168	84.5 Å²	84.5	78%	0.778	47%	0.47	S	S	*	.			trans	-68.4	94.6	-178.3	-81.5	-69.4	0	0	0	111.2	N705 G709	N705-H707 PolarHBondContact O-N 3.5Å; N705-H707 VanDerWaalsContact O-N 3.15Å; H707-G709 VanDerWaalsContact C-N 3.26Å; H707-G709 PolarHBondContact O-N 3.2Å
708	V	40.9	Very low	50.1	Low	97 Å²	97	90.1 Å²	90.1	59%	0.588	50%	0.496	S	S	*	.			trans	-67.4	87.7	166.1	-176.4	0	0	0	0	108.3	L706	L706-V708 PolarHBondContact O-N 2.95Å
709	G	33.7	Very low	47.4	Very low	58 Å²	58	97.5 Å²	97.5	60%	0.598	54%	0.535	S	S	*	.			trans	-56.4	138.5	163.6	0	0	0	0	0	109.3	H707 S711	H707-G709 VanDerWaalsContact C-N 3.26Å; H707-G709 PolarHBondContact O-N 3.2Å; G709-S711 VanDerWaalsContact C-N 3.31Å; G709-S711 PolarHBondContact O-N 2.82Å
710	E	29.4	Very low	44.8	Very low	180 Å²	180	102.7 Å²	102.7	84%	0.841	57%	0.567	S	S	*	*			trans	-67.8	76.4	-165.4	-63.5	-172.1	128.1	0	0	114.3	S712	E710-S712 PolarHBondContact O-N 2.64Å
711	S	32.6	Very low	41.9	Very low	97 Å²	97	106.4 Å²	106.4	68%	0.678	59%	0.593	S	S	*	*			trans	-76.6	23.2	169.3	57.7	0	0	0	0	113.3	G709 Q713	G709-S711 VanDerWaalsContact C-N 3.31Å; G709-S711 PolarHBondContact O-N 2.82Å; S711-Q713 VanDerWaalsContact C-N 3.25Å; S711-Q713 PolarHBondContact O-N 3.35Å
712	S	27	Very low	39.5	Very low	119 Å²	119	110.9 Å²	110.9	83%	0.832	61%	0.613	S	S	*	*			trans	-86.6	13.8	173.8	-169.8	0	0	0	0	113.3	E710	E710-S712 PolarHBondContact O-N 2.64Å
713	Q	25.6	Very low	36.6	Very low	154 Å²	154	117.5 Å²	117.5	72%	0.72	64%	0.644	S	S	*	*	S	Bend	trans	-106.9	138.8	163.1	-64.1	-163.4	12.7	0	0	110.6	S711 Y715	S711-Q713 VanDerWaalsContact C-N 3.25Å; S711-Q713 PolarHBondContact O-N 3.35Å; Q713-Y715 WeakPolarHBondContact O-CD2 3.4Å; Q713-Y715 PolarHBondContact O-N 3.38Å
714	A	30.3	Very low	34	Very low	97 Å²	97	122.3 Å²	122.3	80%	0.802	67%	0.674	S	S	*	*			trans	-73.2	91.9	-170.5	0	0	0	0	0	112.4	K716	A714-K716 VanDerWaalsContact C-N 3.26Å; A714-K716 PolarHBondContact O-N 3.18Å
715	Y	28.9	Very low	32	Very low	197 Å²	197	123.7 Å²	123.7	77%	0.773	69%	0.69	S	S	*	*			trans	-67.5	78.1	173.2	-84.2	-84.1	0	0	0	112.5	Q713 G717	Q713-Y715 WeakPolarHBondContact O-CD2 3.4Å; Q713-Y715 PolarHBondContact O-N 3.38Å; Y715-G717 PolarHBondContact O-N 3.44Å
716	K	25.5	Very low	30.5	Very low	198 Å²	198	128 Å²	128	86%	0.861	70%	0.704	S	S	*	*			trans	-69	96.9	165.7	-78.4	-172	174.4	-178	0	110.5	A714	A714-K716 VanDerWaalsContact C-N 3.26Å; A714-K716 PolarHBondContact O-N 3.18Å
717	G	28.2	Very low	28.9	Very low	68 Å²	68	130.8 Å²	130.8	70%	0.701	73%	0.726	S	S	*	*	S	Bend	trans	64.5	61.2	156.2	0	0	0	0	0	115.6	Y715	Y715-G717 PolarHBondContact O-N 3.44Å
718	H	23.4	Very low	28.1	Very low	165 Å²	165	134.7 Å²	134.7	76%	0.764	73%	0.734	S	S	*	*			trans	-118.4	127	153.8	-87.7	23.6	0	0	0	108.7	V720	H718-V720 PolarHBondContact O-N 2.94Å
719	N	23.7	Very low	27.6	Very low	155 Å²	155	138 Å²	138	83%	0.829	74%	0.742	S	S	*	*			trans	-66.2	127.4	176.5	-68.9	-14.2	0	0	0	109	S721	N719-S721 PolarHBondContact O-N 2.89Å
720	V	27.4	Very low	27.8	Very low	119 Å²	119	138.7 Å²	138.7	72%	0.721	75%	0.75	S	S	*	*			trans	-74.1	82.7	163	-178.6	0	0	0	0	107.2	H718 F722	H718-V720 PolarHBondContact O-N 2.94Å; V720-F722 PolarHBondContact O-N 3.18Å
721	S	23.4	Very low	27.9	Very low	84 Å²	84	145.6 Å²	145.6	59%	0.587	77%	0.769	S	S	*	*			trans	-70.4	110.1	174.1	51.3	0	0	0	0	109.3	N719 E723	N719-S721 PolarHBondContact O-N 2.89Å; S721-E723 PolarHBondContact O-N 2.84Å
722	F	32	Very low	27.6	Very low	107 Å²	107	148.1 Å²	148.1	47%	0.469	77%	0.773	S	S	.	*			trans	-64.8	72.6	163.1	-66	-87	0	0	0	109.7	V602 V720 V724	V602-F722 HydrophobicContact CG2-CE2 4.45Å; V720-F722 PolarHBondContact O-N 3.18Å; F722-V724 PolarHBondContact O-N 2.8Å
723	E	23	Very low	27.7	Very low	166 Å²	166	149.6 Å²	149.6	78%	0.776	77%	0.77	S	S	*	*			trans	-68.5	119	173.7	-74.2	-146.3	132.6	0	0	109.6	S721 P725	S721-E723 PolarHBondContact O-N 2.84Å; E723-P725 WeakPolarHBondContact O-CD 3.38Å
724	V	26.8	Very low	27.8	Very low	113 Å²	113	149.3 Å²	149.3	69%	0.685	77%	0.773	S	S	*	*			trans	-60.5	121	176.4	178.9	0	0	0	0	109.1	F722 K726	F722-V724 PolarHBondContact O-N 2.8Å; V724-K726 PolarHBondContact O-N 3.06Å
725	P	24.6	Very low	27.6	Very low	119 Å²	119	152.4 Å²	152.4	77%	0.773	77%	0.771	S	S	*	*			trans	-64.1	106.8	176.3	25.5	-32.9	0	0	0	109	E723 S727	E723-P725 WeakPolarHBondContact O-CD 3.38Å; P725-S727 PolarHBondContact O-N 3.23Å
726	K	26	Very low	27.5	Very low	197 Å²	197	149.6 Å²	149.6	86%	0.857	77%	0.771	S	S	*	*			trans	-55.7	112.7	-177.1	-70.2	174.6	-178.3	165.9	0	109.8	V724 R728	V724-K726 PolarHBondContact O-N 3.06Å; K726-R728 PolarHBondContact O-N 2.81Å
727	S	27.7	Very low	27.7	Very low	88 Å²	88	146.4 Å²	146.4	62%	0.615	77%	0.765	S	S	*	*			trans	-60.6	113.2	-177.5	52.8	0	0	0	0	110.3	P725 H729	P725-S727 PolarHBondContact O-N 3.23Å; S727-H729 VanDerWaalsContact C-N 3.25Å; S727-H729 PolarHBondContact O-N 2.84Å; S727-H729 PolarHBondContact O-ND1 2.74Å; S727-H729 PolarHBondContact OG-CE1 3.34Å; S727-H729 PolarHBondContact OG-ND1 3.11Å
728	R	29.8	Very low	27.6	Very low	251 Å²	251	152 Å²	152	95%	0.947	77%	0.77	S	S	*	*			trans	-66.7	86.5	174.6	-78.5	-173.9	173.5	-177.1	-0.6	109.4	K726 G730	K726-R728 PolarHBondContact O-N 2.81Å; R728-G730 PolarHBondContact O-N 3.05Å
729	H	30.9	Very low	28	Very low	165 Å²	165	151 Å²	151	76%	0.764	77%	0.77	S	S	*	*			trans	-62.4	105.6	164.4	-77.5	61.8	0	0	0	108	S727	S727-H729 VanDerWaalsContact C-N 3.25Å; S727-H729 PolarHBondContact O-N 2.84Å; S727-H729 PolarHBondContact O-ND1 2.74Å; S727-H729 PolarHBondContact OG-CE1 3.34Å; S727-H729 PolarHBondContact OG-ND1 3.11Å
730	G	36.9	Very low	28.3	Very low	74 Å²	74	150.7 Å²	150.7	76%	0.763	77%	0.765	S	S	*	*			trans	-61.8	149.5	164.3	0	0	0	0	0	110.3	R728	R728-G730 PolarHBondContact O-N 3.05Å
731	R	31.2	Very low	28.4	Very low	325 Å²	325	153.5 Å²	153.5	100%	1.226	77%	0.769	S	S	*	*			trans	-90.9	0	162.9	-75.3	-177.1	173	-178.9	-2.4	109.5

Retrieved 731 of 731 residues in 716.2 ms (Link to these results)

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