A0A5K4EYB2_SCHMA Loading...

Cytoplasmic dynein intermediate chain 2, (Dhic-2), putative

AlphaFold DB (A0A5K4EZI4), UniProt , Accession A0A5K4EYB2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 638 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	60.9	Low	83.9	Confident	203 Å²	203	137.1 Å²	137.1	100%	1	66%	0.657	S	S	*	*				0	-44.3	0	-74.5	-62.7	-90.5	0	0	112.7	D3 K5	M1-D3 PolarHBondContact O-N 3.34Å; M1-K5 PolarHBondContact O-N 3.2Å
2	S	77.8	Confident	84.5	Confident	95 Å²	95	137.8 Å²	137.8	66%	0.664	66%	0.655	S	S	*	*	H	α-helix	trans	-56.7	-46.7	176.4	-175.4	0	0	0	0	113.2	R4 K5 A6	S2-R4 PolarHBondContact O-N 3.44Å; S2-K5 PolarHBondContact O-N 3.25Å; S2-A6 PolarHBondContact O-N 2.96Å; S2-A6 VanDerWaalsContact O-N 3.11Å
3	D	80.5	Confident	85	Confident	131 Å²	131	131.9 Å²	131.9	70%	0.701	64%	0.644	S	S	*	*	H	α-helix	trans	-67.9	-36	-173.4	-52.7	-33.5	0	0	0	113.1	M1 K5 A6 E7	M1-D3 PolarHBondContact O-N 3.34Å; D3-K5 VanDerWaalsContact C-N 3.32Å; D3-K5 PolarHBondContact O-N 2.81Å; D3-A6 PolarHBondContact O-N 3.13Å; D3-E7 PolarHBondContact O-N 3.46Å
4	R	83	Confident	85.4	Confident	199 Å²	199	133.8 Å²	133.8	75%	0.751	65%	0.647	S	S	*	*	H	α-helix	trans	-67.6	-33.2	177.6	-153.3	176.7	-172.1	-178.8	2.2	111.9	S2 L8	S2-R4 PolarHBondContact O-N 3.44Å; R4-L8 PolarHBondContact O-N 3.25Å
5	K	87.4	Confident	85.6	Confident	141 Å²	141	132.6 Å²	132.6	61%	0.613	64%	0.644	S	S	*	*	H	α-helix	trans	-69.8	-41.8	174.3	-171.8	-179	176.2	-174.9	0	111.1	M1 S2 D3 L8 E9	M1-K5 PolarHBondContact O-N 3.2Å; S2-K5 PolarHBondContact O-N 3.25Å; D3-K5 VanDerWaalsContact C-N 3.32Å; D3-K5 PolarHBondContact O-N 2.81Å; K5-L8 PolarHBondContact O-N 3.27Å; K5-E9 PolarHBondContact O-N 3.5Å
6	A	87.7	Confident	85.9	Confident	57 Å²	57	130.5 Å²	130.5	47%	0.471	64%	0.636	S	S	.	*	H	α-helix	trans	-64.1	-38.7	176.9	0	0	0	0	0	112.3	S2 D3 R10	S2-A6 PolarHBondContact O-N 2.96Å; S2-A6 VanDerWaalsContact O-N 3.11Å; D3-A6 PolarHBondContact O-N 3.13Å; A6-R10 WeakPolarHBondContact O-CB 3.33Å; A6-R10 PolarHBondContact O-N 3.03Å
7	E	87.3	Confident	86.1	Confident	102 Å²	102	126.1 Å²	126.1	48%	0.477	63%	0.625	S	S	.	*	H	α-helix	trans	-65.7	-40.7	176.4	-160.9	-164.2	148	0	0	112.1	D3 R10 K11	D3-E7 PolarHBondContact O-N 3.46Å; E7-R10 PolarHBondContact O-N 3.32Å; E7-K11 PolarHBondContact O-N 3.48Å; E7-K11 VanDerWaalsContact OE1-CE 3.28Å; E7-K11 WeakPolarHBondContact OE1-CE 3.4Å; E7-K11 IonicContact OE1-NZ 3.76Å; E7-K11 PolarHBondContact OE1-NZ 2.81Å
8	L	86.6	Confident	86.3	Confident	121 Å²	121	126.2 Å²	126.2	63%	0.634	63%	0.626	S	S	*	*	H	α-helix	trans	-69.1	-38.9	179.8	-140.7	156.2	0	0	0	111.6	R4 K5 R10 K11 K12	R4-L8 PolarHBondContact O-N 3.25Å; K5-L8 PolarHBondContact O-N 3.27Å; L8-R10 VanDerWaalsContact C-N 3.34Å; L8-K11 PolarHBondContact O-N 3.05Å; L8-K12 WeakPolarHBondContact O-CB 3.41Å; L8-K12 PolarHBondContact O-N 3.2Å
9	E	89.5	Confident	86.5	Confident	121 Å²	121	129.4 Å²	129.4	57%	0.565	63%	0.63	S	S	*	*	H	α-helix	trans	-63	-39.4	171.4	-84.3	179.6	176.1	0	0	112.1	K5 K12 A13	K5-E9 PolarHBondContact O-N 3.5Å; E9-K12 PolarHBondContact O-N 2.8Å; E9-A13 WeakPolarHBondContact O-CB 3.45Å; E9-A13 PolarHBondContact O-N 3Å
10	R	89.6	Confident	86.7	Confident	205 Å²	205	129.2 Å²	129.2	77%	0.774	63%	0.628	S	S	*	*	H	α-helix	trans	-65.1	-41.1	176.7	-164.3	177.6	-178.5	-174.8	-0.2	112.2	A6 E7 L8 A13 K14	A6-R10 WeakPolarHBondContact O-CB 3.33Å; A6-R10 PolarHBondContact O-N 3.03Å; E7-R10 PolarHBondContact O-N 3.32Å; L8-R10 VanDerWaalsContact C-N 3.34Å; R10-A13 PolarHBondContact O-N 3Å; R10-K14 PolarHBondContact O-N 3Å
11	K	92.1	Very high	86.7	Confident	133 Å²	133	129.7 Å²	129.7	58%	0.578	63%	0.629	S	S	*	*	H	α-helix	trans	-65	-42.1	174.5	-74	-179.7	-175.5	166	0	111.5	E7 L8 A13 K14 L15	E7-K11 PolarHBondContact O-N 3.48Å; E7-K11 VanDerWaalsContact OE1-CE 3.28Å; E7-K11 WeakPolarHBondContact OE1-CE 3.4Å; E7-K11 IonicContact OE1-NZ 3.76Å; E7-K11 PolarHBondContact OE1-NZ 2.81Å; L8-K11 PolarHBondContact O-N 3.05Å; K11-A13 PolarHBondContact O-N 3.37Å; K11-K14 PolarHBondContact O-N 2.98Å; K11-L15 PolarHBondContact O-N 2.83Å
12	K	92.1	Very high	88	Confident	146 Å²	146	126.7 Å²	126.7	64%	0.635	61%	0.61	S	S	*	*	H	α-helix	trans	-64.3	-39.9	177.4	-165.1	176.6	-178.4	-179.9	0	112.3	L8 E9 L15 L16	L8-K12 WeakPolarHBondContact O-CB 3.41Å; L8-K12 PolarHBondContact O-N 3.2Å; E9-K12 PolarHBondContact O-N 2.8Å; K12-L15 PolarHBondContact O-N 2.83Å; K12-L16 PolarHBondContact O-N 2.85Å; K12-L16 VanDerWaalsContact O-N 3.1Å
13	A	90.4	Very high	88.4	Confident	61 Å²	61	128.5 Å²	128.5	50%	0.504	61%	0.606	S	S	.	*	H	α-helix	trans	-65.2	-41.7	175.1	0	0	0	0	0	112.3	E9 R10 K11 L15 L16 A17	E9-A13 WeakPolarHBondContact O-CB 3.45Å; E9-A13 PolarHBondContact O-N 3Å; R10-A13 PolarHBondContact O-N 3Å; K11-A13 PolarHBondContact O-N 3.37Å; A13-L15 VanDerWaalsContact C-N 3.34Å; A13-L15 PolarHBondContact O-N 2.96Å; A13-L16 PolarHBondContact O-N 3.12Å; A13-A17 PolarHBondContact O-N 2.95Å
14	K	91.1	Very high	88.5	Confident	158 Å²	158	128.9 Å²	128.9	69%	0.687	60%	0.602	S	S	*	*	H	α-helix	trans	-63.3	-39.9	177.1	-164.1	177.9	-177.9	-175.8	0	112	R10 K11 A17 M18	R10-K14 PolarHBondContact O-N 3Å; K11-K14 PolarHBondContact O-N 2.98Å; K14-A17 PolarHBondContact O-N 2.81Å; K14-M18 PolarHBondContact O-N 2.85Å; K14-M18 VanDerWaalsContact O-N 3.14Å
15	L	87.7	Confident	88.1	Confident	116 Å²	116	128 Å²	128	61%	0.607	60%	0.599	S	S	*	*	H	α-helix	trans	-69.4	-36.7	178.8	-153.5	116.4	0	0	0	112.3	K11 K12 A13 R19	K11-L15 PolarHBondContact O-N 2.83Å; K12-L15 PolarHBondContact O-N 2.83Å; A13-L15 VanDerWaalsContact C-N 3.34Å; A13-L15 PolarHBondContact O-N 2.96Å; L15-R19 PolarHBondContact O-N 3.36Å
16	L	90	Very high	87.5	Confident	99 Å²	99	126.5 Å²	126.5	52%	0.518	59%	0.593	S	S	.	*	H	α-helix	trans	-64.9	-44.3	173.7	-103.1	163.7	0	0	0	112	K12 A13 M18 R19 E20	K12-L16 PolarHBondContact O-N 2.85Å; K12-L16 VanDerWaalsContact O-N 3.1Å; A13-L16 PolarHBondContact O-N 3.12Å; L16-M18 VanDerWaalsContact C-N 3.34Å; L16-M18 PolarHBondContact O-N 3.45Å; L16-R19 WeakPolarHBondContact O-CB 3.47Å; L16-R19 PolarHBondContact O-N 3.25Å; L16-R19 VanDerWaalsContact O-N 3.15Å; L16-E20 PolarHBondContact O-N 3.19Å
17	A	89.9	Confident	86.8	Confident	55 Å²	55	128.6 Å²	128.6	46%	0.455	59%	0.594	S	S	.	*	H	α-helix	trans	-59.7	-43.8	177.3	0	0	0	0	0	112	A13 K14 R19 E20 E21	A13-A17 PolarHBondContact O-N 2.95Å; K14-A17 PolarHBondContact O-N 2.81Å; A17-R19 VanDerWaalsContact C-N 3.28Å; A17-R19 PolarHBondContact O-N 3.31Å; A17-E20 PolarHBondContact O-N 3.12Å; A17-E21 PolarHBondContact O-N 3.45Å
18	M	89.3	Confident	85.9	Confident	128 Å²	128	129.5 Å²	129.5	63%	0.631	60%	0.601	S	S	*	*	H	α-helix	trans	-64.3	-33.9	177.5	-153.4	-156.8	-68.7	0	0	112.1	K14 L16 K22	K14-M18 PolarHBondContact O-N 2.85Å; K14-M18 VanDerWaalsContact O-N 3.14Å; L16-M18 VanDerWaalsContact C-N 3.34Å; L16-M18 PolarHBondContact O-N 3.45Å; M18-K22 PolarHBondContact O-N 3.32Å; M18-K22 VanDerWaalsContact O-N 3.08Å
19	R	91	Very high	84.7	Confident	188 Å²	188	130.3 Å²	130.3	71%	0.709	60%	0.599	S	S	*	*	H	α-helix	trans	-70.4	-39.6	177.1	-129.5	177	-178.4	164.9	1.3	112.3	L15 L16 A17 K23	L15-R19 PolarHBondContact O-N 3.36Å; L16-R19 WeakPolarHBondContact O-CB 3.47Å; L16-R19 PolarHBondContact O-N 3.25Å; L16-R19 VanDerWaalsContact O-N 3.15Å; A17-R19 VanDerWaalsContact C-N 3.28Å; A17-R19 PolarHBondContact O-N 3.31Å; R19-K23 PolarHBondContact O-N 2.98Å; R19-K23 VanDerWaalsContact O-N 3.11Å
20	E	89.4	Confident	83.1	Confident	125 Å²	125	132.6 Å²	132.6	58%	0.584	61%	0.607	S	S	*	*	H	α-helix	trans	-68.4	-38.8	175.3	-73.1	-172.2	168.3	0	0	112.2	L16 A17 K23 K24	L16-E20 PolarHBondContact O-N 3.19Å; A17-E20 PolarHBondContact O-N 3.12Å; E20-K23 PolarHBondContact O-N 3.01Å; E20-K24 PolarHBondContact O-N 3.44Å
21	E	87.9	Confident	81.4	Confident	140 Å²	140	129.2 Å²	129.2	65%	0.654	60%	0.603	S	S	*	*	H	α-helix	trans	-65	-42.5	176.5	-168.1	174.4	-171.4	0	0	111.8	A17 K23 K24 R25	A17-E21 PolarHBondContact O-N 3.45Å; E21-K23 VanDerWaalsContact C-N 3.33Å; E21-K23 PolarHBondContact O-N 2.85Å; E21-K24 PolarHBondContact O-N 3.49Å; E21-R25 PolarHBondContact O-N 3.42Å
22	K	87.4	Confident	79.2	Confident	140 Å²	140	126.1 Å²	126.1	61%	0.609	61%	0.609	S	S	*	*	H	α-helix	trans	-60.5	-43.1	173.5	-169.8	175.1	179.6	177.2	0	111.7	M18 R25 E26	M18-K22 PolarHBondContact O-N 3.32Å; M18-K22 VanDerWaalsContact O-N 3.08Å; K22-R25 PolarHBondContact O-N 3.01Å; K22-E26 PolarHBondContact O-N 2.79Å
23	K	86.7	Confident	76.7	Confident	132 Å²	132	126.1 Å²	126.1	57%	0.574	61%	0.614	S	S	*	*	H	α-helix	trans	-64.8	-40.5	177.9	-167.1	-179.4	176.2	-173.4	0	112.3	R19 E20 E21 E26 E27	R19-K23 PolarHBondContact O-N 2.98Å; R19-K23 VanDerWaalsContact O-N 3.11Å; E20-K23 PolarHBondContact O-N 3.01Å; E21-K23 VanDerWaalsContact C-N 3.33Å; E21-K23 PolarHBondContact O-N 2.85Å; K23-E26 PolarHBondContact O-N 3.47Å; K23-E27 PolarHBondContact O-N 2.81Å
24	K	81.5	Confident	74.1	Confident	139 Å²	139	130.4 Å²	130.4	60%	0.604	62%	0.623	S	S	*	*	H	α-helix	trans	-62.8	-40.8	173.5	-78	-174.5	178	179.7	0	112.2	E20 E21 E26 E27 I28	E20-K24 PolarHBondContact O-N 3.44Å; E21-K24 PolarHBondContact O-N 3.49Å; K24-E26 VanDerWaalsContact C-N 3.29Å; K24-E26 PolarHBondContact O-N 2.75Å; K24-E27 PolarHBondContact O-N 2.93Å; K24-I28 VanDerWaalsContact O-CG1 3.29Å; K24-I28 WeakPolarHBondContact O-CG1 3.5Å; K24-I28 PolarHBondContact O-N 2.81Å
25	R	76.3	Confident	71.4	Confident	182 Å²	182	128.6 Å²	128.6	69%	0.687	62%	0.621	S	S	*	*	H	α-helix	trans	-64.6	-35.2	177.5	-161.4	174	-176	-146.8	1.9	112	E21 K22 K29	E21-R25 PolarHBondContact O-N 3.42Å; K22-R25 PolarHBondContact O-N 3.01Å; R25-K29 WeakPolarHBondContact O-CG 3.42Å; R25-K29 PolarHBondContact O-N 3.24Å
26	E	74.4	Confident	69	Low	108 Å²	108	129.9 Å²	129.9	51%	0.505	63%	0.633	S	S	.	*	H	α-helix	trans	-71.1	-37.7	173.3	-73.2	176.9	-173.9	0	0	112.9	K22 K23 K24 K29 K30	K22-E26 PolarHBondContact O-N 2.79Å; K23-E26 PolarHBondContact O-N 3.47Å; K24-E26 VanDerWaalsContact C-N 3.29Å; K24-E26 PolarHBondContact O-N 2.75Å; E26-K29 PolarHBondContact O-N 2.97Å; E26-K30 PolarHBondContact O-N 3.18Å
27	E	72.4	Confident	66.5	Low	102 Å²	102	132.6 Å²	132.6	48%	0.477	64%	0.643	S	S	.	*	H	α-helix	trans	-65.8	-40.8	174.4	-79.2	176.8	180	0	0	112.2	K23 K24 K29 K30 I31	K23-E27 PolarHBondContact O-N 2.81Å; K24-E27 PolarHBondContact O-N 2.93Å; E27-K29 VanDerWaalsContact C-N 3.32Å; E27-K29 PolarHBondContact O-N 2.76Å; E27-K30 PolarHBondContact O-N 2.77Å; E27-K30 VanDerWaalsContact O-N 3.14Å; E27-I31 WeakPolarHBondContact O-CG1 3.49Å; E27-I31 PolarHBondContact O-N 3.47Å; E27-I31 VanDerWaalsContact O-N 3.08Å
28	I	68.5	Low	64.1	Low	121 Å²	121	135.4 Å²	135.4	62%	0.621	66%	0.655	S	S	*	*	H	α-helix	trans	-62	-41.9	174.7	-65.1	162.3	0	0	0	110.6	K24 K30 I31 G32	K24-I28 VanDerWaalsContact O-CG1 3.29Å; K24-I28 WeakPolarHBondContact O-CG1 3.5Å; K24-I28 PolarHBondContact O-N 2.81Å; I28-K30 VanDerWaalsContact C-N 3.29Å; I28-K30 PolarHBondContact O-N 3.03Å; I28-I31 PolarHBondContact O-N 3.43Å; I28-G32 PolarHBondContact O-N 3.25Å
29	K	62.5	Low	62	Low	137 Å²	137	132.3 Å²	132.3	60%	0.596	65%	0.646	S	S	*	*	H	α-helix	trans	-62.4	-34.7	175	-79.4	-174.4	174.2	-169.9	0	112.5	R25 E26 E27 I33	R25-K29 WeakPolarHBondContact O-CG 3.42Å; R25-K29 PolarHBondContact O-N 3.24Å; E26-K29 PolarHBondContact O-N 2.97Å; E27-K29 VanDerWaalsContact C-N 3.32Å; E27-K29 PolarHBondContact O-N 2.76Å; K29-I33 WeakPolarHBondContact O-CD1 3.38Å; K29-I33 WeakPolarHBondContact O-CG1 3.48Å
30	K	55.4	Low	60.1	Low	170 Å²	170	128.6 Å²	128.6	74%	0.739	64%	0.64	S	S	*	*	H	α-helix	trans	-69.8	-35.2	176	-79.4	-175	176.5	-177.6	0	113	E26 E27 I28	E26-K30 PolarHBondContact O-N 3.18Å; E27-K30 PolarHBondContact O-N 2.77Å; E27-K30 VanDerWaalsContact O-N 3.14Å; I28-K30 VanDerWaalsContact C-N 3.29Å; I28-K30 PolarHBondContact O-N 3.03Å
31	I	54.4	Low	58.1	Low	134 Å²	134	128.3 Å²	128.3	69%	0.687	64%	0.641	S	S	*	*	H	α-helix	trans	-74.3	-33.2	178.9	-62.2	164.4	0	0	0	110.7	E27 I28 I33 H34	E27-I31 WeakPolarHBondContact O-CG1 3.49Å; E27-I31 PolarHBondContact O-N 3.47Å; E27-I31 VanDerWaalsContact O-N 3.08Å; I28-I31 PolarHBondContact O-N 3.43Å; I31-I33 PolarHBondContact O-N 2.7Å; I31-I33 VanDerWaalsContact O-N 3.11Å; I31-H34 PolarHBondContact O-N 3.07Å
32	G	45.8	Very low	56.6	Low	68 Å²	68	130.8 Å²	130.8	70%	0.701	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	2.3	178.9	0	0	0	0	0	116.4	I28	I28-G32 PolarHBondContact O-N 3.25Å
33	I	39.2	Very low	55.3	Low	146 Å²	146	130.1 Å²	130.1	75%	0.749	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	2	-178.1	-61.2	168	0	0	0	111.8	K29 I31	K29-I33 WeakPolarHBondContact O-CD1 3.38Å; K29-I33 WeakPolarHBondContact O-CG1 3.48Å; I31-I33 PolarHBondContact O-N 2.7Å; I31-I33 VanDerWaalsContact O-N 3.11Å
34	H	34.8	Very low	54.3	Low	150 Å²	150	127.2 Å²	127.2	69%	0.694	64%	0.637	S	S	*	*	S	Bend	trans	-91.1	115.9	177.3	-147.5	34.4	0	0	0	111.2	I31	I31-H34 PolarHBondContact O-N 3.07Å
35	D	36.1	Very low	53.4	Low	120 Å²	120	123.7 Å²	123.7	64%	0.642	63%	0.627	S	S	*	*			trans	74.3	74.9	162.1	-54.1	-19.8	0	0	0	117.9
36	V	36.5	Very low	52.8	Low	143 Å²	143	120.2 Å²	120.2	87%	0.867	62%	0.622	S	S	*	*			trans	-112.7	104.3	148.4	-177.6	0	0	0	0	107.2	V38	V36-V38 PolarHBondContact O-N 3.15Å
37	E	36.5	Very low	52.4	Low	156 Å²	156	121.9 Å²	121.9	73%	0.729	63%	0.63	S	S	*	*			trans	-62.9	127.5	-173.6	-65	178.9	148.8	0	0	111.7	S39	E37-S39 PolarHBondContact O-N 2.97Å
38	V	40.8	Very low	52	Low	115 Å²	115	122.2 Å²	122.2	70%	0.697	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	0.6	-174.6	176.4	0	0	0	0	113.5	V36	V36-V38 PolarHBondContact O-N 3.15Å
39	S	44.6	Very low	51.8	Low	62 Å²	62	120.7 Å²	120.7	43%	0.434	63%	0.627	S	S	.	*	H	α-helix	trans	-74.1	-25.2	-176.9	41.3	0	0	0	0	114.8	E37	E37-S39 PolarHBondContact O-N 2.97Å
40	D	51.6	Low	52	Low	110 Å²	110	122.1 Å²	122.1	59%	0.588	63%	0.633	S	S	*	*	H	α-helix	trans	-78.1	-26.2	-174.6	-77.6	-5.6	0	0	0	113.4	T44	D40-T44 WeakPolarHBondContact O-CG2 3.17Å; D40-T44 PolarHBondContact O-N 3.49Å; D40-T44 PolarHBondContact O-OG1 3.48Å
41	I	47.9	Very low	52.6	Low	120 Å²	120	121.1 Å²	121.1	62%	0.615	64%	0.636	S	S	*	*	H	α-helix	trans	-71.6	-35	-177.7	-71.6	169	0	0	0	111.9	T44 T45	I41-T44 WeakPolarHBondContact CA-OG1 3.3Å; I41-T44 PolarHBondContact O-OG1 3.48Å; I41-T45 WeakPolarHBondContact O-CG2 3.42Å; I41-T45 PolarHBondContact O-N 3.06Å; I41-T45 PolarHBondContact O-OG1 2.8Å
42	R	55.1	Low	52.9	Low	192 Å²	192	121 Å²	121	73%	0.725	64%	0.636	S	S	*	*	H	α-helix	trans	-73.3	-36.2	-179.9	-70.1	-173.5	177.7	-175.1	-0.5	112.6	T44 T45 D46	R42-T44 VanDerWaalsContact C-N 3.34Å; R42-T45 PolarHBondContact O-N 3.04Å; R42-T45 PolarHBondContact O-OG1 2.99Å; R42-D46 PolarHBondContact O-N 3.4Å
43	Q	60.1	Low	53.2	Low	126 Å²	126	120.9 Å²	120.9	59%	0.589	64%	0.635	S	S	*	*	H	α-helix	trans	-67.8	-38.6	177.6	-66.4	-177.9	16.6	0	0	111.1	T45 D46 E47	Q43-T45 PolarHBondContact O-N 3.21Å; Q43-D46 PolarHBondContact O-N 3.48Å; Q43-E47 WeakPolarHBondContact O-CG 3.49Å; Q43-E47 PolarHBondContact O-N 2.85Å; Q43-E47 VanDerWaalsContact O-N 3.11Å
44	T	65.4	Low	54.1	Low	70 Å²	70	119.3 Å²	119.3	43%	0.429	63%	0.628	S	S	.	*	H	α-helix	trans	-68.2	-33.3	178.3	47.8	0	0	0	0	113.2	D40 I41 R42 L48	D40-T44 WeakPolarHBondContact O-CG2 3.17Å; D40-T44 PolarHBondContact O-N 3.49Å; D40-T44 PolarHBondContact O-OG1 3.48Å; I41-T44 WeakPolarHBondContact CA-OG1 3.3Å; I41-T44 PolarHBondContact O-OG1 3.48Å; R42-T44 VanDerWaalsContact C-N 3.34Å; T44-L48 WeakPolarHBondContact O-CB 3.41Å; T44-L48 WeakPolarHBondContact O-CG 3.34Å; T44-L48 PolarHBondContact O-N 2.85Å; T44-L48 VanDerWaalsContact O-N 3.1Å
45	T	62.9	Low	54.8	Low	65 Å²	65	117.7 Å²	117.7	40%	0.399	63%	0.631	S	S	.	*	H	α-helix	trans	-70.6	-38.9	175.3	51.9	0	0	0	0	113	I41 R42 Q43 L48 L49	I41-T45 WeakPolarHBondContact O-CG2 3.42Å; I41-T45 PolarHBondContact O-N 3.06Å; I41-T45 PolarHBondContact O-OG1 2.8Å; R42-T45 PolarHBondContact O-N 3.04Å; R42-T45 PolarHBondContact O-OG1 2.99Å; Q43-T45 PolarHBondContact O-N 3.21Å; T45-L48 PolarHBondContact O-N 3.14Å; T45-L49 WeakPolarHBondContact O-CG 3.42Å; T45-L49 PolarHBondContact O-N 3.26Å
46	D	63.6	Low	55.6	Low	110 Å²	110	119.8 Å²	119.8	59%	0.588	64%	0.637	S	S	*	*	H	α-helix	trans	-70.6	-33.8	179.3	-72.8	-13.8	0	0	0	111.6	R42 Q43 K50	R42-D46 PolarHBondContact O-N 3.4Å; Q43-D46 PolarHBondContact O-N 3.48Å; D46-K50 PolarHBondContact O-N 2.94Å
47	E	66.5	Low	55.8	Low	143 Å²	143	118.5 Å²	118.5	67%	0.668	63%	0.631	S	S	*	*	H	α-helix	trans	-68.1	-40.7	172.1	-73.1	-170.2	168.4	0	0	112.5	Q43 K50 D51	Q43-E47 WeakPolarHBondContact O-CG 3.49Å; Q43-E47 PolarHBondContact O-N 2.85Å; Q43-E47 VanDerWaalsContact O-N 3.11Å; E47-K50 WeakPolarHBondContact O-CB 3.37Å; E47-K50 PolarHBondContact O-N 3.43Å; E47-D51 PolarHBondContact O-N 3.01Å; E47-D51 VanDerWaalsContact O-N 3.12Å
48	L	64.7	Low	55.8	Low	108 Å²	108	117.4 Å²	117.4	57%	0.565	64%	0.635	S	S	*	*	H	α-helix	trans	-65	-40.4	176.4	-81.8	166.2	0	0	0	112.5	T44 T45 K50 D51 L52	T44-L48 WeakPolarHBondContact O-CB 3.41Å; T44-L48 WeakPolarHBondContact O-CG 3.34Å; T44-L48 PolarHBondContact O-N 2.85Å; T44-L48 VanDerWaalsContact O-N 3.1Å; T45-L48 PolarHBondContact O-N 3.14Å; L48-K50 VanDerWaalsContact C-N 3.27Å; L48-K50 PolarHBondContact O-N 3Å; L48-D51 PolarHBondContact O-N 3Å; L48-L52 PolarHBondContact O-N 3.48Å
49	L	64.1	Low	55.6	Low	90 Å²	90	119 Å²	119	47%	0.471	64%	0.639	S	S	.	*	H	α-helix	trans	-64.6	-33.4	176.8	-75.7	165.3	0	0	0	112	T45 L54	T45-L49 WeakPolarHBondContact O-CG 3.42Å; T45-L49 PolarHBondContact O-N 3.26Å; L49-L54 HydrophobicContact CD2-CD1 4.06Å
50	K	65.3	Low	55	Low	166 Å²	166	121.9 Å²	121.9	72%	0.722	66%	0.656	S	S	*	*	H	α-helix	trans	-68.6	-40.2	173.9	-114.5	175.7	-177.2	166	0	113.1	D46 E47 L48 L52 G53	D46-K50 PolarHBondContact O-N 2.94Å; E47-K50 WeakPolarHBondContact O-CB 3.37Å; E47-K50 PolarHBondContact O-N 3.43Å; L48-K50 VanDerWaalsContact C-N 3.27Å; L48-K50 PolarHBondContact O-N 3Å; K50-L52 VanDerWaalsContact C-N 3.27Å; K50-L52 PolarHBondContact O-N 3.22Å; K50-G53 PolarHBondContact O-N 3.04Å
51	D	69.6	Low	54	Low	150 Å²	150	125.6 Å²	125.6	80%	0.802	67%	0.67	S	S	*	*	H	α-helix	trans	-70.1	-26.8	-179.4	-150.9	40.4	0	0	0	112.1	E47 L48 G53	E47-D51 PolarHBondContact O-N 3.01Å; E47-D51 VanDerWaalsContact O-N 3.12Å; L48-D51 PolarHBondContact O-N 3Å; D51-G53 VanDerWaalsContact C-N 3.25Å; D51-G53 PolarHBondContact O-N 3.44Å
52	L	59.5	Low	53.2	Low	130 Å²	130	124.5 Å²	124.5	68%	0.681	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	3.1	176.4	-83.3	154.7	0	0	0	114.6	L48 K50 L54	L48-L52 PolarHBondContact O-N 3.48Å; K50-L52 VanDerWaalsContact C-N 3.27Å; K50-L52 PolarHBondContact O-N 3.22Å; L52-L54 HydrophobicContact CB-CD1 4.45Å; L52-L54 PolarHBondContact O-N 3.34Å
53	G	52.1	Low	51.9	Low	67 Å²	67	120.2 Å²	120.2	69%	0.691	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.6	19.9	173.5	0	0	0	0	0	114.4	K50 D51	K50-G53 PolarHBondContact O-N 3.04Å; D51-G53 VanDerWaalsContact C-N 3.25Å; D51-G53 PolarHBondContact O-N 3.44Å
54	L	58.9	Low	50.3	Low	112 Å²	112	119.8 Å²	119.8	59%	0.586	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-79.2	128.2	177.3	-74	164.6	0	0	0	109.8	L49 L52	L49-L54 HydrophobicContact CD2-CD1 4.06Å; L52-L54 HydrophobicContact CB-CD1 4.45Å; L52-L54 PolarHBondContact O-N 3.34Å
55	P	48.1	Very low	48.6	Very low	117 Å²	117	124.1 Å²	124.1	76%	0.76	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-70.7	133.3	179.7	28.3	-31.2	0	0	0	110.3
56	E	53.8	Low	46.9	Very low	163 Å²	163	132.3 Å²	132.3	76%	0.762	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-60.4	138.2	175.3	-149.7	166.8	-161.6	0	0	110.1	V58	E56-V58 PolarHBondContact O-N 2.75Å; E56-V58 VanDerWaalsContact O-N 3.1Å
57	P	40.1	Very low	45.3	Very low	117 Å²	117	135.4 Å²	135.4	76%	0.76	74%	0.742	S	S	*	*			trans	-65.3	115.4	-174.6	24.8	-32.4	0	0	0	110.8	L59	P57-L59 PolarHBondContact O-N 2.83Å
58	V	37.3	Very low	43.6	Very low	133 Å²	133	135.9 Å²	135.9	81%	0.806	75%	0.749	S	S	*	*			trans	-64.8	102.7	177.6	-179.5	0	0	0	0	109.5	E56	E56-V58 PolarHBondContact O-N 2.75Å; E56-V58 VanDerWaalsContact O-N 3.1Å
59	L	37.3	Very low	41.7	Very low	147 Å²	147	139.7 Å²	139.7	77%	0.77	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-71.5	141.6	164.3	-84.9	146.9	0	0	0	109.8	P57 Q61	P57-L59 PolarHBondContact O-N 2.83Å; L59-Q61 PolarHBondContact O-N 2.79Å
60	P	32	Very low	40	Very low	123 Å²	123	140.9 Å²	140.9	80%	0.799	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-65.1	125.1	-169.5	-0.5	8.8	0	0	0	111.8	A62	P60-A62 PolarHBondContact O-N 2.7Å
61	Q	29.8	Very low	38.1	Very low	189 Å²	189	138.7 Å²	138.7	88%	0.883	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70.7	116.2	179	-70.8	179.7	-13.2	0	0	111.2	L59	L59-Q61 PolarHBondContact O-N 2.79Å
62	A	30.4	Very low	36.1	Very low	97 Å²	97	136.8 Å²	136.8	80%	0.802	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-79.9	144.5	159.2	0	0	0	0	0	110.2	P60	P60-A62 PolarHBondContact O-N 2.7Å
63	S	28.8	Very low	34.8	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-51.9	133.1	-171.2	49.3	0	0	0	0	117.3
64	S	25.7	Very low	33.6	Very low	118 Å²	118	142.8 Å²	142.8	83%	0.825	80%	0.796	S	S	*	*				49.7	90	128.2	-50	0	0	0	0	118.8
65	I	31.2	Very low	32.4	Very low	160 Å²	160	142.7 Å²	142.7	82%	0.821	80%	0.8	S	S	*	*			trans	-131.3	107.4	146.9	-59.4	177.7	0	0	0	107.6
66	R	26.1	Very low	31.6	Very low	238 Å²	238	143.6 Å²	143.6	90%	0.898	80%	0.803	S	S	*	*			trans	-80	128	162.9	-71.3	172.7	167.5	167.4	-4.3	106
67	E	29.6	Very low	30.4	Very low	174 Å²	174	143.5 Å²	143.5	81%	0.813	81%	0.808	S	S	*	*			trans	-167.7	129.9	151.6	-109.2	178.8	-173.3	0	0	112.7
68	L	31.6	Very low	30	Very low	153 Å²	153	141.2 Å²	141.2	80%	0.801	81%	0.806	S	S	*	*			trans	59.8	112.6	155.9	-69.6	113.4	0	0	0	122.4
69	E	24.3	Very low	29.7	Very low	189 Å²	189	142.5 Å²	142.5	88%	0.883	81%	0.807	S	S	*	*			trans	-63.4	139.1	154.1	-60.1	171.4	155.1	0	0	111.7
70	S	28.9	Very low	29.6	Very low	115 Å²	115	143.3 Å²	143.3	80%	0.804	81%	0.811	S	S	*	*			trans	-147.9	124.9	150.3	59.8	0	0	0	0	109.6
71	P	25.8	Very low	29.7	Very low	120 Å²	120	146 Å²	146	78%	0.779	81%	0.813	S	S	*	*			trans	-94.8	170.9	-177.5	37.8	-34	0	0	0	112.6
72	S	27	Very low	29.9	Very low	110 Å²	110	148.5 Å²	148.5	77%	0.769	81%	0.814	S	S	*	*			trans	84.3	115.2	166	76.4	0	0	0	0	117.1
73	I	32.2	Very low	30.2	Very low	152 Å²	152	151.1 Å²	151.1	78%	0.779	82%	0.815	S	S	*	*				-164.6	106.9	121.3	-87.2	146.1	0	0	0	106.3	T75	I73-T75 WeakPolarHBondContact CG2-OG1 3.24Å; I73-T75 PolarHBondContact O-N 3Å
74	D	27	Very low	30.7	Very low	170 Å²	170	151.2 Å²	151.2	91%	0.909	82%	0.815	S	S	*	*			trans	-66.2	121.2	167.7	-72.2	-42.8	0	0	0	108.7
75	T	33.3	Very low	31.5	Very low	111 Å²	111	155.2 Å²	155.2	68%	0.681	82%	0.818	S	S	*	*			trans	-137	100.8	168.4	-29.2	0	0	0	0	111.1	I73	I73-T75 WeakPolarHBondContact CG2-OG1 3.24Å; I73-T75 PolarHBondContact O-N 3Å
76	V	30.6	Very low	31.9	Very low	135 Å²	135	156.6 Å²	156.6	82%	0.818	82%	0.818	S	S	*	*			trans	42.2	115	141.8	-168.9	0	0	0	0	118.8	G78	V76-G78 PolarHBondContact O-N 2.92Å
77	D	29.5	Very low	32.6	Very low	162 Å²	162	156.7 Å²	156.7	87%	0.866	82%	0.818	S	S	*	*			trans	-42	113.7	164.5	-68.3	-54.3	0	0	0	114.6
78	G	32.3	Very low	33.6	Very low	69 Å²	69	158 Å²	158	71%	0.711	82%	0.821	S	S	*	*			trans	-106.2	109.3	164.8	0	0	0	0	0	110.4	V76 L80	V76-G78 PolarHBondContact O-N 2.92Å; G78-L80 PolarHBondContact O-N 2.87Å; G78-L80 VanDerWaalsContact O-N 3.08Å
79	I	31.3	Very low	34.1	Very low	160 Å²	160	158.4 Å²	158.4	82%	0.821	82%	0.824	S	S	*	*			trans	-56.2	104.1	178.7	-62.2	159.4	0	0	0	110.4
80	L	34.2	Very low	35	Very low	164 Å²	164	158 Å²	158	86%	0.859	83%	0.827	S	S	*	*			trans	-120.5	106.3	162.9	-79	169.7	0	0	0	108.8	G78 R82	G78-L80 PolarHBondContact O-N 2.87Å; G78-L80 VanDerWaalsContact O-N 3.08Å; L80-R82 PolarHBondContact O-N 3.12Å
81	Q	33.4	Very low	36.8	Very low	179 Å²	179	161.2 Å²	161.2	84%	0.836	83%	0.829	S	S	*	*			trans	-55	100	175.5	-77.8	170.1	-21.4	0	0	110.4	N83	Q81-N83 PolarHBondContact O-N 2.9Å; Q81-N83 VanDerWaalsContact O-N 3.1Å
82	R	35.4	Very low	38.4	Very low	241 Å²	241	163 Å²	163	91%	0.909	83%	0.831	S	S	*	*			trans	-69.7	102.2	164.1	-88.3	-178.4	174.9	175.2	-1	108.6	L80 S84	L80-R82 PolarHBondContact O-N 3.12Å; R82-S84 VanDerWaalsContact C-N 3.26Å; R82-S84 PolarHBondContact O-N 3.37Å
83	N	35.2	Very low	39.7	Very low	153 Å²	153	162.6 Å²	162.6	82%	0.818	83%	0.828	S	S	*	*			trans	-60.7	90.7	161.4	-84.9	-25.6	0	0	0	109	Q81 K85	Q81-N83 PolarHBondContact O-N 2.9Å; Q81-N83 VanDerWaalsContact O-N 3.1Å; N83-K85 PolarHBondContact O-N 2.92Å
84	S	40.6	Very low	41.1	Very low	102 Å²	102	161.9 Å²	161.9	71%	0.713	83%	0.826	S	S	*	*			trans	-64.4	99.4	170.6	66	0	0	0	0	108.6	R82 K86	R82-S84 VanDerWaalsContact C-N 3.26Å; R82-S84 PolarHBondContact O-N 3.37Å; S84-K86 VanDerWaalsContact C-N 3.34Å; S84-K86 PolarHBondContact O-N 3.33Å
85	K	41.3	Very low	42.5	Very low	203 Å²	203	160.2 Å²	160.2	88%	0.883	82%	0.821	S	S	*	*			trans	-60.1	100.9	165.1	-75	-178.4	178	175.7	0	106.5	N83 R87	N83-K85 PolarHBondContact O-N 2.92Å; K85-R87 PolarHBondContact O-N 3.34Å; K85-R87 VanDerWaalsContact O-N 3.15Å
86	K	39.5	Very low	43.9	Very low	188 Å²	188	163.7 Å²	163.7	82%	0.817	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-54	120.8	174.1	-71.9	-175.3	179.8	-179.6	0	108	S84 K88	S84-K86 VanDerWaalsContact C-N 3.34Å; S84-K86 PolarHBondContact O-N 3.33Å; K86-K88 PolarHBondContact O-N 3.48Å; K86-K88 VanDerWaalsContact O-N 3.16Å
87	R	40.7	Very low	45.3	Very low	241 Å²	241	166 Å²	166	91%	0.909	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-54.4	118.9	169.4	-75.3	179.7	161.6	-169.1	-6.2	107.8	K85 N89	K85-R87 PolarHBondContact O-N 3.34Å; K85-R87 VanDerWaalsContact O-N 3.15Å; R87-N89 PolarHBondContact O-N 2.97Å
88	K	51.9	Low	46.9	Very low	200 Å²	200	164.9 Å²	164.9	87%	0.87	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-69.9	116.3	175.7	-68	-177.4	177.8	-177.9	0	107.5	K86 L90	K86-K88 PolarHBondContact O-N 3.48Å; K86-K88 VanDerWaalsContact O-N 3.16Å; K88-L90 PolarHBondContact O-N 3.26Å
89	N	42.4	Very low	48.7	Very low	163 Å²	163	165.9 Å²	165.9	87%	0.872	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-69.5	122.8	169.6	-95.5	-4.3	0	0	0	108.3	R87	R87-N89 PolarHBondContact O-N 2.97Å
90	L	42	Very low	50.7	Low	180 Å²	180	165.2 Å²	165.2	94%	0.942	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-67.9	130.5	169.6	-73.6	147.9	0	0	0	108.4	K88	K88-L90 PolarHBondContact O-N 3.26Å
91	Q	66.4	Low	52.4	Low	183 Å²	183	162.2 Å²	162.2	86%	0.855	81%	0.81	S	S	*	*			trans	-119.1	143.3	173.6	-175.9	175.4	-3.5	0	0	108.1	S93	Q91-S93 PolarHBondContact O-N 2.76Å
92	I	59.4	Low	54.4	Low	158 Å²	158	159 Å²	159	81%	0.81	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-69.2	118.7	171.2	-61.7	165.1	0	0	0	106.7
93	S	55.9	Low	56.1	Low	100 Å²	100	153.3 Å²	153.3	70%	0.699	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-94.6	134	171.6	-168.1	0	0	0	0	108.4	Q91 V95	Q91-S93 PolarHBondContact O-N 2.76Å; S93-V95 PolarHBondContact O-N 3.23Å
94	D	61.8	Low	57.6	Low	138 Å²	138	154.7 Å²	154.7	74%	0.738	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-63.5	122.4	171.6	-72.9	-37.6	0	0	0	108.9
95	V	55.5	Low	58.8	Low	135 Å²	135	155.8 Å²	155.8	82%	0.818	80%	0.803	S	S	*	*			trans	-86	112.6	175.6	179.3	0	0	0	0	106.8	S93 E97	S93-V95 PolarHBondContact O-N 3.23Å; V95-E97 PolarHBondContact O-N 3.38Å; V95-E97 VanDerWaalsContact O-N 3.16Å
96	F	63.2	Low	60.1	Low	183 Å²	183	153.6 Å²	153.6	80%	0.803	80%	0.799	S	S	*	*			trans	-73	105.5	171.4	-74.4	-84.2	0	0	0	108.8	I98	F96-I98 PolarHBondContact O-N 3.24Å
97	E	58.7	Low	61.4	Low	184 Å²	184	151.7 Å²	151.7	86%	0.86	80%	0.796	S	S	*	*			trans	-75.6	107	170.1	-170.5	176.7	-174.9	0	0	108.6	V95	V95-E97 PolarHBondContact O-N 3.38Å; V95-E97 VanDerWaalsContact O-N 3.16Å
98	I	64.2	Low	62.6	Low	139 Å²	139	149.2 Å²	149.2	71%	0.713	79%	0.789	S	S	*	*			trans	-98.8	105.8	171.9	-64.8	169.9	0	0	0	107.2	F96 I100	F96-I98 PolarHBondContact O-N 3.24Å; I98-I100 HydrophobicContact CG2-CG1 4.04Å; I98-I100 PolarHBondContact O-N 2.86Å
99	A	70.5	Confident	63.3	Low	89 Å²	89	144 Å²	144	74%	0.736	78%	0.777	S	S	*	*			trans	-83.6	107.4	167.1	0	0	0	0	0	108.6	P101	A99-P101 VanDerWaalsContact O-CD 3.28Å; A99-P101 WeakPolarHBondContact O-CD 3.41Å
100	I	72.8	Confident	64.1	Low	147 Å²	147	144.1 Å²	144.1	75%	0.754	77%	0.77	S	S	*	*			trans	-80.1	113.2	171.9	-56.9	174.6	0	0	0	107.3	I98	I98-I100 HydrophobicContact CG2-CG1 4.04Å; I98-I100 PolarHBondContact O-N 2.86Å
101	P	70.5	Confident	64.7	Low	100 Å²	100	144 Å²	144	65%	0.649	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-65	143.8	175.8	26.8	-32.4	0	0	0	109.9	A99	A99-P101 VanDerWaalsContact O-CD 3.28Å; A99-P101 WeakPolarHBondContact O-CD 3.41Å
102	P	74.1	Confident	63.9	Low	112 Å²	112	140.8 Å²	140.8	73%	0.727	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-58.8	143.2	176.4	24.9	-32.9	0	0	0	110.1	E104	P102-E104 PolarHBondContact O-N 3.47Å
103	P	72.2	Confident	62.9	Low	122 Å²	122	142.3 Å²	142.3	79%	0.792	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-59.7	124.3	178.6	23.7	-32.2	0	0	0	109.8	T105	P103-T105 PolarHBondContact O-N 3.2Å
104	E	66.1	Low	62.5	Low	181 Å²	181	143.2 Å²	143.2	85%	0.846	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-62.3	118.9	172.2	-72.2	-175	167.1	0	0	108.8	P102 I106	P102-E104 PolarHBondContact O-N 3.47Å; E104-I106 PolarHBondContact O-N 3.11Å
105	T	65.2	Low	61.6	Low	125 Å²	125	144 Å²	144	77%	0.767	77%	0.766	S	S	*	*			trans	-73.6	96.9	173.5	18.9	0	0	0	0	108	P103 I107	P103-T105 PolarHBondContact O-N 3.2Å; T105-I107 PolarHBondContact O-N 3.28Å
106	I	69.6	Low	60.9	Low	158 Å²	158	146.9 Å²	146.9	81%	0.81	77%	0.771	S	S	*	*			trans	-71.5	96.7	173.5	-56.3	172.6	0	0	0	107.6	E104 Y108	E104-I106 PolarHBondContact O-N 3.11Å; I106-Y108 PolarHBondContact O-N 3.16Å
107	I	67.3	Low	59.4	Low	147 Å²	147	147 Å²	147	75%	0.754	77%	0.774	S	S	*	*			trans	-81.7	109	172.6	-57.2	171.1	0	0	0	107.2	T105 S109	T105-I107 PolarHBondContact O-N 3.28Å; I107-S109 PolarHBondContact O-N 2.99Å
108	Y	65.6	Low	58.6	Low	190 Å²	190	143.2 Å²	143.2	75%	0.745	77%	0.765	S	S	*	*			trans	-86.3	102.6	169.2	-167.8	-100.2	0	0	0	108.9	I106 K110	I106-Y108 PolarHBondContact O-N 3.16Å; Y108-K110 HydrophobicContact CD1-CB 4.16Å; Y108-K110 HydrophobicContact CD1-CG 4.48Å; Y108-K110 HydrophobicContact CE1-CB 3.93Å; Y108-K110 HydrophobicContact CE1-CD 4.18Å; Y108-K110 HydrophobicContact CE1-CG 3.78Å; Y108-K110 PolarHBondContact O-N 2.8Å
109	S	66.5	Low	57.3	Low	90 Å²	90	145.2 Å²	145.2	63%	0.629	77%	0.772	S	S	*	*			trans	-79.9	115	165.5	50.3	0	0	0	0	108.7	I107	I107-S109 PolarHBondContact O-N 2.99Å
110	K	59.5	Low	55.5	Low	166 Å²	166	150.2 Å²	150.2	72%	0.722	78%	0.779	S	S	*	*			trans	-93.9	101.5	171.7	-150.3	177.9	-165.5	-169.5	0	108	Y108 T112	Y108-K110 HydrophobicContact CD1-CB 4.16Å; Y108-K110 HydrophobicContact CD1-CG 4.48Å; Y108-K110 HydrophobicContact CE1-CB 3.93Å; Y108-K110 HydrophobicContact CE1-CD 4.18Å; Y108-K110 HydrophobicContact CE1-CG 3.78Å; Y108-K110 PolarHBondContact O-N 2.8Å; K110-T112 PolarHBondContact O-N 3.42Å
111	E	53.4	Low	53.6	Low	178 Å²	178	153.3 Å²	153.3	83%	0.832	78%	0.782	S	S	*	*			trans	-75.7	113.9	172.5	-67.7	179.6	-177.4	0	0	108.8	Q113	E111-Q113 PolarHBondContact O-N 3.42Å
112	T	49.9	Very low	51.8	Low	115 Å²	115	157.7 Å²	157.7	71%	0.706	79%	0.793	S	S	*	*			trans	-80.3	112.5	171.5	-50.7	0	0	0	0	107.9	K110 T114	K110-T112 PolarHBondContact O-N 3.42Å; T112-T114 VanDerWaalsContact C-N 3.33Å; T112-T114 HydrophobicContact CG2-CG2 4.05Å; T112-T114 PolarHBondContact O-N 2.81Å
113	Q	37.6	Very low	49.7	Very low	189 Å²	189	159.1 Å²	159.1	88%	0.883	79%	0.794	S	S	*	*			trans	-74.6	84.8	175.2	-164.1	175.6	46.3	0	0	109.2	E111	E111-Q113 PolarHBondContact O-N 3.42Å
114	T	47.6	Very low	47.7	Very low	120 Å²	120	161 Å²	161	74%	0.736	80%	0.796	S	S	*	*			trans	-95.2	116.6	168.2	47	0	0	0	0	109.5	T112	T112-T114 VanDerWaalsContact C-N 3.33Å; T112-T114 HydrophobicContact CG2-CG2 4.05Å; T112-T114 PolarHBondContact O-N 2.81Å
115	L	43	Very low	46.1	Very low	155 Å²	155	158.3 Å²	158.3	81%	0.812	79%	0.792	S	S	*	*			trans	-66.2	146.9	167.1	-69.3	159.4	0	0	0	109.8
116	E	40.9	Very low	44.5	Very low	194 Å²	194	162.9 Å²	162.9	91%	0.907	80%	0.797	S	S	*	*			trans	93.6	93.9	164.9	-55.8	-177.6	171.9	0	0	117.9
117	E	33.2	Very low	42.8	Very low	186 Å²	186	163.3 Å²	163.3	87%	0.869	80%	0.801	S	S	*	*			trans	-66	172.7	146.1	-74.4	-177.2	158.6	0	0	111.3
118	P	41	Very low	41.4	Very low	105 Å²	105	164.8 Å²	164.8	68%	0.682	81%	0.805	S	S	*	*			cis	-132.3	163.1	-28.9	33.1	-16.3	0	0	0	112
119	Q	38	Very low	39.8	Very low	181 Å²	181	158.5 Å²	158.5	85%	0.846	80%	0.798	S	S	*	*			trans	-147.7	103.3	140.8	-81.2	-159.4	-32.1	0	0	108.7	R121	Q119-R121 PolarHBondContact O-N 3Å; Q119-R121 VanDerWaalsContact O-N 3.11Å
120	E	31.4	Very low	38.5	Very low	193 Å²	193	161.4 Å²	161.4	90%	0.902	81%	0.807	S	S	*	*			trans	-52.9	111.1	168.9	-67	173.2	153.7	0	0	109.2
121	R	33.8	Very low	37.4	Very low	212 Å²	212	164.1 Å²	164.1	80%	0.8	81%	0.812	S	S	*	*			trans	-108.8	114.1	160.8	-81.8	-174.2	175	-177.4	-0.3	107.5	Q119 I123	Q119-R121 PolarHBondContact O-N 3Å; Q119-R121 VanDerWaalsContact O-N 3.11Å; R121-I123 PolarHBondContact O-N 2.93Å
122	E	31.5	Very low	37	Very low	192 Å²	192	162.2 Å²	162.2	90%	0.897	81%	0.808	S	S	*	*			trans	-52.6	93.9	172.3	-62.8	172	158.5	0	0	110
123	I	31.7	Very low	36.8	Very low	143 Å²	143	165.9 Å²	165.9	73%	0.733	82%	0.817	S	S	*	*			trans	-95.3	101.9	167	-61.8	175.1	0	0	0	106.3	R121 T125	R121-I123 PolarHBondContact O-N 2.93Å; I123-T125 PolarHBondContact O-N 3.22Å
124	L	29.2	Very low	37.4	Very low	161 Å²	161	162.8 Å²	162.8	84%	0.843	81%	0.811	S	S	*	*			trans	-56.9	97.8	171.7	-67.6	158.8	0	0	0	109.6
125	T	31.9	Very low	37.7	Very low	125 Å²	125	161.6 Å²	161.6	77%	0.767	80%	0.8	S	S	*	*			trans	-91.8	126.7	166	49.9	0	0	0	0	109.4	I123	I123-T125 PolarHBondContact O-N 3.22Å
126	Y	31.9	Very low	38.3	Very low	221 Å²	221	157.3 Å²	157.3	87%	0.867	79%	0.787	S	S	*	*			trans	-53.9	141.2	-175.6	-68	-97.1	0	0	0	113.3	E128	Y126-E128 PolarHBondContact O-N 3.45Å
127	D	34.7	Very low	39	Very low	166 Å²	166	153.7 Å²	153.7	89%	0.888	77%	0.774	S	S	*	*			trans	-46.9	99.8	168.5	-91.2	-35.9	0	0	0	111.4	G129	D127-G129 PolarHBondContact O-N 2.88Å
128	E	36.8	Very low	40.5	Very low	178 Å²	178	147.5 Å²	147.5	83%	0.832	75%	0.754	S	S	*	*			trans	-75.9	76.2	152.8	-77.4	-152.4	151.7	0	0	108.1	Y126 N130	Y126-E128 PolarHBondContact O-N 3.45Å; E128-N130 PolarHBondContact O-N 3.32Å
129	G	32.8	Very low	41.3	Very low	59 Å²	59	144.8 Å²	144.8	61%	0.608	74%	0.74	S	S	*	*			trans	-65.4	125.7	169.4	0	0	0	0	0	110.9	D127 R131	D127-G129 PolarHBondContact O-N 2.88Å; G129-R131 PolarHBondContact O-N 2.84Å
130	N	38.2	Very low	42.2	Very low	151 Å²	151	141.2 Å²	141.2	81%	0.807	73%	0.727	S	S	*	*			trans	48.8	64.7	157.6	-67.5	1.3	0	0	0	116	E128 D132	E128-N130 PolarHBondContact O-N 3.32Å; N130-D132 PolarHBondContact O-N 3.09Å
131	R	36.6	Very low	43.7	Very low	223 Å²	223	134.6 Å²	134.6	84%	0.842	71%	0.705	S	S	*	*			trans	-81.4	105	140	-95.6	180	169.3	165.9	-2.1	106.7	G129 E133	G129-R131 PolarHBondContact O-N 2.84Å; R131-E133 PolarHBondContact O-N 2.75Å
132	D	44.9	Very low	45	Very low	138 Å²	138	130 Å²	130	74%	0.738	69%	0.693	S	S	*	*			trans	-39.3	111.6	165.9	-65.6	-44.9	0	0	0	107.7	N130 V134	N130-D132 PolarHBondContact O-N 3.09Å; D132-V134 PolarHBondContact O-N 2.94Å
133	E	46.4	Very low	46	Very low	192 Å²	192	126.5 Å²	126.5	90%	0.897	68%	0.679	S	S	*	*			trans	-56.4	98.4	170.2	-73.7	-175.5	161	0	0	105.6	R131 D135	R131-E133 PolarHBondContact O-N 2.75Å; E133-D135 PolarHBondContact O-N 3.29Å
134	V	50.2	Low	47	Very low	124 Å²	124	126.8 Å²	126.8	75%	0.752	68%	0.677	S	S	*	*			trans	-63.2	99.8	172.7	178.4	0	0	0	0	104.3	D132 A136	D132-V134 PolarHBondContact O-N 2.94Å; V134-A136 PolarHBondContact O-N 3.48Å
135	D	53.8	Low	48.3	Very low	95 Å²	95	127 Å²	127	51%	0.508	67%	0.671	S	S	.	*			trans	-51.4	102.1	-176	-164	-11.1	0	0	0	107.5	E133 N137 A138 A139	E133-D135 PolarHBondContact O-N 3.29Å; D135-N137 PolarHBondContact O-N 3.29Å; D135-N137 WeakPolarHBondContact OD1-CB 3.26Å; D135-N137 PolarHBondContact OD1-ND2 3.19Å; D135-A138 HydrophobicContact CB-CB 4.14Å; D135-A138 WeakPolarHBondContact O-CA 3.24Å; D135-A138 WeakPolarHBondContact O-CB 3.45Å; D135-A138 PolarHBondContact O-N 3.34Å; D135-A139 PolarHBondContact O-N 2.98Å
136	A	55.1	Low	48.9	Very low	65 Å²	65	126.9 Å²	126.9	54%	0.537	66%	0.664	S	S	.	*	H	α-helix	trans	-56.5	-25	-174.9	0	0	0	0	0	110.5	V134 L140	V134-A136 PolarHBondContact O-N 3.48Å; A136-L140 WeakPolarHBondContact O-CB 3.03Å; A136-L140 WeakPolarHBondContact O-CG 3.36Å; A136-L140 PolarHBondContact O-N 3.45Å
137	N	56.3	Low	49.2	Very low	118 Å²	118	121 Å²	121	63%	0.631	65%	0.653	S	S	*	*	H	α-helix	trans	-68.6	-36.4	174.3	-58.1	-41.3	0	0	0	112.9	D135 A141	D135-N137 PolarHBondContact O-N 3.29Å; D135-N137 WeakPolarHBondContact OD1-CB 3.26Å; D135-N137 PolarHBondContact OD1-ND2 3.19Å; N137-A141 WeakPolarHBondContact O-CB 3.47Å; N137-A141 PolarHBondContact O-N 2.98Å
138	A	65.5	Low	49.4	Very low	55 Å²	55	121.4 Å²	121.4	46%	0.455	65%	0.649	S	S	.	*	H	α-helix	trans	-70.6	-39.4	175.5	0	0	0	0	0	111.5	D135 A141 E142	D135-A138 HydrophobicContact CB-CB 4.14Å; D135-A138 WeakPolarHBondContact O-CA 3.24Å; D135-A138 WeakPolarHBondContact O-CB 3.45Å; D135-A138 PolarHBondContact O-N 3.34Å; A138-A141 PolarHBondContact O-N 3.03Å; A138-E142 PolarHBondContact O-N 3.21Å
139	A	56.7	Low	49.4	Very low	48 Å²	48	119.5 Å²	119.5	40%	0.397	64%	0.643	S	S	.	*	H	α-helix	trans	-64.5	-40.1	174.7	0	0	0	0	0	111.9	D135 E142 L143	D135-A139 PolarHBondContact O-N 2.98Å; A139-E142 PolarHBondContact O-N 3.37Å; A139-L143 PolarHBondContact O-N 3.5Å; A139-L143 VanDerWaalsContact O-N 3.13Å
140	L	56.1	Low	49.5	Very low	107 Å²	107	120.4 Å²	120.4	56%	0.56	65%	0.652	S	S	*	*	H	α-helix	trans	-64.2	-38.6	173.1	-86.2	158.7	0	0	0	112.5	A136 L143 E144	A136-L140 WeakPolarHBondContact O-CB 3.03Å; A136-L140 WeakPolarHBondContact O-CG 3.36Å; A136-L140 PolarHBondContact O-N 3.45Å; L140-L143 PolarHBondContact O-N 3.19Å; L140-E144 PolarHBondContact O-N 3.35Å
141	A	63.5	Low	49.4	Very low	53 Å²	53	118.8 Å²	118.8	44%	0.438	65%	0.647	S	S	.	*	H	α-helix	trans	-69	-33.6	177.9	0	0	0	0	0	113.4	N137 A138 K145	N137-A141 WeakPolarHBondContact O-CB 3.47Å; N137-A141 PolarHBondContact O-N 2.98Å; A138-A141 PolarHBondContact O-N 3.03Å; A141-K145 PolarHBondContact O-N 3.41Å
142	E	62.1	Low	49.1	Very low	117 Å²	117	114.2 Å²	114.2	55%	0.547	64%	0.644	S	S	.	*	H	α-helix	trans	-68.2	-38.6	171.6	-89.9	-76.4	133.3	0	0	111.7	A138 A139 E144 K145	A138-E142 PolarHBondContact O-N 3.21Å; A139-E142 PolarHBondContact O-N 3.37Å; E142-E144 PolarHBondContact O-N 2.76Å; E142-K145 PolarHBondContact O-N 2.85Å
143	L	51.6	Low	48.5	Very low	118 Å²	118	115.6 Å²	115.6	62%	0.618	64%	0.644	S	S	*	*	H	α-helix	trans	-64.4	-37	174.6	-93.5	150.9	0	0	0	112.7	A139 L140 K145 M146	A139-L143 PolarHBondContact O-N 3.5Å; A139-L143 VanDerWaalsContact O-N 3.13Å; L140-L143 PolarHBondContact O-N 3.19Å; L143-K145 VanDerWaalsContact C-N 3.29Å; L143-K145 PolarHBondContact O-N 2.86Å; L143-M146 PolarHBondContact O-N 2.87Å
144	E	52.4	Low	47.8	Very low	148 Å²	148	113.7 Å²	113.7	69%	0.692	65%	0.646	S	S	*	*	H	α-helix	trans	-70.9	-21.2	175	-75.7	-168.3	159.2	0	0	113.4	L140 E142 M146 K153	L140-E144 PolarHBondContact O-N 3.35Å; E142-E144 PolarHBondContact O-N 2.76Å; E144-M146 VanDerWaalsContact C-N 3.32Å; E144-K153 IonicContact OE1-NZ 3.77Å
145	K	56.6	Low	46.9	Very low	165 Å²	165	111 Å²	111	72%	0.717	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-13.1	175.5	-87.9	179.7	-179.5	171.4	0	113.8	A141 E142 L143 P147	A141-K145 PolarHBondContact O-N 3.41Å; E142-K145 PolarHBondContact O-N 2.85Å; L143-K145 VanDerWaalsContact C-N 3.29Å; L143-K145 PolarHBondContact O-N 2.86Å; K145-P147 WeakPolarHBondContact O-CD 3.26Å
146	M	43.8	Very low	45.8	Very low	123 Å²	123	115.7 Å²	115.7	61%	0.606	66%	0.662	S	S	*	*	S	Bend	trans	-78.2	116.3	175.7	-68.7	-165.3	174	0	0	109.7	L143 E144 H148	L143-M146 PolarHBondContact O-N 2.87Å; E144-M146 VanDerWaalsContact C-N 3.32Å; M146-H148 PolarHBondContact O-N 3.46Å
147	P	38.6	Very low	44.7	Very low	98 Å²	98	117.8 Å²	117.8	64%	0.636	67%	0.672	S	S	*	*	S	Bend	trans	-67.8	137.7	171.4	31.1	-30.8	0	0	0	107.2	K145	K145-P147 WeakPolarHBondContact O-CD 3.26Å
148	H	39	Very low	43.5	Very low	174 Å²	174	124.6 Å²	124.6	81%	0.806	69%	0.689	S	S	*	*			trans	84	56.6	174.4	-36.7	-66.2	0	0	0	117.2	M146	M146-H148 PolarHBondContact O-N 3.46Å
149	I	37.1	Very low	41.7	Very low	139 Å²	139	124.5 Å²	124.5	71%	0.713	69%	0.694	S	S	*	*			trans	-137.4	103.1	138.3	-90.5	126.7	0	0	0	106	V151	I149-V151 HydrophobicContact CG2-CG2 3.52Å; I149-V151 PolarHBondContact O-N 2.74Å
150	G	34.8	Very low	40.6	Very low	78 Å²	78	130.1 Å²	130.1	80%	0.804	72%	0.715	S	S	*	*			trans	-69.7	74.4	176.3	0	0	0	0	0	110.5	T152	G150-T152 PolarHBondContact O-N 3.34Å
151	V	35.7	Very low	39.3	Very low	116 Å²	116	133.2 Å²	133.2	70%	0.703	73%	0.731	S	S	*	*			trans	-85.7	77.1	159.3	-179	0	0	0	0	105.5	I149 K153	I149-V151 HydrophobicContact CG2-CG2 3.52Å; I149-V151 PolarHBondContact O-N 2.74Å; V151-K153 PolarHBondContact O-N 3.3Å
152	T	30.8	Very low	37.8	Very low	127 Å²	127	138.2 Å²	138.2	78%	0.779	75%	0.751	S	S	*	*			trans	-63.7	107.9	163.7	47	0	0	0	0	106.8	G150 T154	G150-T152 PolarHBondContact O-N 3.34Å; T152-T154 PolarHBondContact O-N 3.32Å
153	K	33	Very low	36.4	Very low	167 Å²	167	142.2 Å²	142.2	73%	0.726	77%	0.767	S	S	*	*			trans	-38.5	118.9	174.3	-72	175.3	175.8	169.6	0	110.4	E144 V151 G155	E144-K153 IonicContact OE1-NZ 3.77Å; V151-K153 PolarHBondContact O-N 3.3Å; K153-G155 PolarHBondContact O-N 2.84Å
154	T	31.5	Very low	35.5	Very low	153 Å²	153	144.6 Å²	144.6	94%	0.939	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	83.4	164.4	42.2	0	0	0	0	109	T152	T152-T154 PolarHBondContact O-N 3.32Å
155	G	30.2	Very low	34.5	Very low	67 Å²	67	146 Å²	146	69%	0.691	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.8	-12.6	179.5	0	0	0	0	0	116.2	K153	K153-G155 PolarHBondContact O-N 2.84Å
156	Q	31.9	Very low	33.1	Very low	193 Å²	193	141.3 Å²	141.3	90%	0.902	79%	0.79	S	S	*	*	S	Bend	trans	-139.6	69.2	-174.9	-68.9	-174.1	-10.6	0	0	112.8
157	S	31	Very low	32.5	Very low	109 Å²	109	143.9 Å²	143.9	76%	0.762	80%	0.804	S	S	*	*			trans	-156	48.5	148.5	57.2	0	0	0	0	111.2	G159	S157-G159 PolarHBondContact O-N 3.39Å
158	R	30.8	Very low	32.1	Very low	262 Å²	262	150.1 Å²	150.1	99%	0.989	82%	0.815	S	S	*	*	S	Bend	trans	-67.2	91.7	145.9	-88.1	-178.7	149	161.4	-4.4	107.2
159	G	29.3	Very low	31.5	Very low	53 Å²	53	148.4 Å²	148.4	55%	0.546	82%	0.817	S	S	.	*	S	Bend	trans	131.9	86.8	173.6	0	0	0	0	0	111.9	S157	S157-G159 PolarHBondContact O-N 3.39Å
160	I	32.5	Very low	31.3	Very low	166 Å²	166	146.6 Å²	146.6	85%	0.851	82%	0.817	S	S	*	*	S	Bend	trans	-174.6	-8.1	143.8	-88	149.2	0	0	0	110	D162	I160-D162 VanDerWaalsContact C-N 3.33Å; I160-D162 PolarHBondContact O-N 2.86Å
161	L	29.2	Very low	31.1	Very low	171 Å²	171	149.4 Å²	149.4	90%	0.895	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-3.6	172.2	-153.8	70.3	0	0	0	114.9
162	D	32.5	Very low	31	Very low	159 Å²	159	151.5 Å²	151.5	85%	0.85	83%	0.826	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	22.4	-173.4	-96.1	0.4	0	0	0	115.4	I160	I160-D162 VanDerWaalsContact C-N 3.33Å; I160-D162 PolarHBondContact O-N 2.86Å
163	K	32.5	Very low	30.9	Very low	201 Å²	201	148.8 Å²	148.8	87%	0.874	82%	0.823	S	S	*	*	S	Bend	trans	-138.3	39.9	177	-79.4	-165.4	177	-178.8	0	115.8
164	L	31.5	Very low	30.9	Very low	168 Å²	168	147.1 Å²	147.1	88%	0.88	83%	0.826	S	S	*	*	S	Bend	trans	-113.7	-7.9	165.5	-110.2	141.2	0	0	0	115.1
165	D	31.3	Very low	30.9	Very low	177 Å²	177	146.9 Å²	146.9	95%	0.947	82%	0.82	S	S	*	*	S	Bend	trans	-95.7	95.6	168.9	-93.7	-16	0	0	0	110.9
166	G	29.2	Very low	30.9	Very low	67 Å²	67	152.6 Å²	152.6	69%	0.691	83%	0.828	S	S	*	*			trans	150.4	41.4	164.5	0	0	0	0	0	118.5
167	I	30.1	Very low	31	Very low	176 Å²	176	150.7 Å²	150.7	90%	0.903	82%	0.824	S	S	*	*			trans	-110.1	78.7	154.9	-56.5	178.3	0	0	0	107.5	T169	I167-T169 PolarHBondContact O-N 3.46Å
168	R	29.6	Very low	31.3	Very low	229 Å²	229	151 Å²	151	86%	0.864	82%	0.822	S	S	*	*			trans	-71	115.5	159.2	-76.5	-179.2	173.9	176.5	-1.4	107.7	S170	R168-S170 PolarHBondContact O-N 2.87Å
169	T	27.8	Very low	31.7	Very low	138 Å²	138	143.5 Å²	143.5	85%	0.847	81%	0.809	S	S	*	*			trans	23.1	85.6	139.2	62.6	0	0	0	0	116.1	I167	I167-T169 PolarHBondContact O-N 3.46Å
170	S	32.6	Very low	32.2	Very low	102 Å²	102	147.4 Å²	147.4	71%	0.713	82%	0.818	S	S	*	*			trans	-133	103.5	152.1	57.5	0	0	0	0	108	R168 D172	R168-S170 PolarHBondContact O-N 2.87Å; S170-D172 PolarHBondContact O-N 2.89Å; S170-D172 VanDerWaalsContact O-N 3.12Å
171	T	29.5	Very low	32.7	Very low	136 Å²	136	146.3 Å²	146.3	83%	0.834	81%	0.813	S	S	*	*			trans	-50.5	104.9	159.8	45.2	0	0	0	0	109.1
172	D	34.2	Very low	33.6	Very low	161 Å²	161	144.5 Å²	144.5	86%	0.861	81%	0.81	S	S	*	*			trans	-148.2	123.4	150.1	-91.4	-31.4	0	0	0	106.5	S170	S170-D172 PolarHBondContact O-N 2.89Å; S170-D172 VanDerWaalsContact O-N 3.12Å
173	G	29	Very low	34.2	Very low	70 Å²	70	145.1 Å²	145.1	72%	0.722	81%	0.807	S	S	*	*			trans	-74.2	178.7	-172	0	0	0	0	0	113.5
174	V	31.8	Very low	34.9	Very low	131 Å²	131	146.2 Å²	146.2	79%	0.794	81%	0.806	S	S	*	*			trans	84.1	87.8	162.9	-165.8	0	0	0	0	113.5
175	D	32.6	Very low	35.7	Very low	149 Å²	149	145.4 Å²	145.4	80%	0.797	80%	0.803	S	S	*	*				-177.6	93.1	112.4	-87.3	-28.2	0	0	0	109.8	N177	D175-N177 PolarHBondContact O-N 2.95Å
176	E	30.7	Very low	37	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	79%	0.794	S	S	*	*			trans	-64.2	109.9	159.1	-67.3	-178.1	154.6	0	0	107.5
177	N	33.6	Very low	38.5	Very low	154 Å²	154	148 Å²	148	82%	0.824	80%	0.799	S	S	*	*			trans	163.8	42.5	147.3	-83.2	-18.4	0	0	0	115	D175	D175-N177 PolarHBondContact O-N 2.95Å
178	T	36.7	Very low	40.2	Very low	115 Å²	115	147.1 Å²	147.1	71%	0.706	79%	0.794	S	S	*	*			trans	-131.2	68.8	159.9	47.5	0	0	0	0	110.6	N180	T178-N180 PolarHBondContact O-N 2.89Å
179	S	39.1	Very low	42.1	Very low	104 Å²	104	144.9 Å²	144.9	73%	0.727	79%	0.794	S	S	*	*			trans	-64.7	81.1	155.2	52.9	0	0	0	0	107.8	D181	S179-D181 VanDerWaalsContact C-N 3.27Å; S179-D181 PolarHBondContact O-N 2.83Å
180	N	40.3	Very low	44.1	Very low	136 Å²	136	142.4 Å²	142.4	73%	0.727	77%	0.774	S	S	*	*			trans	-69.2	96.5	167	-78.9	-24.5	0	0	0	106.3	T178 V182	T178-N180 PolarHBondContact O-N 2.89Å; N180-V182 VanDerWaalsContact C-N 3.3Å; N180-V182 PolarHBondContact O-N 2.92Å
181	D	42.2	Very low	46.5	Very low	142 Å²	142	140 Å²	140	76%	0.759	76%	0.757	S	S	*	*			trans	-44.9	99.4	163	-73.4	-41.1	0	0	0	107.9	S179 Q183	S179-D181 VanDerWaalsContact C-N 3.27Å; S179-D181 PolarHBondContact O-N 2.83Å; D181-Q183 PolarHBondContact O-N 3.27Å
182	V	48.3	Very low	48.9	Very low	134 Å²	134	141.6 Å²	141.6	81%	0.812	76%	0.755	S	S	*	*			trans	-62	96.8	163.4	177.1	0	0	0	0	103.8	N180 R184	N180-V182 VanDerWaalsContact C-N 3.3Å; N180-V182 PolarHBondContact O-N 2.92Å; V182-R184 VanDerWaalsContact C-N 3.3Å; V182-R184 PolarHBondContact O-N 2.85Å
183	Q	45.9	Very low	51	Low	172 Å²	172	141.8 Å²	141.8	80%	0.804	75%	0.751	S	S	*	*			trans	-49.2	100.4	176.7	-72.9	174.3	-8.7	0	0	106.5	D181 N185	D181-Q183 PolarHBondContact O-N 3.27Å; Q183-N185 PolarHBondContact O-N 3.4Å
184	R	46.6	Very low	53.5	Low	223 Å²	223	143 Å²	143	84%	0.842	74%	0.737	S	S	*	*			trans	-54.4	113.8	165.6	-82.5	176	170	167.2	-2.8	103.7	V182 D186	V182-R184 VanDerWaalsContact C-N 3.3Å; V182-R184 PolarHBondContact O-N 2.85Å; R184-D186 VanDerWaalsContact C-N 3.29Å; R184-D186 PolarHBondContact O-N 3.1Å
185	N	49.4	Very low	55.8	Low	152 Å²	152	142 Å²	142	81%	0.813	72%	0.722	S	S	*	*			trans	-49.9	103.7	171.6	-76.2	-25.2	0	0	0	106.5	Q183 I187	Q183-N185 PolarHBondContact O-N 3.4Å; N185-I187 PolarHBondContact O-N 3.14Å
186	D	56.8	Low	58.1	Low	145 Å²	145	137.5 Å²	137.5	78%	0.775	71%	0.706	S	S	*	*			trans	-58.6	112	-179.7	-75.6	-38.8	0	0	0	105.6	R184 I188	R184-D186 VanDerWaalsContact C-N 3.29Å; R184-D186 PolarHBondContact O-N 3.1Å; D186-I188 VanDerWaalsContact C-N 3.31Å; D186-I188 PolarHBondContact O-N 3.49Å
187	I	61.4	Low	60.6	Low	153 Å²	153	135.4 Å²	135.4	79%	0.785	70%	0.696	S	S	*	*			trans	-59.3	101.3	177.4	-62.5	162.1	0	0	0	104.9	N185 Q189	N185-I187 PolarHBondContact O-N 3.14Å; I187-Q189 PolarHBondContact O-N 3.04Å
188	I	67	Low	62.9	Low	157 Å²	157	132.1 Å²	132.1	81%	0.805	68%	0.678	S	S	*	*			trans	-59	104.8	179.6	-62.5	172.4	0	0	0	106.2	D186 M190	D186-I188 VanDerWaalsContact C-N 3.31Å; D186-I188 PolarHBondContact O-N 3.49Å; I188-M190 PolarHBondContact O-N 3.18Å
189	Q	68.3	Low	65.1	Low	183 Å²	183	131.5 Å²	131.5	86%	0.855	67%	0.67	S	S	*	*			trans	-72	101.2	177.2	-68.3	-175.1	5	0	0	107.3	I187	I187-Q189 PolarHBondContact O-N 3.04Å
190	M	70.5	Confident	67.3	Low	86 Å²	86	130.6 Å²	130.6	42%	0.424	66%	0.664	S	S	.	*			trans	-58.5	135.9	173	-158.9	104.1	65.6	0	0	109.8	I188 E194 K195 L198	I188-M190 PolarHBondContact O-N 3.18Å; M190-E194 HydrophobicContact CG-CB 3.58Å; M190-E194 HydrophobicContact SD-CB 4.23Å; M190-K195 HydrophobicContact CB-CG 4.23Å; M190-K195 HydrophobicContact CG-CG 4.24Å; M190-K195 WeakPolarHBondContact O-CE 3.24Å; M190-L198 HydrophobicContact CE-CD1 3.57Å; M190-L198 HydrophobicContact SD-CD1 4.12Å
191	S	81.6	Confident	69.6	Low	52 Å²	52	126.3 Å²	126.3	36%	0.364	65%	0.645	S	S	.	*			trans	-63.1	154.9	177.2	66.8	0	0	0	0	111.4	E193 E194 K195	S191-E193 PolarHBondContact O-N 3.18Å; S191-E194 WeakPolarHBondContact CB-OE2 3.23Å; S191-E194 PolarHBondContact N-OE2 3.41Å; S191-E194 PolarHBondContact O-N 3.34Å; S191-E194 WeakPolarHBondContact OG-CB 3.28Å; S191-E194 WeakPolarHBondContact OG-CG 3.09Å; S191-E194 PolarHBondContact OG-N 3.17Å; S191-E194 PolarHBondContact OG-OE2 2.87Å; S191-K195 WeakPolarHBondContact O-CG 3.36Å; S191-K195 PolarHBondContact O-N 2.78Å
192	E	80.9	Confident	71.8	Confident	168 Å²	168	123.9 Å²	123.9	79%	0.785	63%	0.631	S	S	*	*	H	α-helix	trans	-61.6	-32.2	178.1	-70.6	-174.6	166.6	0	0	112.3	K195 A196	E192-K195 PolarHBondContact O-N 3.43Å; E192-A196 PolarHBondContact O-N 2.74Å
193	E	78.9	Confident	73.5	Confident	166 Å²	166	120.8 Å²	120.8	78%	0.776	62%	0.62	S	S	*	*	H	α-helix	trans	-68.6	-45	176.7	-64.7	-178.1	178	0	0	111.8	S191 K195 A196 Q197	S191-E193 PolarHBondContact O-N 3.18Å; E193-K195 VanDerWaalsContact C-N 3.29Å; E193-K195 PolarHBondContact O-N 3.03Å; E193-A196 PolarHBondContact O-N 3.07Å; E193-Q197 WeakPolarHBondContact O-CB 3.48Å; E193-Q197 PolarHBondContact O-N 2.68Å
194	E	80.8	Confident	75.6	Confident	94 Å²	94	115.9 Å²	115.9	44%	0.439	60%	0.596	S	S	.	*	H	α-helix	trans	-63.1	-37.3	174.6	-74	165.2	150.9	0	0	111.3	M190 S191 Q197 L198	M190-E194 HydrophobicContact CG-CB 3.58Å; M190-E194 HydrophobicContact SD-CB 4.23Å; S191-E194 WeakPolarHBondContact CB-OE2 3.23Å; S191-E194 PolarHBondContact N-OE2 3.41Å; S191-E194 PolarHBondContact O-N 3.34Å; S191-E194 WeakPolarHBondContact OG-CB 3.28Å; S191-E194 WeakPolarHBondContact OG-CG 3.09Å; S191-E194 PolarHBondContact OG-N 3.17Å; S191-E194 PolarHBondContact OG-OE2 2.87Å; E194-Q197 PolarHBondContact O-N 3.25Å; E194-L198 WeakPolarHBondContact O-CB 3.22Å; E194-L198 VanDerWaalsContact O-CG 3.3Å; E194-L198 WeakPolarHBondContact O-CG 3.5Å; E194-L198 PolarHBondContact O-N 3.08Å
195	K	80.1	Confident	77.5	Confident	110 Å²	110	109 Å²	109	48%	0.478	58%	0.575	S	S	.	*	H	α-helix	trans	-62.5	-45.7	172.5	-71.2	175.6	-175.1	171.1	0	111.4	M190 S191 E192 E193 Q197 L198 L199	M190-K195 HydrophobicContact CB-CG 4.23Å; M190-K195 HydrophobicContact CG-CG 4.24Å; M190-K195 WeakPolarHBondContact O-CE 3.24Å; S191-K195 WeakPolarHBondContact O-CG 3.36Å; S191-K195 PolarHBondContact O-N 2.78Å; E192-K195 PolarHBondContact O-N 3.43Å; E193-K195 VanDerWaalsContact C-N 3.29Å; E193-K195 PolarHBondContact O-N 3.03Å; K195-Q197 VanDerWaalsContact C-N 3.31Å; K195-Q197 PolarHBondContact O-N 3.32Å; K195-L198 PolarHBondContact O-N 3.49Å; K195-L199 WeakPolarHBondContact O-CB 3.32Å; K195-L199 VanDerWaalsContact O-CG 3.26Å; K195-L199 WeakPolarHBondContact O-CG 3.33Å; K195-L199 PolarHBondContact O-N 2.89Å
196	A	80.9	Confident	79	Confident	56 Å²	56	109.4 Å²	109.4	46%	0.463	57%	0.566	S	S	.	*	H	α-helix	trans	-63.6	-36.9	176.8	0	0	0	0	0	112.1	E192 E193 L199 S200	E192-A196 PolarHBondContact O-N 2.74Å; E193-A196 PolarHBondContact O-N 3.07Å; A196-L199 PolarHBondContact O-N 3.1Å; A196-S200 WeakPolarHBondContact O-CB 3.45Å; A196-S200 PolarHBondContact O-N 3.4Å; A196-S200 PolarHBondContact O-OG 3.15Å
197	Q	83.5	Confident	80.4	Confident	141 Å²	141	109 Å²	109	66%	0.659	56%	0.558	S	S	*	*	H	α-helix	trans	-67.6	-39.6	174.4	-169.2	176.7	5.1	0	0	112.1	E193 E194 K195 S200 S201	E193-Q197 WeakPolarHBondContact O-CB 3.48Å; E193-Q197 PolarHBondContact O-N 2.68Å; E194-Q197 PolarHBondContact O-N 3.25Å; K195-Q197 VanDerWaalsContact C-N 3.31Å; K195-Q197 PolarHBondContact O-N 3.32Å; Q197-S200 WeakPolarHBondContact CA-OG 3.11Å; Q197-S200 PolarHBondContact O-N 3.42Å; Q197-S200 PolarHBondContact O-OG 2.97Å; Q197-S200 VanDerWaalsContact O-OG 3.12Å; Q197-S201 WeakPolarHBondContact O-CB 3.48Å; Q197-S201 PolarHBondContact O-N 3.4Å
198	L	82	Confident	81.6	Confident	86 Å²	86	107.3 Å²	107.3	45%	0.45	54%	0.544	S	S	.	.	H	α-helix	trans	-66.5	-42.7	174	-75	169.9	0	0	0	111.6	M190 E194 K195 S200 S201 F204	M190-L198 HydrophobicContact CE-CD1 3.57Å; M190-L198 HydrophobicContact SD-CD1 4.12Å; E194-L198 WeakPolarHBondContact O-CB 3.22Å; E194-L198 VanDerWaalsContact O-CG 3.3Å; E194-L198 WeakPolarHBondContact O-CG 3.5Å; E194-L198 PolarHBondContact O-N 3.08Å; K195-L198 PolarHBondContact O-N 3.49Å; L198-S200 VanDerWaalsContact C-N 3.29Å; L198-S200 PolarHBondContact O-N 3.16Å; L198-S201 VanDerWaalsContact O-CB 3.24Å; L198-S201 WeakPolarHBondContact O-CB 3.31Å; L198-S201 PolarHBondContact O-N 3.31Å; L198-S201 VanDerWaalsContact O-N 3.14Å; L198-F204 WeakPolarHBondContact O-CB 3.07Å; L198-F204 WeakPolarHBondContact O-CG 3.32Å
199	L	82.9	Confident	82.3	Confident	101 Å²	101	104.6 Å²	104.6	53%	0.529	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-34.1	176.5	-71.3	172.8	0	0	0	112.6	K195 A196 F204	K195-L199 WeakPolarHBondContact O-CB 3.32Å; K195-L199 VanDerWaalsContact O-CG 3.26Å; K195-L199 WeakPolarHBondContact O-CG 3.33Å; K195-L199 PolarHBondContact O-N 2.89Å; A196-L199 PolarHBondContact O-N 3.1Å; L199-F204 HydrophobicContact CD2-CD1 4.14Å; L199-F204 HydrophobicContact CD2-CE1 3.43Å; L199-F204 VanDerWaalsContact CD2-CE1 3.43Å; L199-F204 HydrophobicContact CD2-CZ 3.7Å
200	S	85.5	Confident	82.8	Confident	85 Å²	85	104.5 Å²	104.5	59%	0.594	52%	0.52	S	S	*	.	H	α-helix	trans	-85.7	-7.7	175.5	56.2	0	0	0	0	113.9	A196 Q197 L198 D202	A196-S200 WeakPolarHBondContact O-CB 3.45Å; A196-S200 PolarHBondContact O-N 3.4Å; A196-S200 PolarHBondContact O-OG 3.15Å; Q197-S200 WeakPolarHBondContact CA-OG 3.11Å; Q197-S200 PolarHBondContact O-N 3.42Å; Q197-S200 PolarHBondContact O-OG 2.97Å; Q197-S200 VanDerWaalsContact O-OG 3.12Å; L198-S200 VanDerWaalsContact C-N 3.29Å; L198-S200 PolarHBondContact O-N 3.16Å; S200-D202 PolarHBondContact O-N 2.91Å
201	S	88.4	Confident	83.4	Confident	47 Å²	47	101.6 Å²	101.6	33%	0.329	51%	0.508	S	S	.	.			trans	-66.9	131.2	176.6	-177.7	0	0	0	0	110.7	Q197 L198 A203 F204 L205	Q197-S201 WeakPolarHBondContact O-CB 3.48Å; Q197-S201 PolarHBondContact O-N 3.4Å; L198-S201 VanDerWaalsContact O-CB 3.24Å; L198-S201 WeakPolarHBondContact O-CB 3.31Å; L198-S201 PolarHBondContact O-N 3.31Å; L198-S201 VanDerWaalsContact O-N 3.14Å; S201-A203 PolarHBondContact O-N 3.41Å; S201-F204 PolarHBondContact O-N 3.18Å; S201-L205 PolarHBondContact O-N 2.82Å
202	D	87.7	Confident	83.4	Confident	90 Å²	90	100.4 Å²	100.4	48%	0.481	50%	0.5	S	S	.	.	H	α-helix	trans	-58	-33.2	177.5	-174.9	32.1	0	0	0	111.8	S200 F204 L205 R206	S200-D202 PolarHBondContact O-N 2.91Å; D202-F204 PolarHBondContact O-N 2.78Å; D202-L205 PolarHBondContact O-N 3.1Å; D202-R206 WeakPolarHBondContact O-CB 3.23Å; D202-R206 VanDerWaalsContact O-CG 3.24Å; D202-R206 WeakPolarHBondContact O-CG 3.23Å; D202-R206 PolarHBondContact O-N 3.4Å; D202-R206 IonicContact OD1-CZ 3.98Å; D202-R206 IonicContact OD1-NE 3.15Å; D202-R206 PolarHBondContact OD1-NE 3.12Å; D202-R206 VanDerWaalsContact OD1-NE 3.15Å; D202-R206 IonicContact OD1-NH2 3.88Å; D202-R206 IonicContact OD2-CZ 3.23Å; D202-R206 VanDerWaalsContact OD2-CZ 3.23Å; D202-R206 IonicContact OD2-NE 3.07Å; D202-R206 PolarHBondContact OD2-NE 3.46Å; D202-R206 VanDerWaalsContact OD2-NE 3.07Å; D202-R206 IonicContact OD2-NH2 2.7Å; D202-R206 PolarHBondContact OD2-NH2 3.05Å
203	A	85.2	Confident	83.2	Confident	69 Å²	69	99.6 Å²	99.6	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-64.5	-41.3	176.2	0	0	0	0	0	112.3	S201 F207	S201-A203 PolarHBondContact O-N 3.41Å; A203-F207 WeakPolarHBondContact O-CB 3.46Å; A203-F207 PolarHBondContact O-N 3.25Å
204	F	88.9	Confident	83.1	Confident	70 Å²	70	96.6 Å²	96.6	31%	0.307	48%	0.478	S	S	.	.	H	α-helix	trans	-69.4	-44.5	177.6	177.3	-95.9	0	0	0	111.1	L198 L199 S201 D202 R206 F207 F208	L198-F204 WeakPolarHBondContact O-CB 3.07Å; L198-F204 WeakPolarHBondContact O-CG 3.32Å; L199-F204 HydrophobicContact CD2-CD1 4.14Å; L199-F204 HydrophobicContact CD2-CE1 3.43Å; L199-F204 VanDerWaalsContact CD2-CE1 3.43Å; L199-F204 HydrophobicContact CD2-CZ 3.7Å; S201-F204 PolarHBondContact O-N 3.18Å; D202-F204 PolarHBondContact O-N 2.78Å; F204-R206 VanDerWaalsContact C-N 3.35Å; F204-R206 PolarHBondContact O-N 3.42Å; F204-F207 PolarHBondContact O-N 3.08Å; F204-F208 HydrophobicContact CE1-CB 4.21Å; F204-F208 HydrophobicContact CE1-CG 4.48Å; F204-F208 HydrophobicContact CZ-CB 4.41Å; F204-F208 HydrophobicContact CZ-CD2 4.31Å; F204-F208 VanDerWaalsContact O-CB 3.24Å; F204-F208 WeakPolarHBondContact O-CB 3.16Å; F204-F208 PolarHBondContact O-N 2.94Å
205	L	86	Confident	83	Confident	77 Å²	77	96.8 Å²	96.8	40%	0.403	48%	0.481	S	S	.	.	H	α-helix	trans	-59.7	-45.2	177.3	-68.4	175.4	0	0	0	111.4	S201 D202 F207 F208 E209	S201-L205 PolarHBondContact O-N 2.82Å; D202-L205 PolarHBondContact O-N 3.1Å; L205-F207 PolarHBondContact O-N 3.48Å; L205-F208 PolarHBondContact O-N 3.49Å; L205-E209 WeakPolarHBondContact O-CB 3.05Å; L205-E209 VanDerWaalsContact O-CG 3.32Å; L205-E209 WeakPolarHBondContact O-CG 3.2Å; L205-E209 PolarHBondContact O-N 3.16Å
206	R	80.9	Confident	82.6	Confident	162 Å²	162	95 Å²	95	61%	0.611	48%	0.475	S	S	*	.	H	α-helix	trans	-63	-41.8	175.3	-70.5	179.1	-165.7	-156.3	9.1	112.8	D202 F204 R210	D202-R206 WeakPolarHBondContact O-CB 3.23Å; D202-R206 VanDerWaalsContact O-CG 3.24Å; D202-R206 WeakPolarHBondContact O-CG 3.23Å; D202-R206 PolarHBondContact O-N 3.4Å; D202-R206 IonicContact OD1-CZ 3.98Å; D202-R206 IonicContact OD1-NE 3.15Å; D202-R206 PolarHBondContact OD1-NE 3.12Å; D202-R206 VanDerWaalsContact OD1-NE 3.15Å; D202-R206 IonicContact OD1-NH2 3.88Å; D202-R206 IonicContact OD2-CZ 3.23Å; D202-R206 VanDerWaalsContact OD2-CZ 3.23Å; D202-R206 IonicContact OD2-NE 3.07Å; D202-R206 PolarHBondContact OD2-NE 3.46Å; D202-R206 VanDerWaalsContact OD2-NE 3.07Å; D202-R206 IonicContact OD2-NH2 2.7Å; D202-R206 PolarHBondContact OD2-NH2 3.05Å; F204-R206 VanDerWaalsContact C-N 3.35Å; F204-R206 PolarHBondContact O-N 3.42Å; R206-R210 VanDerWaalsContact O-CB 3.26Å; R206-R210 WeakPolarHBondContact O-CB 3.03Å; R206-R210 PolarHBondContact O-N 2.97Å
207	F	86.7	Confident	82.1	Confident	137 Å²	137	97.8 Å²	97.8	60%	0.601	47%	0.473	S	S	*	.	H	α-helix	trans	-64.3	-46	175.9	171.9	-97	0	0	0	111.1	A203 F204 L205 R210 S211	A203-F207 WeakPolarHBondContact O-CB 3.46Å; A203-F207 PolarHBondContact O-N 3.25Å; F204-F207 PolarHBondContact O-N 3.08Å; L205-F207 PolarHBondContact O-N 3.48Å; F207-R210 PolarHBondContact O-N 3.04Å; F207-S211 VanDerWaalsContact O-CB 3.28Å; F207-S211 WeakPolarHBondContact O-CB 3.42Å; F207-S211 PolarHBondContact O-N 2.87Å; F207-S211 PolarHBondContact O-OG 3.45Å
208	F	87.4	Confident	81.5	Confident	116 Å²	116	93.4 Å²	93.4	51%	0.509	46%	0.461	S	S	.	.	H	α-helix	trans	-63.6	-47.8	180	-175.2	-100.3	0	0	0	110.6	F204 L205 R210 S211 S212	F204-F208 HydrophobicContact CE1-CB 4.21Å; F204-F208 HydrophobicContact CE1-CG 4.48Å; F204-F208 HydrophobicContact CZ-CB 4.41Å; F204-F208 HydrophobicContact CZ-CD2 4.31Å; F204-F208 VanDerWaalsContact O-CB 3.24Å; F204-F208 WeakPolarHBondContact O-CB 3.16Å; F204-F208 PolarHBondContact O-N 2.94Å; L205-F208 PolarHBondContact O-N 3.49Å; F208-R210 VanDerWaalsContact C-N 3.3Å; F208-R210 PolarHBondContact O-N 2.87Å; F208-S211 WeakPolarHBondContact CA-OG 3.35Å; F208-S211 PolarHBondContact O-N 2.79Å; F208-S211 PolarHBondContact O-OG 2.9Å; F208-S212 WeakPolarHBondContact O-CA 3.32Å; F208-S212 WeakPolarHBondContact O-CB 3.36Å; F208-S212 PolarHBondContact O-N 2.71Å; F208-S212 PolarHBondContact O-OG 3Å
209	E	80.2	Confident	81.1	Confident	101 Å²	101	95.3 Å²	95.3	47%	0.472	47%	0.47	S	S	.	.	H	α-helix	trans	-63.6	-32.8	177	-75.6	-177.1	-172.8	0	0	113.7	L205 S212 R213	L205-E209 WeakPolarHBondContact O-CB 3.05Å; L205-E209 VanDerWaalsContact O-CG 3.32Å; L205-E209 WeakPolarHBondContact O-CG 3.2Å; L205-E209 PolarHBondContact O-N 3.16Å; E209-S212 PolarHBondContact O-OG 3.47Å; E209-R213 WeakPolarHBondContact O-CG 3.19Å; E209-R213 PolarHBondContact O-N 3.38Å; E209-R213 PolarHBondContact O-NE 2.8Å; E209-R213 IonicContact OE2-NH2 3.71Å; E209-R213 PolarHBondContact OE2-NH2 3.12Å
210	R	79.7	Confident	80.4	Confident	181 Å²	181	91.8 Å²	91.8	68%	0.683	45%	0.454	S	S	*	.	H	α-helix	trans	-75.2	-48.4	176.1	178.9	178.7	173.6	165.2	-1.1	111	R206 F207 F208 I214	R206-R210 VanDerWaalsContact O-CB 3.26Å; R206-R210 WeakPolarHBondContact O-CB 3.03Å; R206-R210 PolarHBondContact O-N 2.97Å; F207-R210 PolarHBondContact O-N 3.04Å; F208-R210 VanDerWaalsContact C-N 3.3Å; F208-R210 PolarHBondContact O-N 2.87Å; R210-I214 HydrophobicContact CG-CD1 4.11Å; R210-I214 WeakPolarHBondContact O-CD1 3.28Å; R210-I214 WeakPolarHBondContact O-CG1 3.39Å; R210-I214 PolarHBondContact O-N 3.34Å
211	S	83.6	Confident	79.4	Confident	25 Å²	25	92 Å²	92	18%	0.175	45%	0.445	C	S	.	.	H	α-helix	trans	-69.9	-38.9	-177.9	55.9	0	0	0	0	111.6	F207 F208 R213 I214 I215	F207-S211 VanDerWaalsContact O-CB 3.28Å; F207-S211 WeakPolarHBondContact O-CB 3.42Å; F207-S211 PolarHBondContact O-N 2.87Å; F207-S211 PolarHBondContact O-OG 3.45Å; F208-S211 WeakPolarHBondContact CA-OG 3.35Å; F208-S211 PolarHBondContact O-N 2.79Å; F208-S211 PolarHBondContact O-OG 2.9Å; S211-R213 PolarHBondContact O-N 3.29Å; S211-I214 PolarHBondContact O-N 2.77Å; S211-I215 WeakPolarHBondContact O-CB 3.45Å; S211-I215 VanDerWaalsContact O-CG1 3.31Å; S211-I215 WeakPolarHBondContact O-CG1 3.34Å; S211-I215 PolarHBondContact O-N 2.93Å
212	S	82	Confident	77.9	Confident	27 Å²	27	95.1 Å²	95.1	19%	0.189	46%	0.464	C	S	.	.	H	α-helix	trans	-58.6	-47.5	174.1	69.4	0	0	0	0	111	F208 E209 I214 I215 E216	F208-S212 WeakPolarHBondContact O-CA 3.32Å; F208-S212 WeakPolarHBondContact O-CB 3.36Å; F208-S212 PolarHBondContact O-N 2.71Å; F208-S212 PolarHBondContact O-OG 3Å; E209-S212 PolarHBondContact O-OG 3.47Å; S212-I214 VanDerWaalsContact C-N 3.3Å; S212-I214 PolarHBondContact O-N 2.79Å; S212-I215 PolarHBondContact O-N 3.35Å; S212-E216 WeakPolarHBondContact O-CB 3.35Å; S212-E216 WeakPolarHBondContact O-CG 3.46Å; S212-E216 PolarHBondContact O-N 3.1Å
213	R	75.6	Confident	76.4	Confident	151 Å²	151	94 Å²	94	57%	0.57	46%	0.458	S	S	*	.	H	α-helix	trans	-60.3	-36.7	176.6	-79.1	-175.9	-95.3	-154.1	-7.4	113.4	E209 S211 R217	E209-R213 WeakPolarHBondContact O-CG 3.19Å; E209-R213 PolarHBondContact O-N 3.38Å; E209-R213 PolarHBondContact O-NE 2.8Å; E209-R213 IonicContact OE2-NH2 3.71Å; E209-R213 PolarHBondContact OE2-NH2 3.12Å; S211-R213 PolarHBondContact O-N 3.29Å; R213-R217 WeakPolarHBondContact O-CB 3.39Å; R213-R217 PolarHBondContact O-N 2.84Å; R213-R217 VanDerWaalsContact O-N 3.09Å
214	I	77.4	Confident	74.9	Confident	103 Å²	103	98.8 Å²	98.8	53%	0.528	47%	0.469	S	S	.	.	H	α-helix	trans	-72	-45.6	177.7	-65.4	164.9	0	0	0	110.8	R210 S211 S212 R217 A218	R210-I214 HydrophobicContact CG-CD1 4.11Å; R210-I214 WeakPolarHBondContact O-CD1 3.28Å; R210-I214 WeakPolarHBondContact O-CG1 3.39Å; R210-I214 PolarHBondContact O-N 3.34Å; S211-I214 PolarHBondContact O-N 2.77Å; S212-I214 VanDerWaalsContact C-N 3.3Å; S212-I214 PolarHBondContact O-N 2.79Å; I214-R217 WeakPolarHBondContact O-CB 3.28Å; I214-R217 PolarHBondContact O-N 2.86Å; I214-A218 PolarHBondContact O-N 3.42Å
215	I	78.9	Confident	73.1	Confident	98 Å²	98	97.2 Å²	97.2	50%	0.503	47%	0.473	S	S	.	.	H	α-helix	trans	-66.6	-43.7	178.8	-67.5	168.6	0	0	0	110.3	S211 S212 R217 A218 I219	S211-I215 WeakPolarHBondContact O-CB 3.45Å; S211-I215 VanDerWaalsContact O-CG1 3.31Å; S211-I215 WeakPolarHBondContact O-CG1 3.34Å; S211-I215 PolarHBondContact O-N 2.93Å; S212-I215 PolarHBondContact O-N 3.35Å; I215-R217 PolarHBondContact O-N 2.99Å; I215-A218 PolarHBondContact O-N 2.85Å; I215-A218 VanDerWaalsContact O-N 3.1Å; I215-I219 HydrophobicContact CG2-CD1 3.65Å; I215-I219 HydrophobicContact CG2-CG1 4.3Å; I215-I219 VanDerWaalsContact O-CG1 3.3Å; I215-I219 WeakPolarHBondContact O-CG1 3.46Å; I215-I219 PolarHBondContact O-N 2.84Å
216	E	71.4	Confident	71.9	Confident	73 Å²	73	99.6 Å²	99.6	34%	0.341	48%	0.484	S	S	.	.	H	α-helix	trans	-55.4	-41.8	172.7	-78.8	178.1	-165.9	0	0	110.9	S212 I219 C220 K302	S212-E216 WeakPolarHBondContact O-CB 3.35Å; S212-E216 WeakPolarHBondContact O-CG 3.46Å; S212-E216 PolarHBondContact O-N 3.1Å; E216-I219 PolarHBondContact O-N 3.01Å; E216-C220 WeakPolarHBondContact O-CB 3.26Å; E216-C220 PolarHBondContact O-N 3.03Å; E216-C220 PolarHBondContact O-SG 3.1Å; E216-K302 IonicContact OE2-NZ 3.37Å; E216-K302 PolarHBondContact OE2-NZ 2.88Å
217	R	70.5	Confident	70.9	Confident	113 Å²	113	99.6 Å²	99.6	43%	0.426	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-43.1	175.4	-179.8	173.2	170.5	178.1	-2.4	113	R213 I214 I215 I219 Q221 Y299	R213-R217 WeakPolarHBondContact O-CB 3.39Å; R213-R217 PolarHBondContact O-N 2.84Å; R213-R217 VanDerWaalsContact O-N 3.09Å; I214-R217 WeakPolarHBondContact O-CB 3.28Å; I214-R217 PolarHBondContact O-N 2.86Å; I215-R217 PolarHBondContact O-N 2.99Å; R217-I219 VanDerWaalsContact C-N 3.3Å; R217-I219 PolarHBondContact O-N 2.88Å; R217-Q221 HydrophobicContact CG-CG 4.47Å; R217-Q221 VanDerWaalsContact O-CG 3.28Å; R217-Q221 WeakPolarHBondContact O-CG 3.46Å; R217-Q221 PolarHBondContact O-N 2.96Å; R217-Q221 VanDerWaalsContact O-N 3.08Å; R217-Y299 HydrophobicContact CB-CE1 3.77Å; R217-Y299 WeakPolarHBondContact CB-OH 3.33Å; R217-Y299 HydrophobicContact CG-CE1 3.91Å
218	A	71.3	Confident	69.7	Low	49 Å²	49	96.9 Å²	96.9	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-64.6	-35.8	177.5	0	0	0	0	0	112.1	I214 I215	I214-A218 PolarHBondContact O-N 3.42Å; I215-A218 PolarHBondContact O-N 2.85Å; I215-A218 VanDerWaalsContact O-N 3.1Å
219	I	73.1	Confident	68.1	Low	126 Å²	126	95.5 Å²	95.5	65%	0.646	48%	0.478	S	S	*	.	H	α-helix	trans	-75.5	-37.1	179.4	-67	167.5	0	0	0	112.2	I215 E216 R217	I215-I219 HydrophobicContact CG2-CD1 3.65Å; I215-I219 HydrophobicContact CG2-CG1 4.3Å; I215-I219 VanDerWaalsContact O-CG1 3.3Å; I215-I219 WeakPolarHBondContact O-CG1 3.46Å; I215-I219 PolarHBondContact O-N 2.84Å; E216-I219 PolarHBondContact O-N 3.01Å; R217-I219 VanDerWaalsContact C-N 3.3Å; R217-I219 PolarHBondContact O-N 2.88Å
220	C	67.8	Low	67.2	Low	27 Å²	27	98.9 Å²	98.9	18%	0.182	49%	0.488	C	S	.	.	H	α-helix	trans	-87.8	-16.2	-175.9	-71.3	0	0	0	0	114.2	E216 Y299	E216-C220 WeakPolarHBondContact O-CB 3.26Å; E216-C220 PolarHBondContact O-N 3.03Å; E216-C220 PolarHBondContact O-SG 3.1Å; C220-Y299 HydrophobicContact CB-CD1 3.53Å; C220-Y299 HydrophobicContact CB-CE1 4.35Å; C220-Y299 HydrophobicContact CB-CG 4.38Å
221	Q	64.3	Low	66.7	Low	90 Å²	90	93.9 Å²	93.9	42%	0.421	48%	0.481	S	S	.	.	S	Bend	trans	-56.3	129.4	173.3	-89.6	176.1	-15	0	0	109.1	R217 D223	R217-Q221 HydrophobicContact CG-CG 4.47Å; R217-Q221 VanDerWaalsContact O-CG 3.28Å; R217-Q221 WeakPolarHBondContact O-CG 3.46Å; R217-Q221 PolarHBondContact O-N 2.96Å; R217-Q221 VanDerWaalsContact O-N 3.08Å; Q221-D223 PolarHBondContact O-N 2.86Å
222	P	57.8	Low	65.5	Low	112 Å²	112	94.9 Å²	94.9	73%	0.727	50%	0.495	S	S	*	.			trans	-57.5	131.5	180	21.3	-30.1	0	0	0	109.8	E224	P222-E224 VanDerWaalsContact C-N 3.31Å; P222-E224 PolarHBondContact O-N 3.33Å
223	D	55.2	Low	64.4	Low	66 Å²	66	101.1 Å²	101.1	35%	0.353	52%	0.521	S	S	.	.			trans	-67.5	71.9	-171.3	-86.5	-51.5	0	0	0	114.1	Q221 G225 F227	Q221-D223 PolarHBondContact O-N 2.86Å; D223-G225 PolarHBondContact O-N 3.28Å; D223-F227 HydrophobicContact CB-CB 4.44Å; D223-F227 VanDerWaalsContact CG-CD2 3.48Å; D223-F227 VanDerWaalsContact OD1-CD2 3.31Å; D223-F227 WeakPolarHBondContact OD1-CD2 3.38Å; D223-F227 WeakPolarHBondContact OD2-CD2 3.49Å
224	E	53.9	Low	63.4	Low	171 Å²	171	98.8 Å²	98.8	80%	0.799	52%	0.52	S	S	*	.	S	Bend	trans	-76	-5.3	162.8	-73.7	-172.3	177.2	0	0	112.4	P222 L228 Y230	P222-E224 VanDerWaalsContact C-N 3.31Å; P222-E224 PolarHBondContact O-N 3.33Å; E224-L228 WeakPolarHBondContact O-CD2 3.47Å; E224-Y230 PolarHBondContact O-OH 2.82Å
225	G	51.5	Low	62.3	Low	37 Å²	37	101.1 Å²	101.1	38%	0.381	53%	0.533	S	S	.	.	S	Bend	trans	-144.5	-34.1	-172.8	0	0	0	0	0	119.4	D223 Y230	D223-G225 PolarHBondContact O-N 3.28Å; G225-Y230 WeakPolarHBondContact CA-OH 3.39Å
226	I	60.4	Low	60.9	Low	126 Å²	126	104.8 Å²	104.8	65%	0.646	55%	0.548	S	S	*	.	S	Bend	trans	-83.1	-42	-170.1	-57.8	176	0	0	0	111.3
227	F	60.3	Low	60.1	Low	163 Å²	163	106.8 Å²	106.8	72%	0.715	57%	0.565	S	S	*	*	S	Bend	trans	-111.9	2.7	179.7	-62.4	-80.5	0	0	0	113.9	D223 D229	D223-F227 HydrophobicContact CB-CB 4.44Å; D223-F227 VanDerWaalsContact CG-CD2 3.48Å; D223-F227 VanDerWaalsContact OD1-CD2 3.31Å; D223-F227 WeakPolarHBondContact OD1-CD2 3.38Å; D223-F227 WeakPolarHBondContact OD2-CD2 3.49Å; F227-D229 PolarHBondContact O-N 3.24Å
228	L	61.6	Low	59.2	Low	80 Å²	80	109.6 Å²	109.6	42%	0.419	58%	0.583	S	S	.	*			trans	-66.3	115.8	176.1	-169.7	71.6	0	0	0	109.2	E224 Y230	E224-L228 WeakPolarHBondContact O-CD2 3.47Å; L228-Y230 HydrophobicContact CD2-CD1 4.37Å; L228-Y230 HydrophobicContact CD2-CE1 3.86Å; L228-Y230 WeakPolarHBondContact O-CD2 3.24Å; L228-Y230 PolarHBondContact O-N 2.83Å
229	D	53.1	Low	58.3	Low	86 Å²	86	115.8 Å²	115.8	46%	0.46	60%	0.603	S	S	.	*			trans	-75	99.3	176.1	-169	8.6	0	0	0	109.7	F227 S231	F227-D229 PolarHBondContact O-N 3.24Å; D229-S231 PolarHBondContact O-N 2.84Å; D229-S231 WeakPolarHBondContact OD1-CB 3.42Å; D229-S231 PolarHBondContact OD1-N 3.44Å; D229-S231 VanDerWaalsContact OD1-N 3.12Å; D229-S231 PolarHBondContact OD1-OG 3.45Å; D229-S231 WeakPolarHBondContact OD2-CB 3.46Å; D229-S231 PolarHBondContact OD2-OG 3.22Å
230	Y	61.2	Low	57.5	Low	173 Å²	173	113.1 Å²	113.1	68%	0.678	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	5.9	174	-62	-76.2	0	0	0	113.5	E224 G225 L228 G232	E224-Y230 PolarHBondContact O-OH 2.82Å; G225-Y230 WeakPolarHBondContact CA-OH 3.39Å; L228-Y230 HydrophobicContact CD2-CD1 4.37Å; L228-Y230 HydrophobicContact CD2-CE1 3.86Å; L228-Y230 WeakPolarHBondContact O-CD2 3.24Å; L228-Y230 PolarHBondContact O-N 2.83Å; Y230-G232 PolarHBondContact O-N 3.41Å; Y230-G232 VanDerWaalsContact O-N 3.15Å
231	S	69.7	Low	57.4	Low	76 Å²	76	119 Å²	119	53%	0.531	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.5	-11.4	171.2	75	0	0	0	0	113.6	D229 Q233	D229-S231 PolarHBondContact O-N 2.84Å; D229-S231 WeakPolarHBondContact OD1-CB 3.42Å; D229-S231 PolarHBondContact OD1-N 3.44Å; D229-S231 VanDerWaalsContact OD1-N 3.12Å; D229-S231 PolarHBondContact OD1-OG 3.45Å; D229-S231 WeakPolarHBondContact OD2-CB 3.46Å; D229-S231 PolarHBondContact OD2-OG 3.22Å; S231-Q233 VanDerWaalsContact C-N 3.33Å
232	G	58.8	Low	58.2	Low	46 Å²	46	120.2 Å²	120.2	47%	0.474	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	83.2	7.1	172.2	0	0	0	0	0	114.2	Y230	Y230-G232 PolarHBondContact O-N 3.41Å; Y230-G232 VanDerWaalsContact O-N 3.15Å
233	Q	59.7	Low	59.6	Low	158 Å²	158	117.3 Å²	117.3	74%	0.738	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-23.9	178.3	-153.7	169	23.7	0	0	112.9	S231	S231-Q233 VanDerWaalsContact C-N 3.33Å
234	D	54	Low	61.3	Low	101 Å²	101	114.6 Å²	114.6	54%	0.54	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.2	2.7	-174.4	-69.5	-19.9	0	0	0	114.6	E236	D234-E236 PolarHBondContact O-N 2.8Å
235	L	54.2	Low	63	Low	152 Å²	152	108.6 Å²	108.6	80%	0.796	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-7.9	177.8	-80.8	164.6	0	0	0	113.6	T237	L235-T237 PolarHBondContact O-N 2.95Å
236	E	50	Low	64.8	Low	175 Å²	175	109.4 Å²	109.4	82%	0.818	57%	0.568	S	S	*	*			trans	-79.9	59.3	166.2	-64.4	-178.1	-179.8	0	0	109.2	D234 E238	D234-E236 PolarHBondContact O-N 2.8Å; E236-E238 VanDerWaalsContact C-N 3.29Å; E236-E238 PolarHBondContact O-N 3.12Å
237	T	54.7	Low	66.1	Low	115 Å²	115	105.7 Å²	105.7	71%	0.706	55%	0.552	S	S	*	*			trans	-70.4	97.4	164	-48.8	0	0	0	0	105.7	L235 E239	L235-T237 PolarHBondContact O-N 2.95Å; T237-E239 PolarHBondContact O-N 3.07Å
238	E	50.1	Low	67.4	Low	172 Å²	172	98.9 Å²	98.9	80%	0.804	52%	0.524	S	S	*	.			trans	-50.1	108.3	170.4	-66.7	-99	124.4	0	0	107.1	E236 S240	E236-E238 VanDerWaalsContact C-N 3.29Å; E236-E238 PolarHBondContact O-N 3.12Å; E238-S240 VanDerWaalsContact C-N 3.25Å; E238-S240 PolarHBondContact O-N 3.17Å
239	E	52.5	Low	68.7	Low	179 Å²	179	98.7 Å²	98.7	84%	0.836	52%	0.521	S	S	*	.			trans	-60.4	96.5	170.5	-71.1	179.9	170.7	0	0	105.8	T237 D241	T237-E239 PolarHBondContact O-N 3.07Å; E239-D241 PolarHBondContact O-N 2.84Å; E239-D241 VanDerWaalsContact O-N 3.08Å
240	S	57.7	Low	70.4	Confident	70 Å²	70	94.7 Å²	94.7	49%	0.49	50%	0.499	S	S	.	.			trans	-63.9	116.2	174.9	59.5	0	0	0	0	106.9	E238 E242	E238-S240 VanDerWaalsContact C-N 3.25Å; E238-S240 PolarHBondContact O-N 3.17Å; S240-E242 PolarHBondContact O-N 3.16Å
241	D	65.1	Low	71.8	Confident	152 Å²	152	87.4 Å²	87.4	81%	0.813	47%	0.471	S	S	*	.			trans	-62.6	10.3	173.8	-68.2	-37.7	0	0	0	113.3	E239 L243	E239-D241 PolarHBondContact O-N 2.84Å; E239-D241 VanDerWaalsContact O-N 3.08Å; D241-L243 PolarHBondContact O-N 3.14Å
242	E	81.5	Confident	72.6	Confident	115 Å²	115	84.9 Å²	84.9	54%	0.537	45%	0.452	S	S	.	.			trans	-69	114.2	177.7	-67.8	-167.4	174.4	0	0	110.2	S240 L244 T245	S240-E242 PolarHBondContact O-N 3.16Å; E242-L244 PolarHBondContact O-N 3.06Å; E242-T245 HydrophobicContact CB-CG2 3.84Å
243	L	87	Confident	73.9	Confident	51 Å²	51	88.2 Å²	88.2	27%	0.267	46%	0.455	S	S	.	.	S	Bend	trans	-64.9	-20.4	179.4	-61.7	178.7	0	0	0	113.7	D241 V551 A552 H604 L607	D241-L243 PolarHBondContact O-N 3.14Å; L243-V551 HydrophobicContact CD1-CG1 3.73Å; L243-A552 HydrophobicContact CB-CB 3.84Å; L243-A552 HydrophobicContact CD1-CB 4.27Å; L243-H604 HydrophobicContact CB-CB 4.5Å; L243-H604 HydrophobicContact CD2-CB 4.03Å; L243-H604 PolarHBondContact O-N 3.32Å; L243-L607 HydrophobicContact CB-CD1 4.21Å; L243-L607 HydrophobicContact CD1-CD1 4.39Å
244	L	89.9	Confident	75.1	Confident	8 Å²	8	88.4 Å²	88.4	4%	0.042	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	108.4	179.2	-68.6	170.7	0	0	0	111.2	E242 I540 A552 R554 V603	E242-L244 PolarHBondContact O-N 3.06Å; L244-I540 HydrophobicContact CD1-CB 4.36Å; L244-I540 HydrophobicContact CD1-CG1 3.59Å; L244-I540 HydrophobicContact CD2-CD1 4.36Å; L244-I540 HydrophobicContact CD2-CG1 3.61Å; L244-I540 HydrophobicContact CG-CG1 4.09Å; L244-A552 HydrophobicContact CD1-CB 3.41Å; L244-A552 VanDerWaalsContact CD1-CB 3.41Å; L244-A552 HydrophobicContact CG-CB 3.71Å; L244-R554 HydrophobicContact CB-CB 4.37Å; L244-R554 HydrophobicContact CD1-CB 4.22Å; L244-R554 VanDerWaalsContact O-CD 3.29Å; L244-R554 WeakPolarHBondContact O-CD 3.26Å; L244-V603 HydrophobicContact CD2-CB 4.41Å; L244-V603 HydrophobicContact CD2-CG2 3.78Å
245	T	90.3	Very high	76.7	Confident	46 Å²	46	84.5 Å²	84.5	28%	0.282	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	145.4	175.5	56.8	0	0	0	0	110.1	E242 S247 C601 S602	E242-T245 HydrophobicContact CB-CG2 3.84Å; T245-S247 PolarHBondContact O-N 3.4Å; T245-C601 CarbonylContact O-C 3.55Å; T245-C601 VanDerWaalsContact O-CA 3.26Å; T245-C601 WeakPolarHBondContact O-CA 3.46Å; T245-S602 PolarHBondContact N-O 3.04Å; T245-S602 VanDerWaalsContact N-O 3.11Å; T245-S602 PolarHBondContact O-N 3.14Å
246	V	89	Confident	78.2	Confident	54 Å²	54	77.2 Å²	77.2	33%	0.327	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	118.7	174.1	169.9	0	0	0	0	107.8	L556 T599	V246-L556 HydrophobicContact CG2-CD2 3.87Å; V246-T599 HydrophobicContact CB-CG2 4.41Å; V246-T599 HydrophobicContact CG1-CG2 3.65Å; V246-T599 HydrophobicContact CG2-CG2 3.88Å
247	S	87.2	Confident	80	Confident	47 Å²	47	72.7 Å²	72.7	33%	0.329	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-54	177.9	61.3	0	0	0	0	111.1	T245 V600	T245-S247 PolarHBondContact O-N 3.4Å; S247-V600 PolarHBondContact N-O 3.25Å; S247-V600 PolarHBondContact OG-O 3.08Å; S247-V600 VanDerWaalsContact OG-O 3.05Å
248	N	87.5	Confident	81.5	Confident	20 Å²	20	71.2 Å²	71.2	11%	0.107	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	146.6	-174	-65.8	-20.6	0	0	0	111.7	F250 M297 P300 V600	N248-F250 HydrophobicContact CB-CE2 4.01Å; N248-F250 HydrophobicContact CB-CZ 3.97Å; N248-M297 HydrophobicContact CB-CE 4.16Å; N248-M297 HydrophobicContact CB-SD 4.15Å; N248-M297 WeakPolarHBondContact ND2-CE 3.41Å; N248-M297 PolarHBondContact ND2-O 3.43Å; N248-M297 PolarHBondContact ND2-SD 2.77Å; N248-P300 WeakPolarHBondContact OD1-CB 3.4Å; N248-V600 HydrophobicContact CB-CB 4.35Å; N248-V600 PolarHBondContact N-O 3.4Å; N248-V600 PolarHBondContact O-N 3.05Å
249	E	88.8	Confident	83.5	Confident	77 Å²	77	63.1 Å²	63.1	36%	0.36	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	121.8	171.7	-171.9	-179.7	173.4	0	0	108.8	R597	E249-R597 WeakPolarHBondContact OE1-CD 3.13Å; E249-R597 IonicContact OE1-CZ 3.96Å; E249-R597 IonicContact OE1-NE 2.81Å; E249-R597 IonicContact OE1-NH1 3.97Å; E249-R597 PolarHBondContact OE1-NH1 3.18Å
250	F	90.3	Very high	85.4	Confident	1 Å²	1	57 Å²	57	0%	0.004	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.1	177.8	-56.9	-70.8	0	0	0	110.6	N248 W295 M297 V598 V600	N248-F250 HydrophobicContact CB-CE2 4.01Å; N248-F250 HydrophobicContact CB-CZ 3.97Å; F250-W295 HydrophobicContact CB-CD2 3.58Å; F250-W295 HydrophobicContact CB-CE3 3.66Å; F250-W295 HydrophobicContact CB-CG 4.01Å; F250-W295 HydrophobicContact CB-CH2 4.2Å; F250-W295 HydrophobicContact CB-CZ2 4.19Å; F250-W295 HydrophobicContact CB-CZ3 3.98Å; F250-W295 HydrophobicContact CD1-CB 4.21Å; F250-W295 HydrophobicContact CD1-CD2 4.17Å; F250-W295 AromaticContact CD1-CE3 3.72Å; F250-W295 HydrophobicContact CD1-CE3 3.72Å; F250-W295 HydrophobicContact CD1-CG 4.4Å; F250-W295 HydrophobicContact CD1-CZ3 4.37Å; F250-W295 HydrophobicContact CD2-CB 3.96Å; F250-W295 HydrophobicContact CD2-CG 4.16Å; F250-W295 HydrophobicContact CE1-CB 4.4Å; F250-W295 HydrophobicContact CE2-CB 4.14Å; F250-W295 HydrophobicContact CG-CB 3.99Å; F250-W295 AromaticContact CG-CD2 3.86Å; F250-W295 HydrophobicContact CG-CD2 3.86Å; F250-W295 AromaticContact CG-CE3 3.86Å; F250-W295 HydrophobicContact CG-CE3 3.86Å; F250-W295 AromaticContact CG-CG 3.93Å; F250-W295 HydrophobicContact CG-CG 3.93Å; F250-W295 HydrophobicContact CZ-CB 4.37Å; F250-M297 HydrophobicContact CE2-SD 3.57Å; F250-M297 VanDerWaalsContact CE2-SD 3.57Å; F250-M297 HydrophobicContact CZ-SD 3.78Å; F250-V598 HydrophobicContact CB-CB 4.28Å; F250-V598 PolarHBondContact N-O 3.35Å; F250-V598 PolarHBondContact O-N 3.31Å; F250-V600 HydrophobicContact CD2-CG2 4.37Å; F250-V600 HydrophobicContact CE2-CG2 4.01Å
251	F	89.2	Confident	87.2	Confident	21 Å²	21	53.6 Å²	53.6	9%	0.092	26%	0.264	C	S	.	.			trans	-156.5	129.2	177.2	179.4	-104.7	0	0	0	109.3	E253 S256 K257 L303 R597	F251-E253 HydrophobicContact CE1-CG 4.05Å; F251-E253 WeakPolarHBondContact CE1-OE1 3.35Å; F251-S256 VanDerWaalsContact CD2-OG 3.23Å; F251-S256 WeakPolarHBondContact CD2-OG 3.33Å; F251-K257 HydrophobicContact CE2-CB 4.35Å; F251-K257 HydrophobicContact CZ-CB 3.95Å; F251-K257 HydrophobicContact CZ-CG 4.15Å; F251-L303 VanDerWaalsContact O-CB 3.28Å; F251-L303 WeakPolarHBondContact O-CB 3.43Å; F251-L303 WeakPolarHBondContact O-CD2 3.22Å; F251-R597 HydrophobicContact CB-CG 4.13Å; F251-R597 HydrophobicContact CD2-CB 4.34Å; F251-R597 HydrophobicContact CD2-CG 3.39Å; F251-R597 HydrophobicContact CE2-CG 4.04Å; F251-R597 HydrophobicContact CG-CG 3.97Å
252	D	87.5	Confident	88.6	Confident	23 Å²	23	47.3 Å²	47.3	12%	0.123	23%	0.231	C	C	.	.			trans	-117.4	119.6	172.6	-177.2	-0.8	0	0	0	109.6	R254 W255 S256 K257 W295 L303 P305	D252-R254 PolarHBondContact O-N 3.21Å; D252-R254 VanDerWaalsContact O-N 3.1Å; D252-R254 PolarHBondContact OD1-N 3.44Å; D252-W255 PolarHBondContact O-N 3.29Å; D252-S256 PolarHBondContact N-OG 3.31Å; D252-S256 PolarHBondContact O-N 3.12Å; D252-S256 PolarHBondContact O-OG 2.85Å; D252-K257 PolarHBondContact O-N 2.93Å; D252-W295 HydrophobicContact CB-CH2 3.77Å; D252-L303 WeakPolarHBondContact CB-O 3.38Å; D252-P305 VanDerWaalsContact OD2-CD 3.32Å; D252-P305 WeakPolarHBondContact OD2-CD 3.27Å
253	E	84.8	Confident	89.1	Confident	116 Å²	116	42.2 Å²	42.2	54%	0.542	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.7	177.7	-73.9	-73.7	166.9	0	0	113	F251 K257	F251-E253 HydrophobicContact CE1-CG 4.05Å; F251-E253 WeakPolarHBondContact CE1-OE1 3.35Å; E253-K257 WeakPolarHBondContact O-CB 3.31Å; E253-K257 WeakPolarHBondContact OE2-CD 3.43Å; E253-K257 IonicContact OE2-NZ 3.79Å; E253-K257 PolarHBondContact OE2-NZ 3Å
254	R	86.7	Confident	89.6	Confident	161 Å²	161	40.4 Å²	40.4	61%	0.608	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-41.2	-176.5	-174.9	175.1	-178.6	175	4	113.3	D252	D252-R254 PolarHBondContact O-N 3.21Å; D252-R254 VanDerWaalsContact O-N 3.1Å; D252-R254 PolarHBondContact OD1-N 3.44Å
255	W	86.4	Confident	89.8	Confident	19 Å²	19	41.1 Å²	41.1	7%	0.072	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-21.6	-167.9	-65.9	113.2	0	0	0	114.4	D252 R259 P288 V291 L293 I308 H310	D252-W255 PolarHBondContact O-N 3.29Å; W255-R259 VanDerWaalsContact O-CD 3.22Å; W255-R259 WeakPolarHBondContact O-CD 3.41Å; W255-P288 HydrophobicContact CH2-CG 4.49Å; W255-P288 HydrophobicContact CZ3-CG 3.78Å; W255-V291 HydrophobicContact CB-CG1 4.43Å; W255-V291 HydrophobicContact CE3-CG1 4.31Å; W255-V291 HydrophobicContact CE3-CG2 4.08Å; W255-V291 HydrophobicContact CZ3-CG2 4.47Å; W255-L293 HydrophobicContact CB-CD1 3.8Å; W255-L293 HydrophobicContact CB-CD2 3.98Å; W255-L293 HydrophobicContact CB-CG 4.47Å; W255-L293 HydrophobicContact CG-CD2 4.36Å; W255-I308 HydrophobicContact CD2-CG2 4.06Å; W255-I308 HydrophobicContact CG-CG2 4.25Å; W255-I308 HydrophobicContact CZ2-CG2 4.41Å; W255-H310 AromaticContact CH2-CD2 3.35Å; W255-H310 WeakPolarHBondContact CH2-CD2 3.28Å; W255-H310 AromaticContact CH2-NE2 3.24Å; W255-H310 WeakPolarHBondContact CH2-NE2 3.47Å; W255-H310 AromaticContact CZ2-NE2 3.49Å; W255-H310 WeakPolarHBondContact CZ2-NE2 3.33Å; W255-H310 AromaticContact CZ3-CD2 3.46Å; W255-H310 VanDerWaalsContact CZ3-CD2 3.46Å; W255-H310 WeakPolarHBondContact CZ3-CD2 3.13Å; W255-H310 AromaticContact CZ3-NE2 3.73Å
256	S	86.6	Confident	90	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-26	-176.2	78.9	0	0	0	0	113.1	F251 D252 H258 R259 G596	F251-S256 VanDerWaalsContact CD2-OG 3.23Å; F251-S256 WeakPolarHBondContact CD2-OG 3.33Å; D252-S256 PolarHBondContact N-OG 3.31Å; D252-S256 PolarHBondContact O-N 3.12Å; D252-S256 PolarHBondContact O-OG 2.85Å; S256-H258 PolarHBondContact O-N 2.95Å; S256-R259 PolarHBondContact O-N 3.37Å; S256-G596 VanDerWaalsContact CB-O 3.23Å; S256-G596 WeakPolarHBondContact CB-O 3.48Å; S256-G596 WeakPolarHBondContact O-CA 3.5Å; S256-G596 PolarHBondContact OG-O 2.91Å
257	K	86.8	Confident	90.2	Very high	79 Å²	79	37 Å²	37	34%	0.343	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	132.1	-178.2	-170.7	-179.1	-163.3	150.7	0	113.7	F251 D252 E253 R259 N281	F251-K257 HydrophobicContact CE2-CB 4.35Å; F251-K257 HydrophobicContact CZ-CB 3.95Å; F251-K257 HydrophobicContact CZ-CG 4.15Å; D252-K257 PolarHBondContact O-N 2.93Å; E253-K257 WeakPolarHBondContact O-CB 3.31Å; E253-K257 WeakPolarHBondContact OE2-CD 3.43Å; E253-K257 IonicContact OE2-NZ 3.79Å; E253-K257 PolarHBondContact OE2-NZ 3Å; K257-R259 PolarHBondContact O-N 3.47Å; K257-N281 PolarHBondContact O-ND2 3.03Å
258	H	87.5	Confident	90.2	Very high	85 Å²	85	37.7 Å²	37.7	39%	0.394	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	31.6	177.7	-53	142.8	0	0	0	113.4	S256 E283 T595	S256-H258 PolarHBondContact O-N 2.95Å; H258-E283 IonicContact CE1-OE1 3.2Å; H258-E283 IonicContact CE1-OE2 3.44Å; H258-E283 PolarHBondContact CE1-OE2 2.89Å; H258-E283 IonicContact CG-OE2 2.71Å; H258-E283 VanDerWaalsContact ND1-CD 3.32Å; H258-E283 IonicContact ND1-OE1 3.7Å; H258-E283 IonicContact ND1-OE2 3.36Å; H258-E283 PolarHBondContact ND1-OE2 3.36Å; H258-T595 PolarHBondContact N-O 3.08Å; H258-T595 VanDerWaalsContact N-O 3.11Å
259	R	91.1	Very high	90.3	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	19%	0.194	C	C	.	.			trans	-124.2	129.5	174.3	-66.3	175.1	-177.7	-92.5	1.8	109.7	W255 S256 K257 Y278 H279 N281 E287 P288 E289 D594 T595 G596	W255-R259 VanDerWaalsContact O-CD 3.22Å; W255-R259 WeakPolarHBondContact O-CD 3.41Å; S256-R259 PolarHBondContact O-N 3.37Å; K257-R259 PolarHBondContact O-N 3.47Å; R259-Y278 HydrophobicContact CB-CD1 3.9Å; R259-Y278 HydrophobicContact CB-CG 4.42Å; R259-H279 PolarHBondContact NH1-O 3.23Å; R259-N281 HydrophobicContact CG-CB 3.67Å; R259-E287 IonicContact CZ-OE2 3.6Å; R259-E287 IonicContact NE-OE2 3.98Å; R259-E287 VanDerWaalsContact NH2-CB 3.31Å; R259-E287 IonicContact NH2-OE2 2.7Å; R259-E287 PolarHBondContact NH2-OE2 3.27Å; R259-P288 PolarHBondContact NH1-O 3.3Å; R259-P288 VanDerWaalsContact NH1-O 3.12Å; R259-P288 PolarHBondContact NH2-O 3.31Å; R259-E289 PolarHBondContact NH1-O 2.83Å; R259-D594 CarbonylContact C-O 3.45Å; R259-T595 CarbonylContact O-C 3.36Å; R259-G596 WeakPolarHBondContact O-CA 3.36Å; R259-G596 PolarHBondContact O-N 3.06Å; R259-G596 VanDerWaalsContact O-N 3.1Å
260	T	92.5	Very high	90.4	Very high	50 Å²	50	40.4 Å²	40.4	31%	0.307	19%	0.193	S	C	.	.			trans	-72.5	139.8	174.3	61.9	0	0	0	0	110.4	Y278 H279 D594	T260-Y278 WeakPolarHBondContact O-CA 3.47Å; T260-H279 PolarHBondContact O-N 2.73Å; T260-H279 VanDerWaalsContact OG1-CB 3.27Å; T260-H279 WeakPolarHBondContact OG1-CB 3.47Å; T260-D594 WeakPolarHBondContact CA-O 3.07Å; T260-D594 HydrophobicContact CG2-CB 4.08Å; T260-D594 WeakPolarHBondContact CG2-O 3.18Å
261	I	95	Very high	90.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.4	175.7	-69	157	0	0	0	108.8	L264 A277 Y278 N578 G592 D593 R597 V598	I261-L264 HydrophobicContact CG2-CD2 3.87Å; I261-L264 HydrophobicContact CG2-CG 4.02Å; I261-A277 CarbonylContact C-O 3.14Å; I261-A277 WeakPolarHBondContact CA-O 3.48Å; I261-Y278 HydrophobicContact CD1-CE1 3.97Å; I261-Y278 HydrophobicContact CG1-CD1 3.76Å; I261-Y278 HydrophobicContact CG1-CE1 3.4Å; I261-N578 PolarHBondContact O-ND2 2.6Å; I261-G592 VanDerWaalsContact CD1-CA 3.41Å; I261-D593 PolarHBondContact N-O 3.46Å; I261-D593 VanDerWaalsContact N-O 3.09Å; I261-R597 WeakPolarHBondContact CD1-O 3.37Å; I261-V598 HydrophobicContact CD1-CG2 3.49Å; I261-V598 VanDerWaalsContact CD1-CG2 3.49Å; I261-V598 HydrophobicContact CG1-CG2 4.45Å
262	T	94.5	Very high	90.3	Very high	19 Å²	19	44.2 Å²	44.2	12%	0.117	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-25.9	-174.1	56.3	0	0	0	0	113	A277 H279 V315 T316 K579	T262-A277 PolarHBondContact N-O 3.23Å; T262-A277 WeakPolarHBondContact OG1-CB 3.1Å; T262-A277 PolarHBondContact OG1-O 2.88Å; T262-H279 HydrophobicContact CG2-CB 3.7Å; T262-V315 WeakPolarHBondContact CB-O 3.32Å; T262-V315 PolarHBondContact OG1-O 3.42Å; T262-T316 WeakPolarHBondContact CB-O 3.3Å; T262-K579 VanDerWaalsContact O-CE 3.25Å; T262-K579 WeakPolarHBondContact O-CE 2.87Å
263	G	93.6	Very high	90.5	Very high	8 Å²	8	43.7 Å²	43.7	8%	0.082	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	146.6	179.7	0	0	0	0	0	112.8	A277	G263-A277 PolarHBondContact O-N 2.56Å
264	L	95.7	Very high	90.9	Very high	14 Å²	14	38.1 Å²	38.1	7%	0.073	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	133.9	176.4	-68.8	175.9	0	0	0	108.9	I261 L274 L275 T276 K579 R581 A590 V598	I261-L264 HydrophobicContact CG2-CD2 3.87Å; I261-L264 HydrophobicContact CG2-CG 4.02Å; L264-L274 HydrophobicContact CD2-CD1 4.5Å; L264-L275 WeakPolarHBondContact CA-O 3.38Å; L264-T276 HydrophobicContact CD2-CG2 3.27Å; L264-K579 HydrophobicContact CD1-CB 3.95Å; L264-K579 WeakPolarHBondContact CD1-O 3.32Å; L264-K579 HydrophobicContact CG-CB 4.11Å; L264-R581 HydrophobicContact CB-CB 3.86Å; L264-A590 HydrophobicContact CD1-CB 4.26Å; L264-V598 HydrophobicContact CD2-CG1 4.38Å
265	D	94.9	Very high	91.3	Very high	22 Å²	22	30.5 Å²	30.5	12%	0.118	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	140.4	173.5	-155.6	17.8	0	0	0	111.5	L275 S319 L320 R581	D265-L275 PolarHBondContact N-O 3.37Å; D265-L275 WeakPolarHBondContact O-CB 3.37Å; D265-L275 PolarHBondContact O-N 2.93Å; D265-S319 WeakPolarHBondContact OD2-CA 3.2Å; D265-S319 WeakPolarHBondContact OD2-CB 3.5Å; D265-S319 PolarHBondContact OD2-OG 3.1Å; D265-L320 PolarHBondContact OD2-N 2.96Å; D265-R581 IonicContact OD1-NE 2.94Å
266	W	94	Very high	91.8	Very high	8 Å²	8	29.6 Å²	29.6	3%	0.03	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	142.2	178	-70	92.7	0	0	0	109.9	L274 M297 R581 W582 N583 A590 V600	W266-L274 HydrophobicContact CD2-CB 4.49Å; W266-L274 HydrophobicContact CD2-CD1 3.83Å; W266-L274 HydrophobicContact CE3-CB 4.08Å; W266-L274 HydrophobicContact CE3-CD1 4.28Å; W266-L274 HydrophobicContact CG-CD1 4.2Å; W266-L274 HydrophobicContact CH2-CB 4.31Å; W266-L274 HydrophobicContact CH2-CD2 4.38Å; W266-L274 HydrophobicContact CZ2-CD1 4.13Å; W266-L274 HydrophobicContact CZ2-CD2 4.37Å; W266-L274 HydrophobicContact CZ3-CB 3.97Å; W266-M297 HydrophobicContact CH2-CE 4.48Å; W266-M297 HydrophobicContact CH2-CG 3.95Å; W266-M297 HydrophobicContact CH2-SD 4.06Å; W266-M297 HydrophobicContact CZ3-CG 3.81Å; W266-M297 HydrophobicContact CZ3-SD 4.49Å; W266-R581 PolarHBondContact NE1-O 3Å; W266-W582 VanDerWaalsContact CD1-C 3.48Å; W266-N583 HydrophobicContact CD2-CB 4.03Å; W266-N583 HydrophobicContact CE3-CB 4.37Å; W266-N583 HydrophobicContact CG-CB 4.38Å; W266-N583 HydrophobicContact CZ2-CB 4.25Å; W266-A590 HydrophobicContact CZ2-CB 3.56Å; W266-V600 HydrophobicContact CH2-CG1 4.03Å; W266-V600 HydrophobicContact CH2-CG2 4.35Å; W266-V600 HydrophobicContact CZ2-CG1 4.12Å
267	S	92.8	Very high	92.2	Very high	5 Å²	5	29.6 Å²	29.6	4%	0.035	16%	0.156	C	C	.	.			trans	-74.9	131.4	171	135.4	0	0	0	0	109.4	I269 F270 L273	S267-I269 VanDerWaalsContact C-N 3.33Å; S267-I269 PolarHBondContact OG-N 2.98Å; S267-F270 WeakPolarHBondContact CB-O 3.31Å; S267-F270 CarbonylContact O-C 3.59Å; S267-F270 WeakPolarHBondContact OG-CA 3.37Å; S267-F270 WeakPolarHBondContact OG-CB 3.45Å; S267-F270 PolarHBondContact OG-N 3.49Å; S267-F270 PolarHBondContact OG-O 2.9Å; S267-L273 PolarHBondContact N-O 3.36Å; S267-L273 VanDerWaalsContact N-O 3.12Å
268	T	87.9	Confident	92.6	Very high	63 Å²	63	25.9 Å²	25.9	39%	0.387	14%	0.14	S	C	.	.	S	Bend	trans	-78.6	-18.4	178.4	56.1	0	0	0	0	113.2	R322	T268-R322 HydrophobicContact CG2-CG 4.18Å; T268-R322 PolarHBondContact OG1-O 3.15Å
269	I	90.5	Very high	92.8	Very high	73 Å²	73	24 Å²	24	37%	0.374	13%	0.131	S	C	.	.	S	Bend	trans	-94.7	-43.6	-176.4	-61.9	169.2	0	0	0	110.3	S267 P271 P325	S267-I269 VanDerWaalsContact C-N 3.33Å; S267-I269 PolarHBondContact OG-N 2.98Å; I269-P271 WeakPolarHBondContact O-CD 3.28Å; I269-P325 HydrophobicContact CB-CB 4.11Å; I269-P325 HydrophobicContact CD1-CB 3.71Å; I269-P325 HydrophobicContact CD1-CG 3.88Å; I269-P325 HydrophobicContact CG1-CB 4.49Å; I269-P325 HydrophobicContact CG2-CB 4.14Å; I269-P325 HydrophobicContact CG2-CG 4.4Å
270	F	90.5	Very high	92.8	Very high	81 Å²	81	27.4 Å²	27.4	36%	0.355	15%	0.148	S	C	.	.	S	Bend	trans	-113.4	90.6	173.8	-56.4	-55.6	0	0	0	108.4	S267 E272 L273 P325	S267-F270 WeakPolarHBondContact CB-O 3.31Å; S267-F270 CarbonylContact O-C 3.59Å; S267-F270 WeakPolarHBondContact OG-CA 3.37Å; S267-F270 WeakPolarHBondContact OG-CB 3.45Å; S267-F270 PolarHBondContact OG-N 3.49Å; S267-F270 PolarHBondContact OG-O 2.9Å; F270-E272 VanDerWaalsContact CA-OE2 3.32Å; F270-E272 WeakPolarHBondContact CA-OE2 3.36Å; F270-E272 PolarHBondContact O-N 2.82Å; F270-E272 VanDerWaalsContact O-N 3.17Å; F270-L273 HydrophobicContact CB-CB 4.35Å; F270-L273 HydrophobicContact CB-CD1 3.79Å; F270-L273 HydrophobicContact CB-CG 3.92Å; F270-L273 HydrophobicContact CD2-CD1 3.96Å; F270-L273 HydrophobicContact CG-CD1 4.22Å; F270-L273 PolarHBondContact O-N 3.37Å; F270-P325 HydrophobicContact CD2-CB 3.82Å; F270-P325 HydrophobicContact CE2-CB 3.49Å; F270-P325 VanDerWaalsContact CE2-CB 3.49Å; F270-P325 HydrophobicContact CE2-CG 4.01Å; F270-P325 HydrophobicContact CZ-CB 4.43Å
271	P	88.2	Confident	92.6	Very high	63 Å²	63	26 Å²	26	41%	0.409	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-9.7	-175.3	28.8	-36.1	0	0	0	113.5	I269 L273 N583	I269-P271 WeakPolarHBondContact O-CD 3.28Å; P271-L273 VanDerWaalsContact C-N 3.33Å; P271-N583 PolarHBondContact O-ND2 2.89Å
272	E	88.3	Confident	91.9	Very high	38 Å²	38	33.5 Å²	33.5	18%	0.178	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-15.5	171.7	71.7	-89.7	-135.3	0	0	113.7	F270 M297 K298	F270-E272 VanDerWaalsContact CA-OE2 3.32Å; F270-E272 WeakPolarHBondContact CA-OE2 3.36Å; F270-E272 PolarHBondContact O-N 2.82Å; F270-E272 VanDerWaalsContact O-N 3.17Å; E272-M297 HydrophobicContact CB-CB 4.3Å; E272-M297 WeakPolarHBondContact O-CB 3.3Å; E272-M297 WeakPolarHBondContact O-CG 3.43Å; E272-M297 PolarHBondContact O-N 2.97Å; E272-K298 HydrophobicContact CB-CD 4.36Å; E272-K298 HydrophobicContact CB-CG 4.16Å; E272-K298 HydrophobicContact CG-CD 4.1Å; E272-K298 HydrophobicContact CG-CG 4.38Å; E272-K298 IonicContact OE1-NZ 3.99Å; E272-K298 PolarHBondContact OE1-NZ 2.91Å
273	L	92.3	Very high	91.2	Very high	12 Å²	12	39.4 Å²	39.4	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.8	-176.2	-64.9	-177.9	0	0	0	111.2	S267 F270 P271 M294 W295 N296 E306	S267-L273 PolarHBondContact N-O 3.36Å; S267-L273 VanDerWaalsContact N-O 3.12Å; F270-L273 HydrophobicContact CB-CB 4.35Å; F270-L273 HydrophobicContact CB-CD1 3.79Å; F270-L273 HydrophobicContact CB-CG 3.92Å; F270-L273 HydrophobicContact CD2-CD1 3.96Å; F270-L273 HydrophobicContact CG-CD1 4.22Å; F270-L273 PolarHBondContact O-N 3.37Å; P271-L273 VanDerWaalsContact C-N 3.33Å; L273-M294 HydrophobicContact CB-CG 4.35Å; L273-M294 HydrophobicContact CB-SD 4.36Å; L273-M294 HydrophobicContact CD1-CE 4.08Å; L273-M294 HydrophobicContact CD1-SD 4.23Å; L273-M294 HydrophobicContact CD2-CG 4.49Å; L273-W295 WeakPolarHBondContact CA-O 3.17Å; L273-N296 HydrophobicContact CD2-CB 4.07Å; L273-E306 VanDerWaalsContact CD2-OE2 3.31Å; L273-E306 WeakPolarHBondContact CD2-OE2 3.31Å
274	L	93.9	Very high	90.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.8	177.2	174.2	63.3	0	0	0	109.8	L264 W266 T276 M294 W295 A590 V598 V600	L264-L274 HydrophobicContact CD2-CD1 4.5Å; W266-L274 HydrophobicContact CD2-CB 4.49Å; W266-L274 HydrophobicContact CD2-CD1 3.83Å; W266-L274 HydrophobicContact CE3-CB 4.08Å; W266-L274 HydrophobicContact CE3-CD1 4.28Å; W266-L274 HydrophobicContact CG-CD1 4.2Å; W266-L274 HydrophobicContact CH2-CB 4.31Å; W266-L274 HydrophobicContact CH2-CD2 4.38Å; W266-L274 HydrophobicContact CZ2-CD1 4.13Å; W266-L274 HydrophobicContact CZ2-CD2 4.37Å; W266-L274 HydrophobicContact CZ3-CB 3.97Å; L274-T276 HydrophobicContact CD2-CG2 4.43Å; L274-T276 HydrophobicContact CG-CG2 4.26Å; L274-M294 CarbonylContact O-C 3.56Å; L274-M294 WeakPolarHBondContact O-CA 3.18Å; L274-W295 HydrophobicContact CB-CB 4.48Å; L274-W295 PolarHBondContact N-O 2.89Å; L274-W295 PolarHBondContact O-N 3.44Å; L274-A590 HydrophobicContact CD1-CB 3.83Å; L274-A590 HydrophobicContact CD2-CB 3.65Å; L274-A590 HydrophobicContact CG-CB 4.42Å; L274-V598 HydrophobicContact CD2-CG1 3.56Å; L274-V600 HydrophobicContact CD2-CG2 4.01Å
275	L	95.2	Very high	89.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	136	170.5	178.4	71.2	0	0	0	110.2	L264 D265 C292 A318 L320 V328	L264-L275 WeakPolarHBondContact CA-O 3.38Å; D265-L275 PolarHBondContact N-O 3.37Å; D265-L275 WeakPolarHBondContact O-CB 3.37Å; D265-L275 PolarHBondContact O-N 2.93Å; L275-C292 HydrophobicContact CD1-CB 4.17Å; L275-A318 HydrophobicContact CD2-CB 3.7Å; L275-A318 HydrophobicContact CG-CB 4.42Å; L275-L320 HydrophobicContact CB-CD1 3.71Å; L275-L320 HydrophobicContact CB-CD2 4.01Å; L275-L320 HydrophobicContact CB-CG 3.71Å; L275-L320 HydrophobicContact CD1-CD2 4.44Å; L275-L320 HydrophobicContact CD2-CD2 3.81Å; L275-L320 HydrophobicContact CD2-CG 3.74Å; L275-L320 HydrophobicContact CG-CD2 4.32Å; L275-L320 HydrophobicContact CG-CG 4.31Å; L275-V328 HydrophobicContact CD1-CG1 3.73Å; L275-V328 HydrophobicContact CD2-CG1 3.53Å; L275-V328 HydrophobicContact CG-CG1 4.3Å
276	T	95.7	Very high	89	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.2	175.4	50.4	0	0	0	0	109.6	L264 L274 Y278 C292 L293 W295 V598	L264-T276 HydrophobicContact CD2-CG2 3.27Å; L274-T276 HydrophobicContact CD2-CG2 4.43Å; L274-T276 HydrophobicContact CG-CG2 4.26Å; T276-Y278 WeakPolarHBondContact OG1-CE2 3.44Å; T276-C292 CarbonylContact O-C 3.55Å; T276-C292 WeakPolarHBondContact O-CA 3.48Å; T276-L293 PolarHBondContact N-O 3.41Å; T276-L293 PolarHBondContact O-N 3.26Å; T276-L293 PolarHBondContact OG1-O 2.92Å; T276-W295 VanDerWaalsContact OG1-CD1 3.28Å; T276-W295 PolarHBondContact OG1-NE1 3.39Å; T276-V598 HydrophobicContact CG2-CB 4.32Å; T276-V598 HydrophobicContact CG2-CG1 4Å; T276-V598 HydrophobicContact CG2-CG2 3.44Å; T276-V598 VanDerWaalsContact CG2-CG2 3.44Å
277	A	95.4	Very high	88.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	133.1	173.3	0	0	0	0	0	109.6	I261 T262 G263 V315 A318	I261-A277 CarbonylContact C-O 3.14Å; I261-A277 WeakPolarHBondContact CA-O 3.48Å; T262-A277 PolarHBondContact N-O 3.23Å; T262-A277 WeakPolarHBondContact OG1-CB 3.1Å; T262-A277 PolarHBondContact OG1-O 2.88Å; G263-A277 PolarHBondContact O-N 2.56Å; A277-V315 HydrophobicContact CB-CB 4.44Å; A277-V315 HydrophobicContact CB-CG1 3.84Å; A277-A318 HydrophobicContact CB-CB 3.74Å
278	Y	94.8	Very high	88.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	141.6	-178.5	-66	-90	0	0	0	110.8	R259 T260 I261 T276 V291 L293 W295 G596 V598	R259-Y278 HydrophobicContact CB-CD1 3.9Å; R259-Y278 HydrophobicContact CB-CG 4.42Å; T260-Y278 WeakPolarHBondContact O-CA 3.47Å; I261-Y278 HydrophobicContact CD1-CE1 3.97Å; I261-Y278 HydrophobicContact CG1-CD1 3.76Å; I261-Y278 HydrophobicContact CG1-CE1 3.4Å; T276-Y278 WeakPolarHBondContact OG1-CE2 3.44Å; Y278-V291 WeakPolarHBondContact CB-O 3.45Å; Y278-V291 PolarHBondContact N-O 3.35Å; Y278-V291 PolarHBondContact O-N 3.28Å; Y278-L293 HydrophobicContact CD2-CD1 4.09Å; Y278-L293 HydrophobicContact CD2-CG 3.94Å; Y278-L293 HydrophobicContact CE2-CB 3.87Å; Y278-L293 HydrophobicContact CE2-CD1 3.46Å; Y278-L293 VanDerWaalsContact CE2-CD1 3.46Å; Y278-L293 HydrophobicContact CE2-CG 3.58Å; Y278-W295 PolarHBondContact OH-NE1 3.05Å; Y278-G596 WeakPolarHBondContact CE1-O 3.11Å; Y278-G596 PolarHBondContact OH-O 2.95Å; Y278-V598 WeakPolarHBondContact OH-CG2 3.32Å
279	H	92.4	Very high	88.4	Confident	46 Å²	46	59.5 Å²	59.5	21%	0.213	30%	0.302	C	S	.	.			trans	-77.7	-175.6	172.6	-154.7	-101	0	0	0	112.2	R259 T260 T262 E289 P314	R259-H279 PolarHBondContact NH1-O 3.23Å; T260-H279 PolarHBondContact O-N 2.73Å; T260-H279 VanDerWaalsContact OG1-CB 3.27Å; T260-H279 WeakPolarHBondContact OG1-CB 3.47Å; T262-H279 HydrophobicContact CG2-CB 3.7Å; H279-E289 CarbonylContact C-O 3.58Å; H279-P314 WeakPolarHBondContact NE2-CB 3.48Å
280	M	90.9	Very high	88.5	Confident	73 Å²	73	56 Å²	56	36%	0.36	28%	0.284	S	S	.	.			trans	-66.5	141.7	174.3	83	-164.4	-156.4	0	0	112.2	E282 E289 P314	M280-E282 HydrophobicContact CE-CG 3.95Å; M280-E289 WeakPolarHBondContact CA-O 3.36Å; M280-E289 HydrophobicContact CB-CB 4.28Å; M280-E289 PolarHBondContact N-O 2.92Å; M280-P314 HydrophobicContact CB-CB 4.5Å; M280-P314 HydrophobicContact CB-CG 4.17Å; M280-P314 HydrophobicContact SD-CG 4.35Å
281	N	87.5	Confident	88.6	Confident	20 Å²	20	52.1 Å²	52.1	11%	0.107	27%	0.267	C	S	.	.			trans	-92.9	121.3	167.9	-175.1	-7.5	0	0	0	108.4	K257 R259 E283	K257-N281 PolarHBondContact O-ND2 3.03Å; R259-N281 HydrophobicContact CG-CB 3.67Å; N281-E283 PolarHBondContact OD1-N 2.92Å
282	E	81.8	Confident	88.9	Confident	157 Å²	157	49.1 Å²	49.1	73%	0.734	25%	0.247	S	C	*	.	S	Bend	trans	-74.4	-26.3	179.4	-63	-166.8	160.9	0	0	113	M280	M280-E282 HydrophobicContact CE-CG 3.95Å
283	E	80	Confident	89.2	Confident	143 Å²	143	47.3 Å²	47.3	67%	0.668	24%	0.239	S	C	*	.	S	Bend	trans	-78.4	-33.2	-177.5	-62.2	-171.4	163.3	0	0	112.7	H258 N281	H258-E283 IonicContact CE1-OE1 3.2Å; H258-E283 IonicContact CE1-OE2 3.44Å; H258-E283 PolarHBondContact CE1-OE2 2.89Å; H258-E283 IonicContact CG-OE2 2.71Å; H258-E283 VanDerWaalsContact ND1-CD 3.32Å; H258-E283 IonicContact ND1-OE1 3.7Å; H258-E283 IonicContact ND1-OE2 3.36Å; H258-E283 PolarHBondContact ND1-OE2 3.36Å; N281-E283 PolarHBondContact OD1-N 2.92Å
284	A	78.7	Confident	89.2	Confident	27 Å²	27	46.9 Å²	46.9	22%	0.223	24%	0.237	C	C	.	.			trans	-109	74.3	-173.2	0	0	0	0	0	112.1	H286 E287	A284-H286 PolarHBondContact O-N 2.82Å; A284-H286 VanDerWaalsContact O-N 3.08Å; A284-E287 HydrophobicContact CB-CB 4.3Å; A284-E287 HydrophobicContact CB-CG 3.92Å; A284-E287 PolarHBondContact O-N 3.24Å
285	V	77.3	Confident	89.1	Confident	128 Å²	128	47 Å²	47	78%	0.776	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.4	-177.8	-173.6	0	0	0	0	113.8
286	H	81.7	Confident	88.9	Confident	194 Å²	194	47.6 Å²	47.6	90%	0.898	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-13.6	178.7	-64.9	-45.6	0	0	0	114.1	A284	A284-H286 PolarHBondContact O-N 2.82Å; A284-H286 VanDerWaalsContact O-N 3.08Å
287	E	85.9	Confident	88.4	Confident	57 Å²	57	49 Å²	49	27%	0.266	25%	0.247	S	C	.	.	S	Bend	trans	-83.3	154.2	177.8	-68.5	-175.2	172.9	0	0	111.2	R259 A284 E289	R259-E287 IonicContact CZ-OE2 3.6Å; R259-E287 IonicContact NE-OE2 3.98Å; R259-E287 VanDerWaalsContact NH2-CB 3.31Å; R259-E287 IonicContact NH2-OE2 2.7Å; R259-E287 PolarHBondContact NH2-OE2 3.27Å; A284-E287 HydrophobicContact CB-CB 4.3Å; A284-E287 HydrophobicContact CB-CG 3.92Å; A284-E287 PolarHBondContact O-N 3.24Å; E287-E289 PolarHBondContact O-N 3Å
288	P	87.6	Confident	87.8	Confident	37 Å²	37	52.4 Å²	52.4	24%	0.24	26%	0.262	C	S	.	.			trans	-58.8	140.1	172.9	22.6	-30.3	0	0	0	111.1	W255 R259 V291 H310 C311	W255-P288 HydrophobicContact CH2-CG 4.49Å; W255-P288 HydrophobicContact CZ3-CG 3.78Å; R259-P288 PolarHBondContact NH1-O 3.3Å; R259-P288 VanDerWaalsContact NH1-O 3.12Å; R259-P288 PolarHBondContact NH2-O 3.31Å; P288-V291 HydrophobicContact CG-CG2 4.21Å; P288-H310 HydrophobicContact CB-CB 4.09Å; P288-H310 HydrophobicContact CG-CB 3.96Å; P288-C311 WeakPolarHBondContact CB-O 3.41Å
289	E	89.1	Confident	87	Confident	99 Å²	99	54.1 Å²	54.1	46%	0.463	27%	0.268	S	S	.	.	S	Bend	trans	-64.9	-46.5	-176.4	-63.4	-178.7	174.1	0	0	111.3	R259 H279 M280 E287 P314	R259-E289 PolarHBondContact NH1-O 2.83Å; H279-E289 CarbonylContact C-O 3.58Å; M280-E289 WeakPolarHBondContact CA-O 3.36Å; M280-E289 HydrophobicContact CB-CB 4.28Å; M280-E289 PolarHBondContact N-O 2.92Å; E287-E289 PolarHBondContact O-N 3Å; E289-P314 HydrophobicContact CB-CG 4.12Å; E289-P314 VanDerWaalsContact OE2-CD 3.32Å; E289-P314 WeakPolarHBondContact OE2-CD 3.41Å
290	G	90.9	Very high	86.1	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.5	178.8	0	0	0	0	0	112.4	H310 C311 S313	G290-H310 CarbonylContact O-C 3.53Å; G290-C311 PolarHBondContact N-O 3.26Å; G290-C311 PolarHBondContact O-N 3.38Å; G290-S313 WeakPolarHBondContact CA-O 3.45Å; G290-S313 PolarHBondContact N-O 3.46Å
291	V	93.5	Very high	85.1	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.3	177.2	-178.5	0	0	0	0	109	W255 Y278 P288 L293 F309	W255-V291 HydrophobicContact CB-CG1 4.43Å; W255-V291 HydrophobicContact CE3-CG1 4.31Å; W255-V291 HydrophobicContact CE3-CG2 4.08Å; W255-V291 HydrophobicContact CZ3-CG2 4.47Å; Y278-V291 WeakPolarHBondContact CB-O 3.45Å; Y278-V291 PolarHBondContact N-O 3.35Å; Y278-V291 PolarHBondContact O-N 3.28Å; P288-V291 HydrophobicContact CG-CG2 4.21Å; V291-L293 HydrophobicContact CG1-CD2 3.52Å; V291-L293 HydrophobicContact CG1-CG 3.94Å; V291-F309 WeakPolarHBondContact CA-O 3.38Å
292	C	94.1	Very high	84.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127	166.9	-63.4	0	0	0	0	109	L275 T276 F309 W340	L275-C292 HydrophobicContact CD1-CB 4.17Å; T276-C292 CarbonylContact O-C 3.55Å; T276-C292 WeakPolarHBondContact O-CA 3.48Å; C292-F309 HydrophobicContact CB-CB 4.12Å; C292-F309 HydrophobicContact CB-CD2 4.34Å; C292-F309 PolarHBondContact N-O 3.31Å; C292-F309 WeakPolarHBondContact O-CB 3.4Å; C292-F309 PolarHBondContact O-N 3.42Å; C292-W340 HydrophobicContact CB-CH2 4.46Å; C292-W340 HydrophobicContact CB-CZ3 4.4Å; C292-W340 VanDerWaalsContact SG-CH2 3.55Å
293	L	93.8	Very high	84.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.7	178.7	-52.1	179.2	0	0	0	109.7	W255 T276 Y278 V291 W295 P305 F307 I308	W255-L293 HydrophobicContact CB-CD1 3.8Å; W255-L293 HydrophobicContact CB-CD2 3.98Å; W255-L293 HydrophobicContact CB-CG 4.47Å; W255-L293 HydrophobicContact CG-CD2 4.36Å; T276-L293 PolarHBondContact N-O 3.41Å; T276-L293 PolarHBondContact O-N 3.26Å; T276-L293 PolarHBondContact OG1-O 2.92Å; Y278-L293 HydrophobicContact CD2-CD1 4.09Å; Y278-L293 HydrophobicContact CD2-CG 3.94Å; Y278-L293 HydrophobicContact CE2-CB 3.87Å; Y278-L293 HydrophobicContact CE2-CD1 3.46Å; Y278-L293 VanDerWaalsContact CE2-CD1 3.46Å; Y278-L293 HydrophobicContact CE2-CG 3.58Å; V291-L293 HydrophobicContact CG1-CD2 3.52Å; V291-L293 HydrophobicContact CG1-CG 3.94Å; L293-W295 HydrophobicContact CB-CZ2 4.28Å; L293-W295 HydrophobicContact CD1-CH2 4.37Å; L293-W295 HydrophobicContact CD1-CZ2 3.64Å; L293-P305 HydrophobicContact CB-CB 4.07Å; L293-P305 HydrophobicContact CD1-CG 4.34Å; L293-P305 HydrophobicContact CD2-CB 4.42Å; L293-P305 HydrophobicContact CD2-CG 4.12Å; L293-F307 WeakPolarHBondContact CA-O 3.48Å; L293-I308 HydrophobicContact CD2-CB 4.11Å; L293-I308 HydrophobicContact CD2-CG1 4.02Å; L293-I308 HydrophobicContact CD2-CG2 3.69Å
294	M	93.2	Very high	84.8	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.015	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.3	172	-161.9	153.6	66.1	0	0	109.3	L273 L274 E306 F307 L320	L273-M294 HydrophobicContact CB-CG 4.35Å; L273-M294 HydrophobicContact CB-SD 4.36Å; L273-M294 HydrophobicContact CD1-CE 4.08Å; L273-M294 HydrophobicContact CD1-SD 4.23Å; L273-M294 HydrophobicContact CD2-CG 4.49Å; L274-M294 CarbonylContact O-C 3.56Å; L274-M294 WeakPolarHBondContact O-CA 3.18Å; M294-E306 PolarHBondContact O-N 2.81Å; M294-F307 HydrophobicContact CB-CB 3.99Å; M294-F307 HydrophobicContact CB-CD2 4.31Å; M294-F307 HydrophobicContact CE-CB 4.17Å; M294-F307 HydrophobicContact CE-CD2 3.03Å; M294-F307 HydrophobicContact CE-CE2 3.45Å; M294-F307 VanDerWaalsContact CE-CE2 3.45Å; M294-F307 HydrophobicContact CE-CG 3.79Å; M294-F307 PolarHBondContact N-O 2.81Å; M294-F307 PolarHBondContact O-N 2.91Å; M294-L320 HydrophobicContact SD-CD2 4.44Å
295	W	92.5	Very high	85.3	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	151.6	-179.2	-57.9	101.3	0	0	0	110.6	F250 D252 L273 L274 T276 Y278 L293 P305	F250-W295 HydrophobicContact CB-CD2 3.58Å; F250-W295 HydrophobicContact CB-CE3 3.66Å; F250-W295 HydrophobicContact CB-CG 4.01Å; F250-W295 HydrophobicContact CB-CH2 4.2Å; F250-W295 HydrophobicContact CB-CZ2 4.19Å; F250-W295 HydrophobicContact CB-CZ3 3.98Å; F250-W295 HydrophobicContact CD1-CB 4.21Å; F250-W295 HydrophobicContact CD1-CD2 4.17Å; F250-W295 AromaticContact CD1-CE3 3.72Å; F250-W295 HydrophobicContact CD1-CE3 3.72Å; F250-W295 HydrophobicContact CD1-CG 4.4Å; F250-W295 HydrophobicContact CD1-CZ3 4.37Å; F250-W295 HydrophobicContact CD2-CB 3.96Å; F250-W295 HydrophobicContact CD2-CG 4.16Å; F250-W295 HydrophobicContact CE1-CB 4.4Å; F250-W295 HydrophobicContact CE2-CB 4.14Å; F250-W295 HydrophobicContact CG-CB 3.99Å; F250-W295 AromaticContact CG-CD2 3.86Å; F250-W295 HydrophobicContact CG-CD2 3.86Å; F250-W295 AromaticContact CG-CE3 3.86Å; F250-W295 HydrophobicContact CG-CE3 3.86Å; F250-W295 AromaticContact CG-CG 3.93Å; F250-W295 HydrophobicContact CG-CG 3.93Å; F250-W295 HydrophobicContact CZ-CB 4.37Å; D252-W295 HydrophobicContact CB-CH2 3.77Å; L273-W295 WeakPolarHBondContact CA-O 3.17Å; L274-W295 HydrophobicContact CB-CB 4.48Å; L274-W295 PolarHBondContact N-O 2.89Å; L274-W295 PolarHBondContact O-N 3.44Å; T276-W295 VanDerWaalsContact OG1-CD1 3.28Å; T276-W295 PolarHBondContact OG1-NE1 3.39Å; Y278-W295 PolarHBondContact OH-NE1 3.05Å; L293-W295 HydrophobicContact CB-CZ2 4.28Å; L293-W295 HydrophobicContact CD1-CH2 4.37Å; L293-W295 HydrophobicContact CD1-CZ2 3.64Å; W295-P305 HydrophobicContact CD2-CB 4.17Å; W295-P305 HydrophobicContact CE3-CB 3.84Å; W295-P305 HydrophobicContact CH2-CB 3.99Å; W295-P305 HydrophobicContact CH2-CG 4.24Å; W295-P305 HydrophobicContact CZ2-CB 4.27Å; W295-P305 HydrophobicContact CZ3-CB 3.75Å; W295-P305 HydrophobicContact CZ3-CG 4.28Å
296	N	89.6	Confident	85.7	Confident	14 Å²	14	52.4 Å²	52.4	8%	0.075	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.6	179.4	-167.3	-31.7	0	0	0	110.1	L273 K298 Y299 E306	L273-N296 HydrophobicContact CD2-CB 4.07Å; N296-K298 PolarHBondContact O-N 2.81Å; N296-K298 VanDerWaalsContact O-N 3.16Å; N296-K298 VanDerWaalsContact OD1-CB 3.3Å; N296-K298 WeakPolarHBondContact OD1-CB 3.48Å; N296-K298 PolarHBondContact OD1-N 2.75Å; N296-Y299 HydrophobicContact CB-CD2 3.93Å; N296-Y299 HydrophobicContact CB-CE2 4.35Å; N296-Y299 PolarHBondContact O-N 2.72Å; N296-Y299 VanDerWaalsContact O-N 3.14Å; N296-E306 WeakPolarHBondContact CB-OE2 3.32Å; N296-E306 PolarHBondContact ND2-OE2 3.03Å
297	M	85.4	Confident	86.2	Confident	29 Å²	29	46 Å²	46	14%	0.143	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.4	178.5	-70.7	-65.1	-72.5	0	0	113.9	N248 F250 W266 E272 Y299 V600	N248-M297 HydrophobicContact CB-CE 4.16Å; N248-M297 HydrophobicContact CB-SD 4.15Å; N248-M297 WeakPolarHBondContact ND2-CE 3.41Å; N248-M297 PolarHBondContact ND2-O 3.43Å; N248-M297 PolarHBondContact ND2-SD 2.77Å; F250-M297 HydrophobicContact CE2-SD 3.57Å; F250-M297 VanDerWaalsContact CE2-SD 3.57Å; F250-M297 HydrophobicContact CZ-SD 3.78Å; W266-M297 HydrophobicContact CH2-CE 4.48Å; W266-M297 HydrophobicContact CH2-CG 3.95Å; W266-M297 HydrophobicContact CH2-SD 4.06Å; W266-M297 HydrophobicContact CZ3-CG 3.81Å; W266-M297 HydrophobicContact CZ3-SD 4.49Å; E272-M297 HydrophobicContact CB-CB 4.3Å; E272-M297 WeakPolarHBondContact O-CB 3.3Å; E272-M297 WeakPolarHBondContact O-CG 3.43Å; E272-M297 PolarHBondContact O-N 2.97Å; M297-Y299 PolarHBondContact O-N 2.85Å; M297-V600 HydrophobicContact CE-CB 3.84Å; M297-V600 HydrophobicContact CE-CG1 3.48Å; M297-V600 VanDerWaalsContact CE-CG1 3.48Å; M297-V600 HydrophobicContact CE-CG2 4.22Å; M297-V600 HydrophobicContact SD-CB 3.99Å; M297-V600 HydrophobicContact SD-CG1 4.03Å; M297-V600 HydrophobicContact SD-CG2 3.68Å
298	K	82.6	Confident	86.5	Confident	72 Å²	72	44.7 Å²	44.7	31%	0.313	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-15.4	178.2	-66.5	173.1	176.5	162.3	0	113.2	E272 N296 P300	E272-K298 HydrophobicContact CB-CD 4.36Å; E272-K298 HydrophobicContact CB-CG 4.16Å; E272-K298 HydrophobicContact CG-CD 4.1Å; E272-K298 HydrophobicContact CG-CG 4.38Å; E272-K298 IonicContact OE1-NZ 3.99Å; E272-K298 PolarHBondContact OE1-NZ 2.91Å; N296-K298 PolarHBondContact O-N 2.81Å; N296-K298 VanDerWaalsContact O-N 3.16Å; N296-K298 VanDerWaalsContact OD1-CB 3.3Å; N296-K298 WeakPolarHBondContact OD1-CB 3.48Å; N296-K298 PolarHBondContact OD1-N 2.75Å; K298-P300 VanDerWaalsContact C-CD 3.42Å; K298-P300 VanDerWaalsContact O-CD 3.3Å; K298-P300 WeakPolarHBondContact O-CD 3.24Å
299	Y	79.4	Confident	86.8	Confident	35 Å²	35	43.2 Å²	43.2	14%	0.137	21%	0.209	C	C	.	.			trans	-120	66.7	-176.4	-50.6	-42.8	0	0	0	111.8	R217 C220 N296 M297 K301 K302	R217-Y299 HydrophobicContact CB-CE1 3.77Å; R217-Y299 WeakPolarHBondContact CB-OH 3.33Å; R217-Y299 HydrophobicContact CG-CE1 3.91Å; C220-Y299 HydrophobicContact CB-CD1 3.53Å; C220-Y299 HydrophobicContact CB-CE1 4.35Å; C220-Y299 HydrophobicContact CB-CG 4.38Å; N296-Y299 HydrophobicContact CB-CD2 3.93Å; N296-Y299 HydrophobicContact CB-CE2 4.35Å; N296-Y299 PolarHBondContact O-N 2.72Å; N296-Y299 VanDerWaalsContact O-N 3.14Å; M297-Y299 PolarHBondContact O-N 2.85Å; Y299-K301 VanDerWaalsContact C-N 3.34Å; Y299-K301 PolarHBondContact O-N 3.5Å; Y299-K302 HydrophobicContact CD2-CD 4.43Å; Y299-K302 HydrophobicContact CG-CD 4.48Å; Y299-K302 WeakPolarHBondContact O-CB 3.31Å; Y299-K302 PolarHBondContact O-N 3.37Å
300	P	71.9	Confident	86.9	Confident	44 Å²	44	39.7 Å²	39.7	29%	0.286	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-35.6	-170.9	28	-37.7	0	0	0	113.6	N248 K298 K302	N248-P300 WeakPolarHBondContact OD1-CB 3.4Å; K298-P300 VanDerWaalsContact C-CD 3.42Å; K298-P300 VanDerWaalsContact O-CD 3.3Å; K298-P300 WeakPolarHBondContact O-CD 3.24Å; P300-K302 PolarHBondContact O-N 2.94Å
301	K	71.4	Confident	87	Confident	187 Å²	187	39.9 Å²	39.9	81%	0.813	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-8.5	178.7	-64	178.7	-178	170.8	0	112.9	Y299 L303	Y299-K301 VanDerWaalsContact C-N 3.34Å; Y299-K301 PolarHBondContact O-N 3.5Å; K301-L303 PolarHBondContact O-N 3.27Å
302	K	75.7	Confident	86.8	Confident	58 Å²	58	46.5 Å²	46.5	25%	0.252	23%	0.225	S	C	.	.			trans	-91.3	104.8	-177.1	-173.2	174.4	178.7	170.7	0	109.3	E216 Y299 P300 T304	E216-K302 IonicContact OE2-NZ 3.37Å; E216-K302 PolarHBondContact OE2-NZ 2.88Å; Y299-K302 HydrophobicContact CD2-CD 4.43Å; Y299-K302 HydrophobicContact CG-CD 4.48Å; Y299-K302 WeakPolarHBondContact O-CB 3.31Å; Y299-K302 PolarHBondContact O-N 3.37Å; P300-K302 PolarHBondContact O-N 2.94Å; K302-T304 WeakPolarHBondContact CE-OG1 3.22Å; K302-T304 WeakPolarHBondContact CG-OG1 3.44Å; K302-T304 PolarHBondContact O-N 2.89Å
303	L	80.2	Confident	86.8	Confident	97 Å²	97	47.1 Å²	47.1	51%	0.508	23%	0.229	S	C	.	.			trans	-75.2	1.5	174.4	-66.1	-178.2	0	0	0	113.8	F251 D252 K301	F251-L303 VanDerWaalsContact O-CB 3.28Å; F251-L303 WeakPolarHBondContact O-CB 3.43Å; F251-L303 WeakPolarHBondContact O-CD2 3.22Å; D252-L303 WeakPolarHBondContact CB-O 3.38Å; K301-L303 PolarHBondContact O-N 3.27Å
304	T	86	Confident	86.8	Confident	78 Å²	78	47.4 Å²	47.4	48%	0.479	23%	0.231	S	C	.	.	S	Bend	trans	-99.6	125.6	178.2	48.3	0	0	0	0	110.5	K302	K302-T304 WeakPolarHBondContact CE-OG1 3.22Å; K302-T304 WeakPolarHBondContact CG-OG1 3.44Å; K302-T304 PolarHBondContact O-N 2.89Å
305	P	89	Confident	86.9	Confident	12 Å²	12	47.3 Å²	47.3	8%	0.078	23%	0.23	C	C	.	.			trans	-66.4	151.3	-179.6	27.7	-35.8	0	0	0	111.4	D252 L293 W295 I308	D252-P305 VanDerWaalsContact OD2-CD 3.32Å; D252-P305 WeakPolarHBondContact OD2-CD 3.27Å; L293-P305 HydrophobicContact CB-CB 4.07Å; L293-P305 HydrophobicContact CD1-CG 4.34Å; L293-P305 HydrophobicContact CD2-CB 4.42Å; L293-P305 HydrophobicContact CD2-CG 4.12Å; W295-P305 HydrophobicContact CD2-CB 4.17Å; W295-P305 HydrophobicContact CE3-CB 3.84Å; W295-P305 HydrophobicContact CH2-CB 3.99Å; W295-P305 HydrophobicContact CH2-CG 4.24Å; W295-P305 HydrophobicContact CZ2-CB 4.27Å; W295-P305 HydrophobicContact CZ3-CB 3.75Å; W295-P305 HydrophobicContact CZ3-CG 4.28Å; P305-I308 HydrophobicContact CB-CG1 4.36Å; P305-I308 HydrophobicContact CG-CD1 4.02Å; P305-I308 HydrophobicContact CG-CG1 3.63Å
306	E	87.2	Confident	87	Confident	83 Å²	83	48 Å²	48	39%	0.388	24%	0.235	S	C	.	.	S	Bend	trans	-72.4	-45.5	180	-171.3	177.6	158.9	0	0	111.2	L273 M294 N296	L273-E306 VanDerWaalsContact CD2-OE2 3.31Å; L273-E306 WeakPolarHBondContact CD2-OE2 3.31Å; M294-E306 PolarHBondContact O-N 2.81Å; N296-E306 WeakPolarHBondContact CB-OE2 3.32Å; N296-E306 PolarHBondContact ND2-OE2 3.03Å
307	F	90.6	Very high	87.2	Confident	59 Å²	59	47.9 Å²	47.9	26%	0.259	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143	175.3	-61	-89.1	0	0	0	110.9	L293 M294 F309	L293-F307 WeakPolarHBondContact CA-O 3.48Å; M294-F307 HydrophobicContact CB-CB 3.99Å; M294-F307 HydrophobicContact CB-CD2 4.31Å; M294-F307 HydrophobicContact CE-CB 4.17Å; M294-F307 HydrophobicContact CE-CD2 3.03Å; M294-F307 HydrophobicContact CE-CE2 3.45Å; M294-F307 VanDerWaalsContact CE-CE2 3.45Å; M294-F307 HydrophobicContact CE-CG 3.79Å; M294-F307 PolarHBondContact N-O 2.81Å; M294-F307 PolarHBondContact O-N 2.91Å; F307-F309 HydrophobicContact CB-CE2 3.96Å; F307-F309 HydrophobicContact CB-CZ 3.92Å; F307-F309 HydrophobicContact CG-CZ 4.5Å
308	I	92.6	Very high	87.6	Confident	29 Å²	29	47 Å²	47	15%	0.149	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	119	-177.7	-54.4	164.2	0	0	0	107.4	W255 L293 P305 H310 R347	W255-I308 HydrophobicContact CD2-CG2 4.06Å; W255-I308 HydrophobicContact CG-CG2 4.25Å; W255-I308 HydrophobicContact CZ2-CG2 4.41Å; L293-I308 HydrophobicContact CD2-CB 4.11Å; L293-I308 HydrophobicContact CD2-CG1 4.02Å; L293-I308 HydrophobicContact CD2-CG2 3.69Å; P305-I308 HydrophobicContact CB-CG1 4.36Å; P305-I308 HydrophobicContact CG-CD1 4.02Å; P305-I308 HydrophobicContact CG-CG1 3.63Å; I308-H310 VanDerWaalsContact CG2-CE1 3.42Å; I308-H310 WeakPolarHBondContact CG2-CE1 3.36Å; I308-H310 WeakPolarHBondContact CG2-NE2 3.41Å; I308-H310 PolarHBondContact O-CE1 3.01Å; I308-R347 WeakPolarHBondContact O-CB 3.36Å
309	F	94.5	Very high	88.1	Confident	7 Å²	7	44.1 Å²	44.1	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.5	177.6	-56.9	-63.9	0	0	0	110.3	V291 C292 F307 V328 W340	V291-F309 WeakPolarHBondContact CA-O 3.38Å; C292-F309 HydrophobicContact CB-CB 4.12Å; C292-F309 HydrophobicContact CB-CD2 4.34Å; C292-F309 PolarHBondContact N-O 3.31Å; C292-F309 WeakPolarHBondContact O-CB 3.4Å; C292-F309 PolarHBondContact O-N 3.42Å; F307-F309 HydrophobicContact CB-CE2 3.96Å; F307-F309 HydrophobicContact CB-CZ 3.92Å; F307-F309 HydrophobicContact CG-CZ 4.5Å; F309-V328 HydrophobicContact CD2-CG2 4.45Å; F309-V328 HydrophobicContact CE2-CG2 3.75Å; F309-V328 HydrophobicContact CZ-CG2 4.15Å; F309-W340 HydrophobicContact CB-CB 4.47Å; F309-W340 HydrophobicContact CB-CD2 3.92Å; F309-W340 HydrophobicContact CB-CG 3.82Å; F309-W340 HydrophobicContact CD1-CB 3.55Å; F309-W340 AromaticContact CD1-CD1 3.73Å; F309-W340 AromaticContact CD1-CG 3.73Å; F309-W340 HydrophobicContact CD1-CG 3.73Å; F309-W340 HydrophobicContact CD2-CB 4.45Å; F309-W340 HydrophobicContact CE1-CB 3.78Å; F309-W340 HydrophobicContact CE1-CG 4.45Å; F309-W340 HydrophobicContact CG-CB 3.91Å; F309-W340 AromaticContact CG-CD1 3.95Å; F309-W340 HydrophobicContact CG-CD2 4.24Å; F309-W340 AromaticContact CG-CG 3.8Å; F309-W340 HydrophobicContact CG-CG 3.8Å; F309-W340 HydrophobicContact CZ-CB 4.32Å
310	H	91.5	Very high	88.8	Confident	25 Å²	25	42.8 Å²	42.8	12%	0.116	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144.5	-174.8	-36.8	60.5	0	0	0	108.8	W255 P288 G290 I308 W340 R347 P349	W255-H310 AromaticContact CH2-CD2 3.35Å; W255-H310 WeakPolarHBondContact CH2-CD2 3.28Å; W255-H310 AromaticContact CH2-NE2 3.24Å; W255-H310 WeakPolarHBondContact CH2-NE2 3.47Å; W255-H310 AromaticContact CZ2-NE2 3.49Å; W255-H310 WeakPolarHBondContact CZ2-NE2 3.33Å; W255-H310 AromaticContact CZ3-CD2 3.46Å; W255-H310 VanDerWaalsContact CZ3-CD2 3.46Å; W255-H310 WeakPolarHBondContact CZ3-CD2 3.13Å; W255-H310 AromaticContact CZ3-NE2 3.73Å; P288-H310 HydrophobicContact CB-CB 4.09Å; P288-H310 HydrophobicContact CG-CB 3.96Å; G290-H310 CarbonylContact O-C 3.53Å; I308-H310 VanDerWaalsContact CG2-CE1 3.42Å; I308-H310 WeakPolarHBondContact CG2-CE1 3.36Å; I308-H310 WeakPolarHBondContact CG2-NE2 3.41Å; I308-H310 PolarHBondContact O-CE1 3.01Å; H310-W340 PolarHBondContact O-NE1 3.26Å; H310-R347 WeakPolarHBondContact CE1-CB 3.42Å; H310-R347 WeakPolarHBondContact CE1-CD 3.46Å; H310-R347 PolarHBondContact N-O 2.82Å; H310-R347 WeakPolarHBondContact ND1-CB 3.38Å; H310-R347 PolarHBondContact ND1-O 2.93Å; H310-P349 VanDerWaalsContact O-CD 3.23Å; H310-P349 WeakPolarHBondContact O-CD 3.22Å
311	C	91.3	Very high	89.6	Confident	3 Å²	3	41 Å²	41	2%	0.02	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	152.2	173.4	-159.6	0	0	0	0	110.1	P288 G290 S313 V315 T332 W340	P288-C311 WeakPolarHBondContact CB-O 3.41Å; G290-C311 PolarHBondContact N-O 3.26Å; G290-C311 PolarHBondContact O-N 3.38Å; C311-S313 VanDerWaalsContact C-N 3.3Å; C311-S313 VanDerWaalsContact CB-O 3.31Å; C311-S313 WeakPolarHBondContact CB-O 3.43Å; C311-S313 PolarHBondContact SG-O 3.1Å; C311-V315 HydrophobicContact CB-CG2 4.05Å; C311-T332 VanDerWaalsContact SG-CG2 3.6Å; C311-W340 HydrophobicContact CB-CZ2 4.02Å
312	Q	90.8	Very high	90.4	Very high	139 Å²	139	38.5 Å²	38.5	65%	0.65	19%	0.19	S	C	*	.	S	Bend	trans	-80.3	-13.5	173.7	-73.9	172	-21.1	0	0	113
313	S	93.1	Very high	90.9	Very high	13 Å²	13	37.7 Å²	37.7	9%	0.091	19%	0.187	C	C	.	.	S	Bend	trans	-122	150.9	177.2	173.1	0	0	0	0	108.6	G290 C311 V315 S334	G290-S313 WeakPolarHBondContact CA-O 3.45Å; G290-S313 PolarHBondContact N-O 3.46Å; C311-S313 VanDerWaalsContact C-N 3.3Å; C311-S313 VanDerWaalsContact CB-O 3.31Å; C311-S313 WeakPolarHBondContact CB-O 3.43Å; C311-S313 PolarHBondContact SG-O 3.1Å; S313-V315 PolarHBondContact O-N 3.46Å; S313-S334 WeakPolarHBondContact OG-CB 3.48Å; S313-S334 PolarHBondContact OG-N 3.24Å; S313-S334 VanDerWaalsContact OG-N 3.12Å; S313-S334 PolarHBondContact OG-OG 3.07Å
314	P	94.5	Very high	91.3	Very high	7 Å²	7	36.1 Å²	36.1	5%	0.045	18%	0.177	C	C	.	.			trans	-58.4	138.3	178.6	-19.2	30.8	0	0	0	110.6	H279 M280 E289 T332 Y333	H279-P314 WeakPolarHBondContact NE2-CB 3.48Å; M280-P314 HydrophobicContact CB-CB 4.5Å; M280-P314 HydrophobicContact CB-CG 4.17Å; M280-P314 HydrophobicContact SD-CG 4.35Å; E289-P314 HydrophobicContact CB-CG 4.12Å; E289-P314 VanDerWaalsContact OE2-CD 3.32Å; E289-P314 WeakPolarHBondContact OE2-CD 3.41Å; P314-T332 CarbonylContact O-C 3.56Å; P314-T332 VanDerWaalsContact O-CA 3.24Å; P314-T332 WeakPolarHBondContact O-CA 3.35Å; P314-T332 WeakPolarHBondContact O-CB 3.24Å; P314-Y333 PolarHBondContact O-N 2.82Å
315	V	95	Very high	91.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.3	176.8	-177.1	0	0	0	0	108.1	T262 A277 C311 S313 S317 A318 G331 W340	T262-V315 WeakPolarHBondContact CB-O 3.32Å; T262-V315 PolarHBondContact OG1-O 3.42Å; A277-V315 HydrophobicContact CB-CB 4.44Å; A277-V315 HydrophobicContact CB-CG1 3.84Å; C311-V315 HydrophobicContact CB-CG2 4.05Å; S313-V315 PolarHBondContact O-N 3.46Å; V315-S317 WeakPolarHBondContact CG1-O 3.31Å; V315-A318 HydrophobicContact CG1-CB 4.29Å; V315-G331 WeakPolarHBondContact CA-O 3.49Å; V315-G331 WeakPolarHBondContact CG1-O 3.41Å; V315-W340 HydrophobicContact CG2-CH2 3.86Å; V315-W340 HydrophobicContact CG2-CZ2 4.45Å
316	T	94.7	Very high	91.3	Very high	17 Å²	17	34.9 Å²	34.9	10%	0.104	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-33.2	-177.7	41.7	0	0	0	0	111.9	T262 G331 Y333 V364	T262-T316 WeakPolarHBondContact CB-O 3.3Å; T316-G331 PolarHBondContact N-O 3.18Å; T316-G331 PolarHBondContact OG1-O 3.13Å; T316-G331 VanDerWaalsContact OG1-O 3.05Å; T316-Y333 HydrophobicContact CG2-CD2 4.17Å; T316-V364 WeakPolarHBondContact CB-O 3.14Å; T316-V364 PolarHBondContact OG1-O 3.48Å
317	S	94	Very high	91.6	Very high	12 Å²	12	31.8 Å²	31.8	8%	0.084	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	148.6	173.5	51.5	0	0	0	0	109.8	V315 G330 G331 V364 F365 I367	V315-S317 WeakPolarHBondContact CG1-O 3.31Å; S317-G330 CarbonylContact O-C 3.5Å; S317-G330 WeakPolarHBondContact O-CA 3.38Å; S317-G331 PolarHBondContact O-N 3.36Å; S317-V364 PolarHBondContact OG-O 3.25Å; S317-F365 VanDerWaalsContact CB-O 3.3Å; S317-F365 WeakPolarHBondContact CB-O 3.3Å; S317-F365 PolarHBondContact OG-O 2.85Å; S317-I367 WeakPolarHBondContact OG-CG2 3.21Å; S317-I367 PolarHBondContact OG-N 3.49Å
318	A	93.7	Very high	91.8	Very high	9 Å²	9	29 Å²	29	7%	0.074	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	146	171.4	0	0	0	0	0	109.9	L275 A277 V315 V329	L275-A318 HydrophobicContact CD2-CB 3.7Å; L275-A318 HydrophobicContact CG-CB 4.42Å; A277-A318 HydrophobicContact CB-CB 3.74Å; V315-A318 HydrophobicContact CG1-CB 4.29Å; A318-V329 CarbonylContact C-O 3.53Å; A318-V329 VanDerWaalsContact CA-O 3.31Å; A318-V329 WeakPolarHBondContact CA-O 3.41Å
319	S	93.1	Very high	91.9	Very high	13 Å²	13	27.9 Å²	27.9	9%	0.091	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	143.7	177.5	-179.4	0	0	0	0	110.1	D265 V329	D265-S319 WeakPolarHBondContact OD2-CA 3.2Å; D265-S319 WeakPolarHBondContact OD2-CB 3.5Å; D265-S319 PolarHBondContact OD2-OG 3.1Å; S319-V329 PolarHBondContact N-O 3.49Å; S319-V329 PolarHBondContact O-N 2.98Å
320	L	93.2	Very high	91.9	Very high	7 Å²	7	27.5 Å²	27.5	4%	0.037	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	144.3	174.9	-69.2	174.4	0	0	0	110.3	D265 L275 M294 R322 V328	D265-L320 PolarHBondContact OD2-N 2.96Å; L275-L320 HydrophobicContact CB-CD1 3.71Å; L275-L320 HydrophobicContact CB-CD2 4.01Å; L275-L320 HydrophobicContact CB-CG 3.71Å; L275-L320 HydrophobicContact CD1-CD2 4.44Å; L275-L320 HydrophobicContact CD2-CD2 3.81Å; L275-L320 HydrophobicContact CD2-CG 3.74Å; L275-L320 HydrophobicContact CG-CD2 4.32Å; L275-L320 HydrophobicContact CG-CG 4.31Å; M294-L320 HydrophobicContact SD-CD2 4.44Å; L320-R322 PolarHBondContact O-N 3.12Å; L320-V328 HydrophobicContact CD2-CB 4.26Å; L320-V328 HydrophobicContact CD2-CG1 4.19Å; L320-V328 HydrophobicContact CD2-CG2 3.6Å
321	S	90.3	Very high	92	Very high	5 Å²	5	26.3 Å²	26.3	4%	0.035	13%	0.13	C	C	.	.			trans	-70.8	124.3	172.5	175.6	0	0	0	0	110.8	F323 H324 I327 L369	S321-F323 PolarHBondContact O-N 3.19Å; S321-F323 PolarHBondContact OG-N 3.06Å; S321-H324 WeakPolarHBondContact CB-O 3.22Å; S321-H324 PolarHBondContact OG-N 2.97Å; S321-H324 VanDerWaalsContact OG-N 3.07Å; S321-I327 PolarHBondContact N-O 3.42Å; S321-I327 VanDerWaalsContact N-O 3.17Å; S321-L369 WeakPolarHBondContact OG-CD2 3.37Å
322	R	86.8	Confident	92.2	Very high	135 Å²	135	26.2 Å²	26.2	51%	0.509	13%	0.129	S	C	.	.	S	Bend	trans	-66.7	-19	174.4	-58.9	-174.3	-174.5	-177.4	2.3	113.4	T268 L320	T268-R322 HydrophobicContact CG2-CG 4.18Å; T268-R322 PolarHBondContact OG1-O 3.15Å; L320-R322 PolarHBondContact O-N 3.12Å
323	F	86.9	Confident	92.3	Very high	42 Å²	42	25.8 Å²	25.8	18%	0.184	12%	0.122	C	C	.	.	S	Bend	trans	-106.9	-28.5	-174.5	-47.4	-63.2	0	0	0	113.1	S321 L369 G371 Q373 H376	S321-F323 PolarHBondContact O-N 3.19Å; S321-F323 PolarHBondContact OG-N 3.06Å; F323-L369 HydrophobicContact CD2-CD2 3.75Å; F323-L369 HydrophobicContact CE2-CD2 3.99Å; F323-L369 HydrophobicContact CE2-CG 4.34Å; F323-G371 VanDerWaalsContact CZ-C 3.47Å; F323-G371 WeakPolarHBondContact CZ-O 3.5Å; F323-Q373 HydrophobicContact CB-CB 4.44Å; F323-Q373 HydrophobicContact CB-CG 4.37Å; F323-Q373 HydrophobicContact CD1-CB 4.07Å; F323-Q373 HydrophobicContact CG-CB 4.42Å; F323-H376 HydrophobicContact CD2-CB 3.6Å; F323-H376 AromaticContact CD2-CG 3.81Å; F323-H376 HydrophobicContact CE2-CB 3.47Å; F323-H376 VanDerWaalsContact CE2-CB 3.47Å
324	H	88.4	Confident	92.3	Very high	63 Å²	63	27 Å²	27	29%	0.292	13%	0.13	S	C	.	.			trans	-124.9	104.8	-177.8	-63.4	-53.5	0	0	0	109.6	S321 N326 I327 H376	S321-H324 WeakPolarHBondContact CB-O 3.22Å; S321-H324 PolarHBondContact OG-N 2.97Å; S321-H324 VanDerWaalsContact OG-N 3.07Å; H324-N326 PolarHBondContact O-N 2.66Å; H324-I327 HydrophobicContact CB-CB 4.19Å; H324-I327 HydrophobicContact CB-CG1 3.79Å; H324-I327 PolarHBondContact O-N 3.23Å; H324-H376 AromaticContact CD2-CE1 3.94Å; H324-H376 AromaticContact NE2-CE1 3.52Å
325	P	86.5	Confident	92.2	Very high	30 Å²	30	26.6 Å²	26.6	20%	0.195	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-18	-168.3	23.3	-30.1	0	0	0	114	I269 F270	I269-P325 HydrophobicContact CB-CB 4.11Å; I269-P325 HydrophobicContact CD1-CB 3.71Å; I269-P325 HydrophobicContact CD1-CG 3.88Å; I269-P325 HydrophobicContact CG1-CB 4.49Å; I269-P325 HydrophobicContact CG2-CB 4.14Å; I269-P325 HydrophobicContact CG2-CG 4.4Å; F270-P325 HydrophobicContact CD2-CB 3.82Å; F270-P325 HydrophobicContact CE2-CB 3.49Å; F270-P325 VanDerWaalsContact CE2-CB 3.49Å; F270-P325 HydrophobicContact CE2-CG 4.01Å; F270-P325 HydrophobicContact CZ-CB 4.43Å
326	N	89.6	Confident	92.1	Very high	35 Å²	35	28.6 Å²	28.6	19%	0.187	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-5.2	-173.4	-64.3	21.8	0	0	0	112.3	H324 D341 S342 R343	H324-N326 PolarHBondContact O-N 2.66Å; N326-D341 CarbonylContact O-C 3.55Å; N326-D341 WeakPolarHBondContact O-CA 3.46Å; N326-S342 VanDerWaalsContact CA-OG 3.32Å; N326-S342 WeakPolarHBondContact CA-OG 3.4Å; N326-S342 WeakPolarHBondContact CB-OG 3.18Å; N326-S342 PolarHBondContact O-N 2.81Å; N326-S342 PolarHBondContact O-OG 2.65Å; N326-R343 HydrophobicContact CB-CG 3.94Å; N326-R343 WeakPolarHBondContact ND2-CG 3.36Å; N326-R343 PolarHBondContact ND2-NE 3.05Å
327	I	92.9	Very high	92.1	Very high	18 Å²	18	27.8 Å²	27.8	9%	0.092	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126	-175.1	-55.2	-61.1	0	0	0	110.3	S321 H324 V329 L339 W340 D341 L392	S321-I327 PolarHBondContact N-O 3.42Å; S321-I327 VanDerWaalsContact N-O 3.17Å; H324-I327 HydrophobicContact CB-CB 4.19Å; H324-I327 HydrophobicContact CB-CG1 3.79Å; H324-I327 PolarHBondContact O-N 3.23Å; I327-V329 HydrophobicContact CG2-CG2 4.44Å; I327-L339 HydrophobicContact CD1-CD2 4.4Å; I327-L339 HydrophobicContact CG2-CD1 3.95Å; I327-L339 HydrophobicContact CG2-CD2 4.03Å; I327-L339 HydrophobicContact CG2-CG 3.84Å; I327-W340 WeakPolarHBondContact CA-O 3.36Å; I327-D341 HydrophobicContact CD1-CB 3.75Å; I327-L392 HydrophobicContact CG2-CD1 3.93Å; I327-L392 HydrophobicContact CG2-CD2 4.39Å
328	V	93.7	Very high	92	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.7	177.3	-173.2	0	0	0	0	108.8	L275 F309 L320 L339 W340	L275-V328 HydrophobicContact CD1-CG1 3.73Å; L275-V328 HydrophobicContact CD2-CG1 3.53Å; L275-V328 HydrophobicContact CG-CG1 4.3Å; F309-V328 HydrophobicContact CD2-CG2 4.45Å; F309-V328 HydrophobicContact CE2-CG2 3.75Å; F309-V328 HydrophobicContact CZ-CG2 4.15Å; L320-V328 HydrophobicContact CD2-CB 4.26Å; L320-V328 HydrophobicContact CD2-CG1 4.19Å; L320-V328 HydrophobicContact CD2-CG2 3.6Å; V328-L339 WeakPolarHBondContact O-CA 3.3Å; V328-W340 HydrophobicContact CB-CB 4.26Å; V328-W340 HydrophobicContact CB-CE3 4.18Å; V328-W340 HydrophobicContact CG1-CE3 3.92Å; V328-W340 HydrophobicContact CG1-CZ3 4.39Å; V328-W340 PolarHBondContact N-O 3.11Å; V328-W340 PolarHBondContact O-N 2.67Å
329	V	94.7	Very high	92.1	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.024	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.1	179.3	-174.2	0	0	0	0	108.7	A318 S319 I327 I337 I367 I378 L392	A318-V329 CarbonylContact C-O 3.53Å; A318-V329 VanDerWaalsContact CA-O 3.31Å; A318-V329 WeakPolarHBondContact CA-O 3.41Å; S319-V329 PolarHBondContact N-O 3.49Å; S319-V329 PolarHBondContact O-N 2.98Å; I327-V329 HydrophobicContact CG2-CG2 4.44Å; V329-I337 HydrophobicContact CG1-CG2 4.06Å; V329-I367 HydrophobicContact CG1-CD1 3.46Å; V329-I367 VanDerWaalsContact CG1-CD1 3.46Å; V329-I367 HydrophobicContact CG1-CG1 4.03Å; V329-I378 HydrophobicContact CB-CD1 4.48Å; V329-I378 HydrophobicContact CG1-CD1 3.76Å; V329-I378 HydrophobicContact CG1-CG1 4.18Å; V329-I378 HydrophobicContact CG1-CG2 3.87Å; V329-I378 HydrophobicContact CG2-CD1 3.83Å; V329-I378 HydrophobicContact CG2-CG1 4.21Å; V329-L392 HydrophobicContact CG2-CD1 4.17Å
330	G	94.4	Very high	92.1	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.8	178	0	0	0	0	0	112.5	S317 I337 V338	S317-G330 CarbonylContact O-C 3.5Å; S317-G330 WeakPolarHBondContact O-CA 3.38Å; G330-I337 WeakPolarHBondContact O-CA 3.45Å; G330-V338 PolarHBondContact N-O 3.1Å; G330-V338 WeakPolarHBondContact O-CG2 3.39Å; G330-V338 PolarHBondContact O-N 3.09Å
331	G	94.7	Very high	92.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.4	163.1	0	0	0	0	0	109.8	V315 T316 S317	V315-G331 WeakPolarHBondContact CA-O 3.49Å; V315-G331 WeakPolarHBondContact CG1-O 3.41Å; T316-G331 PolarHBondContact N-O 3.18Å; T316-G331 PolarHBondContact OG1-O 3.13Å; T316-G331 VanDerWaalsContact OG1-O 3.05Å; S317-G331 PolarHBondContact O-N 3.36Å
332	T	94.9	Very high	92	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	159.5	178.9	69.3	0	0	0	0	112.1	C311 P314 S334 G335 Q336 V338 V364	C311-T332 VanDerWaalsContact SG-CG2 3.6Å; P314-T332 CarbonylContact O-C 3.56Å; P314-T332 VanDerWaalsContact O-CA 3.24Å; P314-T332 WeakPolarHBondContact O-CA 3.35Å; P314-T332 WeakPolarHBondContact O-CB 3.24Å; T332-S334 PolarHBondContact O-N 2.98Å; T332-S334 PolarHBondContact OG1-OG 2.68Å; T332-G335 PolarHBondContact O-N 3.4Å; T332-G335 VanDerWaalsContact O-N 3.16Å; T332-Q336 WeakPolarHBondContact CB-O 3.5Å; T332-Q336 WeakPolarHBondContact CG2-O 3.38Å; T332-Q336 PolarHBondContact N-O 2.82Å; T332-Q336 WeakPolarHBondContact OG1-CA 3.46Å; T332-Q336 WeakPolarHBondContact OG1-CB 3.1Å; T332-Q336 PolarHBondContact OG1-N 2.95Å; T332-Q336 VanDerWaalsContact OG1-N 3.1Å; T332-Q336 PolarHBondContact OG1-O 2.7Å; T332-V338 HydrophobicContact CG2-CG1 3.96Å; T332-V338 HydrophobicContact CG2-CG2 3.99Å; T332-V364 PolarHBondContact O-N 3.39Å
333	Y	94	Very high	92	Very high	131 Å²	131	29.1 Å²	29.1	51%	0.514	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-30	176.3	-172.7	-97.1	0	0	0	112.9	P314 T316 G335 P363	P314-Y333 PolarHBondContact O-N 2.82Å; T316-Y333 HydrophobicContact CG2-CD2 4.17Å; Y333-G335 PolarHBondContact O-N 2.72Å; Y333-P363 HydrophobicContact CD2-CB 3.61Å; Y333-P363 HydrophobicContact CD2-CG 4.16Å; Y333-P363 HydrophobicContact CE2-CB 3.94Å; Y333-P363 HydrophobicContact CE2-CG 3.96Å; Y333-P363 HydrophobicContact CG-CB 4.15Å; Y333-P363 WeakPolarHBondContact O-CA 3.46Å; Y333-P363 WeakPolarHBondContact O-CB 3.43Å
334	S	93.2	Very high	92.1	Very high	37 Å²	37	29.8 Å²	29.8	26%	0.259	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.1	176.3	67.5	0	0	0	0	114.3	S313 T332 Q336 L355	S313-S334 WeakPolarHBondContact OG-CB 3.48Å; S313-S334 PolarHBondContact OG-N 3.24Å; S313-S334 VanDerWaalsContact OG-N 3.12Å; S313-S334 PolarHBondContact OG-OG 3.07Å; T332-S334 PolarHBondContact O-N 2.98Å; T332-S334 PolarHBondContact OG1-OG 2.68Å; S334-Q336 PolarHBondContact OG-N 2.8Å; S334-L355 WeakPolarHBondContact O-CD2 3.4Å
335	G	91.4	Very high	91.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	96.2	-2.7	-170.3	0	0	0	0	0	114.2	T332 Y333 H360 H362	T332-G335 PolarHBondContact O-N 3.4Å; T332-G335 VanDerWaalsContact O-N 3.16Å; Y333-G335 PolarHBondContact O-N 2.72Å; G335-H360 WeakPolarHBondContact O-CB 3.43Å; G335-H362 WeakPolarHBondContact CA-O 3.5Å
336	Q	93.1	Very high	91.8	Very high	41 Å²	41	40.5 Å²	40.5	19%	0.192	19%	0.193	C	C	.	.			trans	-75.7	141.7	172.3	-63.1	-175.8	-10.2	0	0	110.8	T332 S334 L355	T332-Q336 WeakPolarHBondContact CB-O 3.5Å; T332-Q336 WeakPolarHBondContact CG2-O 3.38Å; T332-Q336 PolarHBondContact N-O 2.82Å; T332-Q336 WeakPolarHBondContact OG1-CA 3.46Å; T332-Q336 WeakPolarHBondContact OG1-CB 3.1Å; T332-Q336 PolarHBondContact OG1-N 2.95Å; T332-Q336 VanDerWaalsContact OG1-N 3.1Å; T332-Q336 PolarHBondContact OG1-O 2.7Å; S334-Q336 PolarHBondContact OG-N 2.8Å; Q336-L355 HydrophobicContact CG-CD1 4.11Å; Q336-L355 HydrophobicContact CG-CD2 3.54Å; Q336-L355 HydrophobicContact CG-CG 3.62Å
337	I	93.9	Very high	91.8	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.7	166.2	-59.6	170.6	0	0	0	106.8	V329 G330 R352 S353 I367 S380 W390	V329-I337 HydrophobicContact CG1-CG2 4.06Å; G330-I337 WeakPolarHBondContact O-CA 3.45Å; I337-R352 CarbonylContact O-C 3.6Å; I337-R352 WeakPolarHBondContact O-CA 3.43Å; I337-S353 PolarHBondContact N-OG 3.42Å; I337-S353 PolarHBondContact O-N 3.09Å; I337-I367 HydrophobicContact CG1-CD1 4.33Å; I337-I367 HydrophobicContact CG2-CD1 3.71Å; I337-S380 WeakPolarHBondContact CD1-OG 3.2Å; I337-W390 HydrophobicContact CD1-CD2 3.94Å; I337-W390 HydrophobicContact CD1-CG 3.91Å; I337-W390 HydrophobicContact CD1-CZ2 3.96Å
338	V	93.6	Very high	91.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.4	-176	-64.1	0	0	0	0	109.8	G330 T332 W340 P349 R352	G330-V338 PolarHBondContact N-O 3.1Å; G330-V338 WeakPolarHBondContact O-CG2 3.39Å; G330-V338 PolarHBondContact O-N 3.09Å; T332-V338 HydrophobicContact CG2-CG1 3.96Å; T332-V338 HydrophobicContact CG2-CG2 3.99Å; V338-W340 HydrophobicContact CB-CH2 4.41Å; V338-W340 HydrophobicContact CB-CZ2 4.33Å; V338-W340 HydrophobicContact CG2-CE3 4.25Å; V338-W340 HydrophobicContact CG2-CH2 3.22Å; V338-W340 HydrophobicContact CG2-CZ2 3.51Å; V338-W340 HydrophobicContact CG2-CZ3 3.64Å; V338-P349 HydrophobicContact CB-CB 4.07Å; V338-P349 HydrophobicContact CG1-CB 4.48Å; V338-R352 HydrophobicContact CG1-CG 4.17Å
339	L	94	Very high	91.7	Very high	11 Å²	11	48 Å²	48	6%	0.058	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	126.4	178	-172.9	151.5	0	0	0	108.9	I327 V328 P349 V350 Q351 L392 L395	I327-L339 HydrophobicContact CD1-CD2 4.4Å; I327-L339 HydrophobicContact CG2-CD1 3.95Å; I327-L339 HydrophobicContact CG2-CD2 4.03Å; I327-L339 HydrophobicContact CG2-CG 3.84Å; V328-L339 WeakPolarHBondContact O-CA 3.3Å; L339-P349 CarbonylContact O-C 3.52Å; L339-P349 WeakPolarHBondContact O-CA 3.43Å; L339-V350 HydrophobicContact CD2-CB 4.37Å; L339-V350 PolarHBondContact O-N 2.66Å; L339-Q351 HydrophobicContact CB-CB 4.36Å; L339-Q351 PolarHBondContact N-O 3.08Å; L339-Q351 PolarHBondContact O-N 2.63Å; L339-L392 HydrophobicContact CD1-CD1 3.4Å; L339-L392 VanDerWaalsContact CD1-CD1 3.4Å; L339-L392 HydrophobicContact CD1-CG 4.01Å; L339-L395 HydrophobicContact CB-CD1 3.97Å; L339-L395 HydrophobicContact CD1-CD1 4.29Å
340	W	94	Very high	91.5	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	147	171.3	-57.1	-86.5	0	0	0	110.1	C292 F309 H310 C311 V315 I327 V328 V338 P349	C292-W340 HydrophobicContact CB-CH2 4.46Å; C292-W340 HydrophobicContact CB-CZ3 4.4Å; C292-W340 VanDerWaalsContact SG-CH2 3.55Å; F309-W340 HydrophobicContact CB-CB 4.47Å; F309-W340 HydrophobicContact CB-CD2 3.92Å; F309-W340 HydrophobicContact CB-CG 3.82Å; F309-W340 HydrophobicContact CD1-CB 3.55Å; F309-W340 AromaticContact CD1-CD1 3.73Å; F309-W340 AromaticContact CD1-CG 3.73Å; F309-W340 HydrophobicContact CD1-CG 3.73Å; F309-W340 HydrophobicContact CD2-CB 4.45Å; F309-W340 HydrophobicContact CE1-CB 3.78Å; F309-W340 HydrophobicContact CE1-CG 4.45Å; F309-W340 HydrophobicContact CG-CB 3.91Å; F309-W340 AromaticContact CG-CD1 3.95Å; F309-W340 HydrophobicContact CG-CD2 4.24Å; F309-W340 AromaticContact CG-CG 3.8Å; F309-W340 HydrophobicContact CG-CG 3.8Å; F309-W340 HydrophobicContact CZ-CB 4.32Å; H310-W340 PolarHBondContact O-NE1 3.26Å; C311-W340 HydrophobicContact CB-CZ2 4.02Å; V315-W340 HydrophobicContact CG2-CH2 3.86Å; V315-W340 HydrophobicContact CG2-CZ2 4.45Å; I327-W340 WeakPolarHBondContact CA-O 3.36Å; V328-W340 HydrophobicContact CB-CB 4.26Å; V328-W340 HydrophobicContact CB-CE3 4.18Å; V328-W340 HydrophobicContact CG1-CE3 3.92Å; V328-W340 HydrophobicContact CG1-CZ3 4.39Å; V328-W340 PolarHBondContact N-O 3.11Å; V328-W340 PolarHBondContact O-N 2.67Å; V338-W340 HydrophobicContact CB-CH2 4.41Å; V338-W340 HydrophobicContact CB-CZ2 4.33Å; V338-W340 HydrophobicContact CG2-CE3 4.25Å; V338-W340 HydrophobicContact CG2-CH2 3.22Å; V338-W340 HydrophobicContact CG2-CZ2 3.51Å; V338-W340 HydrophobicContact CG2-CZ3 3.64Å; W340-P349 HydrophobicContact CG-CB 4.47Å
341	D	92.9	Very high	91.3	Very high	27 Å²	27	54.6 Å²	54.6	14%	0.144	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121.1	173.3	-174	-14.3	0	0	0	108.1	N326 I327 R343 V344 V350	N326-D341 CarbonylContact O-C 3.55Å; N326-D341 WeakPolarHBondContact O-CA 3.46Å; I327-D341 HydrophobicContact CD1-CB 3.75Å; D341-R343 PolarHBondContact O-N 2.71Å; D341-R343 VanDerWaalsContact OD1-CB 3.23Å; D341-R343 WeakPolarHBondContact OD1-CB 3.47Å; D341-R343 VanDerWaalsContact OD1-CG 3.22Å; D341-R343 WeakPolarHBondContact OD1-CG 3.44Å; D341-R343 PolarHBondContact OD1-N 2.8Å; D341-V344 HydrophobicContact CB-CG2 4.07Å; D341-V344 PolarHBondContact O-N 2.93Å; D341-V344 VanDerWaalsContact O-N 3.12Å; D341-V350 HydrophobicContact CB-CG2 3.9Å
342	S	88.6	Confident	91.2	Very high	14 Å²	14	58.6 Å²	58.6	10%	0.098	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.9	178.6	69.9	0	0	0	0	113.2	N326 V344	N326-S342 VanDerWaalsContact CA-OG 3.32Å; N326-S342 WeakPolarHBondContact CA-OG 3.4Å; N326-S342 WeakPolarHBondContact CB-OG 3.18Å; N326-S342 PolarHBondContact O-N 2.81Å; N326-S342 PolarHBondContact O-OG 2.65Å; S342-V344 VanDerWaalsContact C-N 3.29Å
343	R	87.8	Confident	91.1	Very high	157 Å²	157	58.7 Å²	58.7	59%	0.592	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.7	174.6	-60	169.6	-179.8	170.3	1.5	112.4	N326 D341	N326-R343 HydrophobicContact CB-CG 3.94Å; N326-R343 WeakPolarHBondContact ND2-CG 3.36Å; N326-R343 PolarHBondContact ND2-NE 3.05Å; D341-R343 PolarHBondContact O-N 2.71Å; D341-R343 VanDerWaalsContact OD1-CB 3.23Å; D341-R343 WeakPolarHBondContact OD1-CB 3.47Å; D341-R343 VanDerWaalsContact OD1-CG 3.22Å; D341-R343 WeakPolarHBondContact OD1-CG 3.44Å; D341-R343 PolarHBondContact OD1-N 2.8Å
344	V	88.3	Confident	91	Very high	56 Å²	56	54.8 Å²	54.8	34%	0.339	27%	0.271	S	S	.	.	S	Bend	trans	-89.5	115	-178.8	-177.4	0	0	0	0	107.7	D341 S342 K346 V350	D341-V344 HydrophobicContact CB-CG2 4.07Å; D341-V344 PolarHBondContact O-N 2.93Å; D341-V344 VanDerWaalsContact O-N 3.12Å; S342-V344 VanDerWaalsContact C-N 3.29Å; V344-K346 HydrophobicContact CG1-CB 3.91Å; V344-K346 HydrophobicContact CG1-CD 4.5Å; V344-K346 HydrophobicContact CG1-CG 4.16Å; V344-K346 PolarHBondContact O-N 3.17Å; V344-V350 HydrophobicContact CB-CG2 4.31Å; V344-V350 HydrophobicContact CG2-CG2 4.08Å
345	N	80	Confident	90.7	Very high	165 Å²	165	57.1 Å²	57.1	88%	0.882	28%	0.28	S	S	*	.	S	Bend	trans	-63.6	-0.2	178.7	-74	-8.7	0	0	0	114.5
346	K	88.1	Confident	90.4	Very high	152 Å²	152	59.5 Å²	59.5	66%	0.661	29%	0.294	S	S	*	.			trans	-86.3	130.2	172.5	-62.5	-178.4	179.9	177.4	0	108.6	V344 T348	V344-K346 HydrophobicContact CG1-CB 3.91Å; V344-K346 HydrophobicContact CG1-CD 4.5Å; V344-K346 HydrophobicContact CG1-CG 4.16Å; V344-K346 PolarHBondContact O-N 3.17Å; K346-T348 VanDerWaalsContact C-N 3.29Å; K346-T348 PolarHBondContact O-N 3.17Å
347	R	88.9	Confident	89.8	Confident	120 Å²	120	62.4 Å²	62.4	45%	0.453	32%	0.319	S	S	.	.			trans	-83.3	-5.9	-177	-43.9	-171.1	-174.9	-177	-12.3	114.7	I308 H310	I308-R347 WeakPolarHBondContact O-CB 3.36Å; H310-R347 WeakPolarHBondContact CE1-CB 3.42Å; H310-R347 WeakPolarHBondContact CE1-CD 3.46Å; H310-R347 PolarHBondContact N-O 2.82Å; H310-R347 WeakPolarHBondContact ND1-CB 3.38Å; H310-R347 PolarHBondContact ND1-O 2.93Å
348	T	92.3	Very high	89.1	Confident	78 Å²	78	71.9 Å²	71.9	48%	0.479	36%	0.355	S	S	.	.	S	Bend	trans	-81.8	153.3	173.8	52.9	0	0	0	0	110.5	K346	K346-T348 VanDerWaalsContact C-N 3.29Å; K346-T348 PolarHBondContact O-N 3.17Å
349	P	92.7	Very high	88.7	Confident	13 Å²	13	72 Å²	72	8%	0.084	36%	0.356	C	S	.	.			trans	-59.8	142.2	177.8	28.1	-38.2	0	0	0	111.5	H310 V338 L339 W340 R352	H310-P349 VanDerWaalsContact O-CD 3.23Å; H310-P349 WeakPolarHBondContact O-CD 3.22Å; V338-P349 HydrophobicContact CB-CB 4.07Å; V338-P349 HydrophobicContact CG1-CB 4.48Å; L339-P349 CarbonylContact O-C 3.52Å; L339-P349 WeakPolarHBondContact O-CA 3.43Å; W340-P349 HydrophobicContact CG-CB 4.47Å; P349-R352 HydrophobicContact CB-CG 4.38Å; P349-R352 HydrophobicContact CG-CG 4.08Å
350	V	90.7	Very high	88.5	Confident	83 Å²	83	71.4 Å²	71.4	50%	0.503	35%	0.353	S	S	.	.	S	Bend	trans	-73.8	-44.5	179.2	178.9	0	0	0	0	110.1	L339 D341 V344	L339-V350 HydrophobicContact CD2-CB 4.37Å; L339-V350 PolarHBondContact O-N 2.66Å; D341-V350 HydrophobicContact CB-CG2 3.9Å; V344-V350 HydrophobicContact CB-CG2 4.31Å; V344-V350 HydrophobicContact CG2-CG2 4.08Å
351	Q	91.3	Very high	88.3	Confident	61 Å²	61	74.8 Å²	74.8	29%	0.285	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.4	180	-164.8	177	10.9	0	0	110.4	L339 L395	L339-Q351 HydrophobicContact CB-CB 4.36Å; L339-Q351 PolarHBondContact N-O 3.08Å; L339-Q351 PolarHBondContact O-N 2.63Å; Q351-L395 HydrophobicContact CB-CD1 3.99Å; Q351-L395 HydrophobicContact CG-CB 4.02Å; Q351-L395 HydrophobicContact CG-CD1 3.8Å; Q351-L395 HydrophobicContact CG-CG 4.22Å; Q351-L395 VanDerWaalsContact NE2-N 3.11Å
352	R	92	Very high	88.3	Confident	83 Å²	83	77.4 Å²	77.4	31%	0.313	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.7	176.5	-52.3	-173.3	-174.5	-165.3	1.1	109.3	I337 V338 P349	I337-R352 CarbonylContact O-C 3.6Å; I337-R352 WeakPolarHBondContact O-CA 3.43Å; V338-R352 HydrophobicContact CG1-CG 4.17Å; P349-R352 HydrophobicContact CB-CG 4.38Å; P349-R352 HydrophobicContact CG-CG 4.08Å
353	S	92.8	Very high	88.5	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.014	39%	0.385	C	S	.	.			trans	-76.5	148.9	169	71.9	0	0	0	0	110.8	I337 L395	I337-S353 PolarHBondContact N-OG 3.42Å; I337-S353 PolarHBondContact O-N 3.09Å; S353-L395 WeakPolarHBondContact CA-O 3.41Å
354	P	90.7	Very high	88.8	Confident	50 Å²	50	70 Å²	70	33%	0.325	36%	0.357	S	S	.	.			trans	-78.8	148	177.3	33.2	-35.3	0	0	0	111.7	T356 L395 A396	P354-T356 HydrophobicContact CB-CG2 4.06Å; P354-T356 HydrophobicContact CG-CG2 4.24Å; P354-T356 PolarHBondContact O-N 2.83Å; P354-L395 WeakPolarHBondContact CD-O 3.22Å; P354-A396 VanDerWaalsContact CG-O 3.23Å; P354-A396 WeakPolarHBondContact CG-O 3.42Å
355	L	87.8	Confident	89.1	Confident	86 Å²	86	70.5 Å²	70.5	45%	0.45	35%	0.354	S	S	.	.			trans	-79.3	95.3	171.3	-65.9	172.4	0	0	0	109	S334 Q336	S334-L355 WeakPolarHBondContact O-CD2 3.4Å; Q336-L355 HydrophobicContact CG-CD1 4.11Å; Q336-L355 HydrophobicContact CG-CD2 3.54Å; Q336-L355 HydrophobicContact CG-CG 3.62Å
356	T	85.2	Confident	89.8	Confident	49 Å²	49	63.3 Å²	63.3	30%	0.301	32%	0.318	S	S	.	.			trans	-135	157.6	179.5	64	0	0	0	0	110.1	P354 W358 A359	P354-T356 HydrophobicContact CB-CG2 4.06Å; P354-T356 HydrophobicContact CG-CG2 4.24Å; P354-T356 PolarHBondContact O-N 2.83Å; T356-W358 PolarHBondContact O-N 2.7Å; T356-A359 CarbonylContact O-C 3.55Å; T356-A359 WeakPolarHBondContact O-CA 3.23Å; T356-A359 PolarHBondContact O-N 2.83Å; T356-A359 WeakPolarHBondContact OG1-CB 3.23Å; T356-A359 PolarHBondContact OG1-N 2.77Å
357	S	80.5	Confident	90.1	Very high	103 Å²	103	56.8 Å²	56.8	72%	0.72	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22	177.1	-50	0	0	0	0	113.5	K401	S357-K401 PolarHBondContact O-NZ 2.84Å
358	W	79.3	Confident	90.2	Very high	199 Å²	199	52.4 Å²	52.4	75%	0.754	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-17.4	172.6	-61.6	-49.7	0	0	0	113.4	T356 P398 K401	T356-W358 PolarHBondContact O-N 2.7Å; W358-P398 WeakPolarHBondContact O-CG 3.42Å; W358-K401 WeakPolarHBondContact O-CD 3.31Å
359	A	84.7	Confident	90.2	Very high	1 Å²	1	49 Å²	49	1%	0.008	26%	0.256	C	S	.	.	S	Bend	trans	-101.6	-142.3	173	0	0	0	0	0	109.4	T356 W390 K401	T356-A359 CarbonylContact O-C 3.55Å; T356-A359 WeakPolarHBondContact O-CA 3.23Å; T356-A359 PolarHBondContact O-N 2.83Å; T356-A359 WeakPolarHBondContact OG1-CB 3.23Å; T356-A359 PolarHBondContact OG1-N 2.77Å; A359-W390 HydrophobicContact CB-CH2 3.52Å; A359-W390 HydrophobicContact CB-CZ2 3.76Å; A359-K401 PolarHBondContact O-NZ 3.28Å
360	H	90.4	Very high	90	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.256	C	S	.	.			trans	-101.8	137.6	173.6	-64.3	-54.5	0	0	0	110.6	G335 V364 S380 S386 C388	G335-H360 WeakPolarHBondContact O-CB 3.43Å; H360-V364 HydrophobicContact CB-CG2 4.2Å; H360-S380 PolarHBondContact CD2-OG 3.03Å; H360-S380 WeakPolarHBondContact NE2-CB 3.25Å; H360-S380 PolarHBondContact NE2-O 3.32Å; H360-S380 PolarHBondContact NE2-OG 3.28Å; H360-S386 PolarHBondContact CE1-O 3.21Å; H360-S386 PolarHBondContact CE1-OG 2.79Å; H360-S386 PolarHBondContact ND1-OG 2.87Å; H360-C388 PolarHBondContact CE1-SG 3.07Å
361	T	89.3	Confident	89.8	Confident	71 Å²	71	46.5 Å²	46.5	44%	0.436	24%	0.244	S	C	.	.	S	Bend	trans	-116.6	1	169.9	56.5	0	0	0	0	112.1
362	H	92.2	Very high	89.6	Confident	83 Å²	83	47.4 Å²	47.4	38%	0.384	25%	0.254	S	S	.	.	S	Bend	trans	-126	161.8	-174.5	-70.5	107.3	0	0	0	108.8	G335 S383 D384	G335-H362 WeakPolarHBondContact CA-O 3.5Å; H362-S383 WeakPolarHBondContact CB-OG 3.36Å; H362-D384 HydrophobicContact CB-CB 4.43Å; H362-D384 IonicContact CE1-OD2 3Å; H362-D384 IonicContact CG-OD2 2.87Å; H362-D384 IonicContact ND1-OD2 2.68Å; H362-D384 PolarHBondContact ND1-OD2 3.43Å
363	P	94	Very high	89.2	Confident	15 Å²	15	49.5 Å²	49.5	10%	0.097	27%	0.267	C	S	.	.			trans	-58.6	140.7	-177.3	20.8	-32.9	0	0	0	113	Y333 F365 G382 S383	Y333-P363 HydrophobicContact CD2-CB 3.61Å; Y333-P363 HydrophobicContact CD2-CG 4.16Å; Y333-P363 HydrophobicContact CE2-CB 3.94Å; Y333-P363 HydrophobicContact CE2-CG 3.96Å; Y333-P363 HydrophobicContact CG-CB 4.15Å; Y333-P363 WeakPolarHBondContact O-CA 3.46Å; Y333-P363 WeakPolarHBondContact O-CB 3.43Å; P363-F365 HydrophobicContact CG-CZ 4.27Å; P363-G382 CarbonylContact O-C 3.52Å; P363-G382 WeakPolarHBondContact O-CA 3.48Å; P363-S383 WeakPolarHBondContact CD-OG 3.41Å; P363-S383 PolarHBondContact O-N 2.9Å
364	V	94.5	Very high	88.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	94.4	178.3	178.9	0	0	0	0	109.7	T316 S317 T332 H360 L381	T316-V364 WeakPolarHBondContact CB-O 3.14Å; T316-V364 PolarHBondContact OG1-O 3.48Å; S317-V364 PolarHBondContact OG-O 3.25Å; T332-V364 PolarHBondContact O-N 3.39Å; H360-V364 HydrophobicContact CB-CG2 4.2Å; V364-L381 CarbonylContact C-O 3.6Å; V364-L381 VanDerWaalsContact CA-O 3.24Å; V364-L381 WeakPolarHBondContact CA-O 3Å
365	F	94.5	Very high	88.4	Confident	67 Å²	67	57.3 Å²	57.3	29%	0.294	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-34.1	-174.4	-71	-57.9	0	0	0	114.1	S317 P363 L381 P417 T418	S317-F365 VanDerWaalsContact CB-O 3.3Å; S317-F365 WeakPolarHBondContact CB-O 3.3Å; S317-F365 PolarHBondContact OG-O 2.85Å; P363-F365 HydrophobicContact CG-CZ 4.27Å; F365-L381 PolarHBondContact N-O 3.25Å; F365-P417 WeakPolarHBondContact CD2-O 3.41Å; F365-T418 VanDerWaalsContact CB-O 3.24Å; F365-T418 WeakPolarHBondContact CB-O 3.37Å
366	A	93.6	Very high	88.4	Confident	14 Å²	14	54.1 Å²	54.1	12%	0.116	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.2	179.3	0	0	0	0	0	111.3	L381 M420	A366-L381 HydrophobicContact CB-CB 4.17Å; A366-L381 HydrophobicContact CB-CD2 4.27Å; A366-L381 PolarHBondContact O-N 3.47Å; A366-M420 HydrophobicContact CB-CB 4Å; A366-M420 HydrophobicContact CB-CE 4.29Å
367	I	94.2	Very high	88.7	Confident	14 Å²	14	53 Å²	53	7%	0.072	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.1	174.3	-163	153.6	0	0	0	109.5	S317 V329 I337 I378 I379	S317-I367 WeakPolarHBondContact OG-CG2 3.21Å; S317-I367 PolarHBondContact OG-N 3.49Å; V329-I367 HydrophobicContact CG1-CD1 3.46Å; V329-I367 VanDerWaalsContact CG1-CD1 3.46Å; V329-I367 HydrophobicContact CG1-CG1 4.03Å; I337-I367 HydrophobicContact CG1-CD1 4.33Å; I337-I367 HydrophobicContact CG2-CD1 3.71Å; I367-I378 HydrophobicContact CD1-CG2 3.72Å; I367-I378 HydrophobicContact CG1-CG2 3.61Å; I367-I379 WeakPolarHBondContact CA-O 3.48Å
368	T	92.4	Very high	89.3	Confident	29 Å²	29	48.1 Å²	48.1	18%	0.178	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145.5	179.3	-176	0	0	0	0	110.3	I370 I379 M420 F422	T368-I370 HydrophobicContact CG2-CD1 3.94Å; T368-I370 HydrophobicContact CG2-CG1 3.93Å; T368-I379 HydrophobicContact CG2-CB 4.22Å; T368-I379 PolarHBondContact N-O 3.08Å; T368-I379 PolarHBondContact O-N 3.07Å; T368-M420 HydrophobicContact CG2-CE 3.76Å; T368-F422 HydrophobicContact CG2-CD2 3.78Å; T368-F422 HydrophobicContact CG2-CE2 3.84Å
369	L	91.5	Very high	90	Very high	6 Å²	6	38.7 Å²	38.7	3%	0.031	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	129.1	174.5	-171.4	78.2	0	0	0	110.1	S321 F323 H376 I378	S321-L369 WeakPolarHBondContact OG-CD2 3.37Å; F323-L369 HydrophobicContact CD2-CD2 3.75Å; F323-L369 HydrophobicContact CE2-CD2 3.99Å; F323-L369 HydrophobicContact CE2-CG 4.34Å; L369-H376 HydrophobicContact CD1-CB 4.39Å; L369-H376 HydrophobicContact CG-CB 4.5Å; L369-I378 HydrophobicContact CD1-CB 4.37Å; L369-I378 HydrophobicContact CD1-CG1 3.47Å; L369-I378 VanDerWaalsContact CD1-CG1 3.47Å
370	I	89.1	Confident	90.4	Very high	18 Å²	18	38.7 Å²	38.7	9%	0.092	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.1	-173.6	-20.2	173.1	0	0	0	110.5	T368 H376 N377 I379 F422 V427	T368-I370 HydrophobicContact CG2-CD1 3.94Å; T368-I370 HydrophobicContact CG2-CG1 3.93Å; I370-H376 CarbonylContact O-C 3.48Å; I370-H376 VanDerWaalsContact O-CA 3.31Å; I370-H376 WeakPolarHBondContact O-CA 3.27Å; I370-N377 PolarHBondContact N-O 2.88Å; I370-N377 PolarHBondContact O-N 3.28Å; I370-I379 HydrophobicContact CD1-CB 4.02Å; I370-I379 HydrophobicContact CD1-CG1 3.31Å; I370-I379 HydrophobicContact CG1-CG1 3.93Å; I370-F422 HydrophobicContact CD1-CD1 3.53Å; I370-F422 HydrophobicContact CD1-CD2 3.4Å; I370-F422 VanDerWaalsContact CD1-CD2 3.4Å; I370-F422 HydrophobicContact CD1-CE1 3.35Å; I370-F422 HydrophobicContact CD1-CE2 3.22Å; I370-F422 HydrophobicContact CD1-CG 3.55Å; I370-F422 HydrophobicContact CD1-CZ 3.19Å; I370-F422 HydrophobicContact CG1-CD2 4.47Å; I370-V427 HydrophobicContact CB-CG1 4Å; I370-V427 HydrophobicContact CG2-CB 4.23Å; I370-V427 HydrophobicContact CG2-CG1 3.86Å; I370-V427 HydrophobicContact CG2-CG2 4.18Å
371	G	86.8	Confident	90.6	Very high	25 Å²	25	38.7 Å²	38.7	26%	0.258	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	126.2	-142.4	174.9	0	0	0	0	0	112.2	F323 A375	F323-G371 VanDerWaalsContact CZ-C 3.47Å; F323-G371 WeakPolarHBondContact CZ-O 3.5Å; G371-A375 WeakPolarHBondContact CA-O 3.39Å
372	T	86.1	Confident	90.7	Very high	81 Å²	81	35.3 Å²	35.3	50%	0.497	20%	0.199	S	C	.	.			trans	-123.8	167.6	-179.7	63.2	0	0	0	0	109.9	N374 A375 H376	T372-N374 PolarHBondContact O-N 2.86Å; T372-A375 PolarHBondContact N-O 2.77Å; T372-A375 CarbonylContact O-C 3.53Å; T372-A375 PolarHBondContact O-N 2.92Å; T372-A375 VanDerWaalsContact O-N 3.1Å; T372-A375 PolarHBondContact OG1-N 3.21Å; T372-A375 VanDerWaalsContact OG1-N 3.14Å; T372-A375 PolarHBondContact OG1-O 3.11Å; T372-H376 WeakPolarHBondContact O-CB 3.45Å; T372-H376 PolarHBondContact O-N 3.37Å; T372-H376 PolarHBondContact O-ND1 2.89Å
373	Q	83.4	Confident	90.7	Very high	126 Å²	126	32.2 Å²	32.2	59%	0.589	19%	0.187	S	C	*	.	S	Bend	trans	-51.7	-43.3	177.6	-173.4	175.1	32	0	0	112.5	F323 H376	F323-Q373 HydrophobicContact CB-CB 4.44Å; F323-Q373 HydrophobicContact CB-CG 4.37Å; F323-Q373 HydrophobicContact CD1-CB 4.07Å; F323-Q373 HydrophobicContact CG-CB 4.42Å; Q373-H376 PolarHBondContact O-CE1 3.05Å; Q373-H376 PolarHBondContact O-ND1 2.91Å
374	N	83.2	Confident	90.4	Very high	155 Å²	155	33.1 Å²	33.1	83%	0.829	19%	0.191	S	C	*	.	S	Bend	trans	-83.1	-24.6	-178.5	-61.4	-20.1	0	0	0	113.4	T372	T372-N374 PolarHBondContact O-N 2.86Å
375	A	84.4	Confident	90.1	Very high	61 Å²	61	33.1 Å²	33.1	50%	0.504	19%	0.191	S	C	.	.	S	Bend	trans	-140.6	86	-176.9	0	0	0	0	0	109.9	G371 T372	G371-A375 WeakPolarHBondContact CA-O 3.39Å; T372-A375 PolarHBondContact N-O 2.77Å; T372-A375 CarbonylContact O-C 3.53Å; T372-A375 PolarHBondContact O-N 2.92Å; T372-A375 VanDerWaalsContact O-N 3.1Å; T372-A375 PolarHBondContact OG1-N 3.21Å; T372-A375 VanDerWaalsContact OG1-N 3.14Å; T372-A375 PolarHBondContact OG1-O 3.11Å
376	H	88	Confident	89.9	Confident	20 Å²	20	30.1 Å²	30.1	9%	0.093	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	145.5	176.9	54.3	-88.7	0	0	0	110.7	F323 H324 L369 I370 T372 Q373 L392	F323-H376 HydrophobicContact CD2-CB 3.6Å; F323-H376 AromaticContact CD2-CG 3.81Å; F323-H376 HydrophobicContact CE2-CB 3.47Å; F323-H376 VanDerWaalsContact CE2-CB 3.47Å; H324-H376 AromaticContact CD2-CE1 3.94Å; H324-H376 AromaticContact NE2-CE1 3.52Å; L369-H376 HydrophobicContact CD1-CB 4.39Å; L369-H376 HydrophobicContact CG-CB 4.5Å; I370-H376 CarbonylContact O-C 3.48Å; I370-H376 VanDerWaalsContact O-CA 3.31Å; I370-H376 WeakPolarHBondContact O-CA 3.27Å; T372-H376 WeakPolarHBondContact O-CB 3.45Å; T372-H376 PolarHBondContact O-N 3.37Å; T372-H376 PolarHBondContact O-ND1 2.89Å; Q373-H376 PolarHBondContact O-CE1 3.05Å; Q373-H376 PolarHBondContact O-ND1 2.91Å; H376-L392 WeakPolarHBondContact NE2-CB 3.3Å; H376-L392 VanDerWaalsContact NE2-CD2 3.27Å; H376-L392 WeakPolarHBondContact NE2-CD2 3.33Å
377	N	91.2	Very high	89.7	Confident	25 Å²	25	29.5 Å²	29.5	13%	0.134	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.2	175.1	-55.1	-68.1	0	0	0	109.1	I370 I379 W390 R399	I370-N377 PolarHBondContact N-O 2.88Å; I370-N377 PolarHBondContact O-N 3.28Å; N377-I379 HydrophobicContact CB-CD1 4.42Å; N377-W390 CarbonylContact C-O 3.56Å; N377-W390 VanDerWaalsContact CA-O 3.26Å; N377-W390 WeakPolarHBondContact CA-O 3.06Å; N377-W390 WeakPolarHBondContact CB-O 3.12Å; N377-R399 PolarHBondContact OD1-NH1 2.91Å
378	I	93.4	Very high	89.6	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	127.1	169.8	-62.2	160	0	0	0	107.1	V329 I367 L369 A389 W390 L392 L395	V329-I378 HydrophobicContact CB-CD1 4.48Å; V329-I378 HydrophobicContact CG1-CD1 3.76Å; V329-I378 HydrophobicContact CG1-CG1 4.18Å; V329-I378 HydrophobicContact CG1-CG2 3.87Å; V329-I378 HydrophobicContact CG2-CD1 3.83Å; V329-I378 HydrophobicContact CG2-CG1 4.21Å; I367-I378 HydrophobicContact CD1-CG2 3.72Å; I367-I378 HydrophobicContact CG1-CG2 3.61Å; L369-I378 HydrophobicContact CD1-CB 4.37Å; L369-I378 HydrophobicContact CD1-CG1 3.47Å; L369-I378 VanDerWaalsContact CD1-CG1 3.47Å; I378-A389 CarbonylContact O-C 3.55Å; I378-A389 WeakPolarHBondContact O-CA 3.03Å; I378-W390 HydrophobicContact CB-CB 4.18Å; I378-W390 PolarHBondContact N-O 2.81Å; I378-W390 PolarHBondContact O-N 2.9Å; I378-L392 HydrophobicContact CD1-CD1 3.7Å; I378-L392 HydrophobicContact CG1-CD1 4.36Å; I378-L395 HydrophobicContact CD1-CD2 4.3Å
379	I	93.7	Very high	89.6	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.1	172.2	-53.7	-53.4	0	0	0	108.6	I367 T368 I370 N377 L387 A389 M420 F422	I367-I379 WeakPolarHBondContact CA-O 3.48Å; T368-I379 HydrophobicContact CG2-CB 4.22Å; T368-I379 PolarHBondContact N-O 3.08Å; T368-I379 PolarHBondContact O-N 3.07Å; I370-I379 HydrophobicContact CD1-CB 4.02Å; I370-I379 HydrophobicContact CD1-CG1 3.31Å; I370-I379 HydrophobicContact CG1-CG1 3.93Å; N377-I379 HydrophobicContact CB-CD1 4.42Å; I379-L387 HydrophobicContact CG2-CD1 3.33Å; I379-L387 HydrophobicContact CG2-CD2 4.38Å; I379-L387 HydrophobicContact CG2-CG 3.87Å; I379-A389 HydrophobicContact CD1-CB 3.44Å; I379-A389 VanDerWaalsContact CD1-CB 3.44Å; I379-M420 HydrophobicContact CG2-CE 4.03Å; I379-M420 HydrophobicContact CG2-SD 4.16Å; I379-F422 HydrophobicContact CB-CE2 4.21Å; I379-F422 HydrophobicContact CB-CZ 4.29Å; I379-F422 HydrophobicContact CG1-CE2 4.36Å; I379-F422 HydrophobicContact CG1-CZ 4.04Å; I379-F422 HydrophobicContact CG2-CE2 4.04Å; I379-F422 HydrophobicContact CG2-CZ 4.01Å
380	S	93.7	Very high	89.6	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.2	-177.4	52	0	0	0	0	109.8	I337 H360 L387 C388 W390	I337-S380 WeakPolarHBondContact CD1-OG 3.2Å; H360-S380 PolarHBondContact CD2-OG 3.03Å; H360-S380 WeakPolarHBondContact NE2-CB 3.25Å; H360-S380 PolarHBondContact NE2-O 3.32Å; H360-S380 PolarHBondContact NE2-OG 3.28Å; S380-L387 WeakPolarHBondContact O-CA 3.25Å; S380-C388 PolarHBondContact N-O 3.15Å; S380-C388 PolarHBondContact O-N 2.9Å; S380-C388 PolarHBondContact OG-O 2.79Å; S380-W390 VanDerWaalsContact OG-CD1 3.32Å; S380-W390 PolarHBondContact OG-NE1 2.84Å
381	L	93.5	Very high	89.7	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.4	178.2	-174.5	75	0	0	0	109.5	V364 F365 A366 L387 P417 M420 V432	V364-L381 CarbonylContact C-O 3.6Å; V364-L381 VanDerWaalsContact CA-O 3.24Å; V364-L381 WeakPolarHBondContact CA-O 3Å; F365-L381 PolarHBondContact N-O 3.25Å; A366-L381 HydrophobicContact CB-CB 4.17Å; A366-L381 HydrophobicContact CB-CD2 4.27Å; A366-L381 PolarHBondContact O-N 3.47Å; L381-L387 HydrophobicContact CD1-CD1 4.06Å; L381-P417 HydrophobicContact CD1-CB 4.05Å; L381-P417 HydrophobicContact CD1-CG 3.75Å; L381-P417 HydrophobicContact CD2-CB 3.73Å; L381-P417 HydrophobicContact CD2-CG 3.98Å; L381-P417 HydrophobicContact CG-CB 4.11Å; L381-P417 HydrophobicContact CG-CG 3.8Å; L381-M420 HydrophobicContact CB-CB 4.43Å; L381-M420 HydrophobicContact CB-CE 4.18Å; L381-M420 HydrophobicContact CB-SD 4.2Å; L381-M420 HydrophobicContact CD1-SD 4.4Å; L381-M420 HydrophobicContact CD2-CB 3.64Å; L381-M420 HydrophobicContact CG-CB 4.45Å; L381-V432 HydrophobicContact CD1-CG2 4.46Å; L381-V432 HydrophobicContact CD2-CG1 4.36Å
382	G	92.5	Very high	89.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	153.2	173.1	0	0	0	0	0	111.9	P363 D384 G385 S386 P417	P363-G382 CarbonylContact O-C 3.52Å; P363-G382 WeakPolarHBondContact O-CA 3.48Å; G382-D384 PolarHBondContact O-N 2.81Å; G382-D384 VanDerWaalsContact O-N 3.13Å; G382-G385 PolarHBondContact O-N 2.95Å; G382-S386 PolarHBondContact N-O 3.33Å; G382-P417 VanDerWaalsContact O-CG 3.25Å; G382-P417 WeakPolarHBondContact O-CG 3.24Å
383	S	90.7	Very high	89.5	Confident	18 Å²	18	31.2 Å²	31.2	13%	0.126	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.4	178	74.5	0	0	0	0	114.3	H362 P363 G385 Y416	H362-S383 WeakPolarHBondContact CB-OG 3.36Å; P363-S383 WeakPolarHBondContact CD-OG 3.41Å; P363-S383 PolarHBondContact O-N 2.9Å; S383-G385 VanDerWaalsContact C-N 3.27Å; S383-G385 PolarHBondContact O-N 2.6Å; S383-Y416 WeakPolarHBondContact O-CA 3.27Å; S383-Y416 VanDerWaalsContact O-CD1 3.27Å; S383-Y416 WeakPolarHBondContact O-CD1 3.44Å
384	D	89.1	Confident	89.7	Confident	34 Å²	34	31.1 Å²	31.1	18%	0.182	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	9.8	177.4	62.9	0	0	0	0	113.8	H362 G382 S386 L415	H362-D384 HydrophobicContact CB-CB 4.43Å; H362-D384 IonicContact CE1-OD2 3Å; H362-D384 IonicContact CG-OD2 2.87Å; H362-D384 IonicContact ND1-OD2 2.68Å; H362-D384 PolarHBondContact ND1-OD2 3.43Å; G382-D384 PolarHBondContact O-N 2.81Å; G382-D384 VanDerWaalsContact O-N 3.13Å; D384-S386 PolarHBondContact O-N 2.77Å; D384-S386 VanDerWaalsContact OD1-CB 3.22Å; D384-S386 WeakPolarHBondContact OD1-CB 3.33Å; D384-S386 PolarHBondContact OD1-N 3.17Å; D384-S386 PolarHBondContact OD1-OG 2.93Å; D384-L415 CarbonylContact C-O 3.5Å
385	G	87.2	Confident	89.7	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	81.1	1.8	-176.8	0	0	0	0	0	113.6	G382 S383 K403 V404 L415	G382-G385 PolarHBondContact O-N 2.95Å; S383-G385 VanDerWaalsContact C-N 3.27Å; S383-G385 PolarHBondContact O-N 2.6Å; G385-K403 WeakPolarHBondContact O-CA 3.46Å; G385-V404 PolarHBondContact O-N 2.9Å; G385-L415 WeakPolarHBondContact CA-O 3.37Å; G385-L415 PolarHBondContact N-O 2.88Å
386	S	89.7	Confident	89.7	Confident	4 Å²	4	23.8 Å²	23.8	3%	0.028	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130.8	176.1	67.7	0	0	0	0	111.7	H360 G382 D384	H360-S386 PolarHBondContact CE1-O 3.21Å; H360-S386 PolarHBondContact CE1-OG 2.79Å; H360-S386 PolarHBondContact ND1-OG 2.87Å; G382-S386 PolarHBondContact N-O 3.33Å; D384-S386 PolarHBondContact O-N 2.77Å; D384-S386 VanDerWaalsContact OD1-CB 3.22Å; D384-S386 WeakPolarHBondContact OD1-CB 3.33Å; D384-S386 PolarHBondContact OD1-N 3.17Å; D384-S386 PolarHBondContact OD1-OG 2.93Å
387	L	90.8	Very high	89.6	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	112.1	175.5	-174.3	72	0	0	0	107.7	I379 S380 L381 K401 S402 M420 Y430	I379-L387 HydrophobicContact CG2-CD1 3.33Å; I379-L387 HydrophobicContact CG2-CD2 4.38Å; I379-L387 HydrophobicContact CG2-CG 3.87Å; S380-L387 WeakPolarHBondContact O-CA 3.25Å; L381-L387 HydrophobicContact CD1-CD1 4.06Å; L387-K401 WeakPolarHBondContact O-CA 3.3Å; L387-S402 PolarHBondContact N-O 2.88Å; L387-S402 PolarHBondContact O-N 3.31Å; L387-S402 PolarHBondContact O-OG 2.91Å; L387-M420 HydrophobicContact CD1-CE 4.43Å; L387-M420 HydrophobicContact CD1-SD 3.5Å; L387-M420 WeakPolarHBondContact CD1-SD 3.5Å; L387-Y430 HydrophobicContact CD2-CD1 4.2Å; L387-Y430 HydrophobicContact CD2-CE1 3.56Å; L387-Y430 HydrophobicContact CD2-CE2 4.33Å
388	C	90.9	Very high	89.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	130.6	-179.4	-64.6	0	0	0	0	110.9	H360 S380 W390 P398 E400	H360-C388 PolarHBondContact CE1-SG 3.07Å; S380-C388 PolarHBondContact N-O 3.15Å; S380-C388 PolarHBondContact O-N 2.9Å; S380-C388 PolarHBondContact OG-O 2.79Å; C388-W390 HydrophobicContact CB-CZ2 4.3Å; C388-W390 VanDerWaalsContact CB-NE1 3.28Å; C388-P398 HydrophobicContact CB-CB 4.18Å; C388-E400 CarbonylContact C-O 3.56Å; C388-E400 WeakPolarHBondContact CA-O 3.12Å
389	A	91.7	Very high	89.1	Confident	3 Å²	3	37.3 Å²	37.3	3%	0.025	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	131.1	171.2	0	0	0	0	0	110.5	I378 I379 P398 R399 E400	I378-A389 CarbonylContact O-C 3.55Å; I378-A389 WeakPolarHBondContact O-CA 3.03Å; I379-A389 HydrophobicContact CD1-CB 3.44Å; I379-A389 VanDerWaalsContact CD1-CB 3.44Å; A389-P398 CarbonylContact O-C 3.52Å; A389-R399 PolarHBondContact O-N 2.66Å; A389-E400 HydrophobicContact CB-CB 4.07Å; A389-E400 PolarHBondContact N-O 2.98Å; A389-E400 PolarHBondContact O-N 3.31Å
390	W	91.9	Very high	88.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	147.4	-176.4	-57.6	84.5	0	0	0	110.9	I337 A359 N377 I378 S380 C388 L395 Q397 P398	I337-W390 HydrophobicContact CD1-CD2 3.94Å; I337-W390 HydrophobicContact CD1-CG 3.91Å; I337-W390 HydrophobicContact CD1-CZ2 3.96Å; A359-W390 HydrophobicContact CB-CH2 3.52Å; A359-W390 HydrophobicContact CB-CZ2 3.76Å; N377-W390 CarbonylContact C-O 3.56Å; N377-W390 VanDerWaalsContact CA-O 3.26Å; N377-W390 WeakPolarHBondContact CA-O 3.06Å; N377-W390 WeakPolarHBondContact CB-O 3.12Å; I378-W390 HydrophobicContact CB-CB 4.18Å; I378-W390 PolarHBondContact N-O 2.81Å; I378-W390 PolarHBondContact O-N 2.9Å; S380-W390 VanDerWaalsContact OG-CD1 3.32Å; S380-W390 PolarHBondContact OG-NE1 2.84Å; C388-W390 HydrophobicContact CB-CZ2 4.3Å; C388-W390 VanDerWaalsContact CB-NE1 3.28Å; W390-L395 HydrophobicContact CB-CD2 3.99Å; W390-L395 HydrophobicContact CE3-CD2 4.35Å; W390-L395 WeakPolarHBondContact CZ3-O 3.42Å; W390-Q397 VanDerWaalsContact CZ3-C 3.5Å; W390-P398 HydrophobicContact CD2-CB 3.99Å; W390-P398 HydrophobicContact CE3-CB 4.1Å; W390-P398 HydrophobicContact CH2-CB 4.01Å; W390-P398 HydrophobicContact CH2-CG 4.04Å; W390-P398 HydrophobicContact CZ2-CB 3.87Å; W390-P398 HydrophobicContact CZ2-CG 4.18Å; W390-P398 HydrophobicContact CZ3-CB 4.11Å; W390-P398 HydrophobicContact CZ3-CG 4.37Å; W390-P398 VanDerWaalsContact CZ3-N 3.33Å
391	S	90.7	Very high	88.5	Confident	11 Å²	11	44.6 Å²	44.6	8%	0.077	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	142	165.7	35.2	0	0	0	0	110.8	E393 M394 L395	S391-E393 VanDerWaalsContact C-N 3.29Å; S391-E393 PolarHBondContact O-N 3.22Å; S391-M394 CarbonylContact O-C 3.34Å; S391-M394 PolarHBondContact OG-O 2.8Å; S391-L395 VanDerWaalsContact O-CD2 3.28Å; S391-L395 WeakPolarHBondContact O-CD2 3.36Å
392	L	86.1	Confident	88.2	Confident	18 Å²	18	46 Å²	46	9%	0.094	23%	0.23	C	C	.	.	S	Bend	trans	-60.8	-39.2	176.1	-167.2	69	0	0	0	112.5	I327 V329 L339 H376 I378	I327-L392 HydrophobicContact CG2-CD1 3.93Å; I327-L392 HydrophobicContact CG2-CD2 4.39Å; V329-L392 HydrophobicContact CG2-CD1 4.17Å; L339-L392 HydrophobicContact CD1-CD1 3.4Å; L339-L392 VanDerWaalsContact CD1-CD1 3.4Å; L339-L392 HydrophobicContact CD1-CG 4.01Å; H376-L392 WeakPolarHBondContact NE2-CB 3.3Å; H376-L392 VanDerWaalsContact NE2-CD2 3.27Å; H376-L392 WeakPolarHBondContact NE2-CD2 3.33Å; I378-L392 HydrophobicContact CD1-CD1 3.7Å; I378-L392 HydrophobicContact CG1-CD1 4.36Å
393	E	84.3	Confident	87.8	Confident	176 Å²	176	50.8 Å²	50.8	82%	0.822	25%	0.251	S	S	*	.	S	Bend	trans	-79	-33.1	-175.1	-59.8	177.1	171.9	0	0	113.4	S391	S391-E393 VanDerWaalsContact C-N 3.29Å; S391-E393 PolarHBondContact O-N 3.22Å
394	M	85.9	Confident	87.5	Confident	125 Å²	125	50.5 Å²	50.5	62%	0.616	25%	0.248	S	C	*	.			trans	-127.5	96.1	-175.3	-171.4	178.1	-66.9	0	0	109.9	S391 A396	S391-M394 CarbonylContact O-C 3.34Å; S391-M394 PolarHBondContact OG-O 2.8Å; M394-A396 HydrophobicContact CG-CB 4.35Å
395	L	83.6	Confident	87.1	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	25%	0.246	C	C	.	.			trans	-93	9.9	176	-62.4	177	0	0	0	113.5	L339 Q351 S353 P354 I378 W390 S391	L339-L395 HydrophobicContact CB-CD1 3.97Å; L339-L395 HydrophobicContact CD1-CD1 4.29Å; Q351-L395 HydrophobicContact CB-CD1 3.99Å; Q351-L395 HydrophobicContact CG-CB 4.02Å; Q351-L395 HydrophobicContact CG-CD1 3.8Å; Q351-L395 HydrophobicContact CG-CG 4.22Å; Q351-L395 VanDerWaalsContact NE2-N 3.11Å; S353-L395 WeakPolarHBondContact CA-O 3.41Å; P354-L395 WeakPolarHBondContact CD-O 3.22Å; I378-L395 HydrophobicContact CD1-CD2 4.3Å; W390-L395 HydrophobicContact CB-CD2 3.99Å; W390-L395 HydrophobicContact CE3-CD2 4.35Å; W390-L395 WeakPolarHBondContact CZ3-O 3.42Å; S391-L395 VanDerWaalsContact O-CD2 3.28Å; S391-L395 WeakPolarHBondContact O-CD2 3.36Å
396	A	84.4	Confident	86.8	Confident	61 Å²	61	50.7 Å²	50.7	50%	0.504	25%	0.25	S	S	.	.	S	Bend	trans	-69.6	-36.1	-178	0	0	0	0	0	112.6	P354 M394	P354-A396 VanDerWaalsContact CG-O 3.23Å; P354-A396 WeakPolarHBondContact CG-O 3.42Å; M394-A396 HydrophobicContact CG-CB 4.35Å
397	Q	86.2	Confident	86	Confident	141 Å²	141	54.9 Å²	54.9	66%	0.659	27%	0.27	S	S	*	.	S	Bend	trans	-140.9	143.5	177.6	-66.5	-177.7	-0.8	0	0	109.5	W390	W390-Q397 VanDerWaalsContact CZ3-C 3.5Å
398	P	88.5	Confident	84.9	Confident	26 Å²	26	56.6 Å²	56.6	17%	0.169	28%	0.283	C	S	.	.			trans	-67.9	142.2	172.1	25.7	-27.6	0	0	0	109.8	W358 C388 A389 W390	W358-P398 WeakPolarHBondContact O-CG 3.42Å; C388-P398 HydrophobicContact CB-CB 4.18Å; A389-P398 CarbonylContact O-C 3.52Å; W390-P398 HydrophobicContact CD2-CB 3.99Å; W390-P398 HydrophobicContact CE3-CB 4.1Å; W390-P398 HydrophobicContact CH2-CB 4.01Å; W390-P398 HydrophobicContact CH2-CG 4.04Å; W390-P398 HydrophobicContact CZ2-CB 3.87Å; W390-P398 HydrophobicContact CZ2-CG 4.18Å; W390-P398 HydrophobicContact CZ3-CB 4.11Å; W390-P398 HydrophobicContact CZ3-CG 4.37Å; W390-P398 VanDerWaalsContact CZ3-N 3.33Å
399	R	86.6	Confident	83.8	Confident	163 Å²	163	63.4 Å²	63.4	62%	0.615	33%	0.33	S	S	*	.	S	Bend	trans	-68.6	-37.9	175.2	-75.6	-169.9	163.2	176.3	-5.9	111.9	N377 A389	N377-R399 PolarHBondContact OD1-NH1 2.91Å; A389-R399 PolarHBondContact O-N 2.66Å
400	E	87	Confident	82.7	Confident	61 Å²	61	66.5 Å²	66.5	29%	0.285	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	139.6	-177.1	-175	-179.6	-165.7	0	0	108.4	C388 A389 R444	C388-E400 CarbonylContact C-O 3.56Å; C388-E400 WeakPolarHBondContact CA-O 3.12Å; A389-E400 HydrophobicContact CB-CB 4.07Å; A389-E400 PolarHBondContact N-O 2.98Å; A389-E400 PolarHBondContact O-N 3.31Å; E400-R444 IonicContact OE2-NH1 2.74Å; E400-R444 PolarHBondContact OE2-NH1 3.41Å
401	K	86.8	Confident	81.9	Confident	92 Å²	92	68 Å²	68	40%	0.4	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	116.7	170.4	176.1	164.7	177.9	164.4	0	107.8	S357 W358 A359 L387	S357-K401 PolarHBondContact O-NZ 2.84Å; W358-K401 WeakPolarHBondContact O-CD 3.31Å; A359-K401 PolarHBondContact O-NZ 3.28Å; L387-K401 WeakPolarHBondContact O-CA 3.3Å
402	S	86.6	Confident	81.2	Confident	30 Å²	30	72.4 Å²	72.4	21%	0.21	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	160.4	170.8	56.3	0	0	0	0	109.4	L387	L387-S402 PolarHBondContact N-O 2.88Å; L387-S402 PolarHBondContact O-N 3.31Å; L387-S402 PolarHBondContact O-OG 2.91Å
403	K	84.8	Confident	81	Confident	101 Å²	101	76.7 Å²	76.7	44%	0.439	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.2	175.2	-165.4	177.5	-173.5	-178	0	108.5	G385 D414	G385-K403 WeakPolarHBondContact O-CA 3.46Å; K403-D414 WeakPolarHBondContact CE-OD1 3.44Å; K403-D414 IonicContact NZ-OD1 3.29Å; K403-D414 PolarHBondContact NZ-OD1 3.48Å; K403-D414 IonicContact NZ-OD2 3.86Å; K403-D414 PolarHBondContact NZ-OD2 3.4Å
404	V	84.8	Confident	81	Confident	12 Å²	12	72.8 Å²	72.8	7%	0.073	40%	0.403	C	S	.	.			trans	-83.8	120.2	170.7	-169.8	0	0	0	0	107.2	G385 L415 Y430	G385-V404 PolarHBondContact O-N 2.9Å; V404-L415 HydrophobicContact CB-CD2 4.46Å; V404-L415 HydrophobicContact CG1-CD2 3.71Å; V404-Y430 HydrophobicContact CG2-CE2 4.29Å
405	C	81	Confident	81	Confident	20 Å²	20	67.1 Å²	67.1	14%	0.135	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	152.1	179.5	-59.2	0	0	0	0	109.5	L412 F413 H458	C405-L412 HydrophobicContact CB-CD2 4.16Å; C405-F413 WeakPolarHBondContact CA-O 3.2Å; C405-F413 WeakPolarHBondContact CB-O 3.36Å; C405-H458 PolarHBondContact O-ND1 3.49Å
406	E	80.3	Confident	81.4	Confident	18 Å²	18	73.2 Å²	73.2	8%	0.084	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139.6	168	178.1	174	170.2	0	0	109.8	S408 L412 F413 Y440	E406-S408 PolarHBondContact OE1-OG 3.31Å; E406-L412 CarbonylContact O-C 3.54Å; E406-L412 VanDerWaalsContact O-CA 3.3Å; E406-L412 WeakPolarHBondContact O-CA 3.47Å; E406-F413 PolarHBondContact N-O 3.25Å; E406-F413 PolarHBondContact O-N 2.96Å; E406-Y440 HydrophobicContact CB-CE1 3.73Å; E406-Y440 HydrophobicContact CG-CE1 3.82Å; E406-Y440 PolarHBondContact OE2-OH 2.9Å
407	M	74	Confident	81.8	Confident	91 Å²	91	70.3 Å²	70.3	45%	0.448	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	104.8	166.4	-174.7	75.6	80.9	0	0	107.5	L412 H458	M407-L412 HydrophobicContact CB-CD2 4.14Å; M407-L412 HydrophobicContact CE-CD1 4.32Å; M407-L412 HydrophobicContact CE-CD2 3.52Å; M407-L412 HydrophobicContact CE-CG 3.74Å; M407-L412 HydrophobicContact SD-CD2 3.81Å; M407-L412 HydrophobicContact SD-CG 3.88Å; M407-H458 HydrophobicContact CB-CB 3.23Å; M407-H458 PolarHBondContact N-O 3.07Å
408	S	67.6	Low	82.1	Confident	39 Å²	39	65 Å²	65	27%	0.273	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	170.3	167.3	-37.5	0	0	0	0	109.1	E406 G410 G411	E406-S408 PolarHBondContact OE1-OG 3.31Å; S408-G410 PolarHBondContact O-N 2.81Å; S408-G411 PolarHBondContact N-O 2.86Å; S408-G411 VanDerWaalsContact N-O 3.13Å; S408-G411 PolarHBondContact O-N 2.85Å
409	S	67.8	Low	82.3	Confident	142 Å²	142	64.3 Å²	64.3	99%	0.993	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-21	-179.6	-48	0	0	0	0	114.7
410	G	67.5	Low	82.7	Confident	69 Å²	69	57.5 Å²	57.5	71%	0.711	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-1.5	178.9	0	0	0	0	0	115.8	S408	S408-G410 PolarHBondContact O-N 2.81Å
411	G	75.2	Confident	83	Confident	30 Å²	30	55.7 Å²	55.7	31%	0.309	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.3	-167.6	-178.8	0	0	0	0	0	113.8	S408 F413	S408-G411 PolarHBondContact N-O 2.86Å; S408-G411 VanDerWaalsContact N-O 3.13Å; S408-G411 PolarHBondContact O-N 2.85Å; G411-F413 WeakPolarHBondContact O-CD2 3.21Å
412	L	75.9	Confident	83.2	Confident	104 Å²	104	52.4 Å²	52.4	55%	0.545	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	121	177.2	-72.3	168	0	0	0	110.2	C405 E406 M407	C405-L412 HydrophobicContact CB-CD2 4.16Å; E406-L412 CarbonylContact O-C 3.54Å; E406-L412 VanDerWaalsContact O-CA 3.3Å; E406-L412 WeakPolarHBondContact O-CA 3.47Å; M407-L412 HydrophobicContact CB-CD2 4.14Å; M407-L412 HydrophobicContact CE-CD1 4.32Å; M407-L412 HydrophobicContact CE-CD2 3.52Å; M407-L412 HydrophobicContact CE-CG 3.74Å; M407-L412 HydrophobicContact SD-CD2 3.81Å; M407-L412 HydrophobicContact SD-CG 3.88Å
413	F	82.2	Confident	83.4	Confident	109 Å²	109	51.6 Å²	51.6	48%	0.478	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	146.5	175.4	-67.2	-85.3	0	0	0	110.8	C405 E406 G411	C405-F413 WeakPolarHBondContact CA-O 3.2Å; C405-F413 WeakPolarHBondContact CB-O 3.36Å; E406-F413 PolarHBondContact N-O 3.25Å; E406-F413 PolarHBondContact O-N 2.96Å; G411-F413 WeakPolarHBondContact O-CD2 3.21Å
414	D	83.5	Confident	83.3	Confident	94 Å²	94	47.8 Å²	47.8	50%	0.503	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	134.5	173.8	-73.6	-7.4	0	0	0	109.8	K403	K403-D414 WeakPolarHBondContact CE-OD1 3.44Å; K403-D414 IonicContact NZ-OD1 3.29Å; K403-D414 PolarHBondContact NZ-OD1 3.48Å; K403-D414 IonicContact NZ-OD2 3.86Å; K403-D414 PolarHBondContact NZ-OD2 3.4Å
415	L	87	Confident	83.1	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.026	32%	0.319	C	S	.	.			trans	-107.4	142.6	-178.7	-174.5	66.7	0	0	0	110.3	D384 G385 V404 P417 A434 Y440	D384-L415 CarbonylContact C-O 3.5Å; G385-L415 WeakPolarHBondContact CA-O 3.37Å; G385-L415 PolarHBondContact N-O 2.88Å; V404-L415 HydrophobicContact CB-CD2 4.46Å; V404-L415 HydrophobicContact CG1-CD2 3.71Å; L415-P417 VanDerWaalsContact O-CD 3.31Å; L415-P417 WeakPolarHBondContact O-CD 3.5Å; L415-A434 HydrophobicContact CD1-CB 3.42Å; L415-A434 VanDerWaalsContact CD1-CB 3.42Å; L415-A434 HydrophobicContact CD2-CB 4.14Å; L415-A434 HydrophobicContact CG-CB 3.86Å; L415-Y440 HydrophobicContact CD1-CD2 4.2Å; L415-Y440 HydrophobicContact CD1-CE1 4.46Å; L415-Y440 HydrophobicContact CD1-CE2 3.43Å; L415-Y440 VanDerWaalsContact CD1-CE2 3.43Å; L415-Y440 HydrophobicContact CD2-CD1 4.31Å; L415-Y440 HydrophobicContact CD2-CD2 3.42Å; L415-Y440 VanDerWaalsContact CD2-CD2 3.42Å; L415-Y440 HydrophobicContact CD2-CE1 4.39Å; L415-Y440 HydrophobicContact CD2-CE2 3.57Å; L415-Y440 HydrophobicContact CD2-CG 3.84Å; L415-Y440 HydrophobicContact CG-CD2 4.43Å; L415-Y440 HydrophobicContact CG-CE2 4.12Å
416	Y	91.6	Very high	83.2	Confident	130 Å²	130	55.7 Å²	55.7	51%	0.51	32%	0.323	S	S	.	.			trans	-108.6	95.6	173.8	-58.3	-80.6	0	0	0	109.4	S383 A434 E435	S383-Y416 WeakPolarHBondContact O-CA 3.27Å; S383-Y416 VanDerWaalsContact O-CD1 3.27Å; S383-Y416 WeakPolarHBondContact O-CD1 3.44Å; Y416-A434 WeakPolarHBondContact O-CA 3.45Å; Y416-A434 WeakPolarHBondContact O-CB 3.37Å; Y416-E435 PolarHBondContact O-N 3.2Å
417	P	92.2	Very high	83.3	Confident	0 Å²	0	57 Å²	57	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	143.2	-176.5	35.9	-38.6	0	0	0	112	F365 L381 G382 L415 V432 G433	F365-P417 WeakPolarHBondContact CD2-O 3.41Å; L381-P417 HydrophobicContact CD1-CB 4.05Å; L381-P417 HydrophobicContact CD1-CG 3.75Å; L381-P417 HydrophobicContact CD2-CB 3.73Å; L381-P417 HydrophobicContact CD2-CG 3.98Å; L381-P417 HydrophobicContact CG-CB 4.11Å; L381-P417 HydrophobicContact CG-CG 3.8Å; G382-P417 VanDerWaalsContact O-CG 3.25Å; G382-P417 WeakPolarHBondContact O-CG 3.24Å; L415-P417 VanDerWaalsContact O-CD 3.31Å; L415-P417 WeakPolarHBondContact O-CD 3.5Å; P417-V432 HydrophobicContact CB-CG1 3.22Å; P417-V432 HydrophobicContact CG-CG1 4.44Å; P417-G433 CarbonylContact C-O 3.53Å; P417-G433 VanDerWaalsContact CA-O 3.27Å; P417-G433 WeakPolarHBondContact CA-O 3.45Å
418	T	92.9	Very high	83.9	Confident	28 Å²	28	55.3 Å²	55.3	17%	0.172	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-36	-179.5	52.1	0	0	0	0	112.4	F365 G433 E435 L468	F365-T418 VanDerWaalsContact CB-O 3.24Å; F365-T418 WeakPolarHBondContact CB-O 3.37Å; T418-G433 PolarHBondContact N-O 3.28Å; T418-G433 PolarHBondContact OG1-O 2.93Å; T418-E435 HydrophobicContact CG2-CB 4.36Å; T418-E435 HydrophobicContact CG2-CG 3.37Å; T418-L468 VanDerWaalsContact CB-O 3.24Å; T418-L468 WeakPolarHBondContact CB-O 3.45Å; T418-L468 PolarHBondContact OG1-O 3.24Å
419	C	93.1	Very high	84.9	Confident	12 Å²	12	55.7 Å²	55.7	8%	0.081	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	157.1	-175.2	60.3	0	0	0	0	111	V432 G433 I471	C419-V432 WeakPolarHBondContact O-CA 3.44Å; C419-G433 PolarHBondContact N-O 2.88Å; C419-G433 PolarHBondContact O-N 2.98Å; C419-I471 HydrophobicContact CB-CG2 4.02Å; C419-I471 VanDerWaalsContact SG-CG2 3.56Å
420	M	94.4	Very high	86	Confident	20 Å²	20	49.5 Å²	49.5	10%	0.099	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	142.2	-179.6	173.7	-173.3	67	0	0	110.1	A366 T368 I379 L381 L387 F422 A431 V432	A366-M420 HydrophobicContact CB-CB 4Å; A366-M420 HydrophobicContact CB-CE 4.29Å; T368-M420 HydrophobicContact CG2-CE 3.76Å; I379-M420 HydrophobicContact CG2-CE 4.03Å; I379-M420 HydrophobicContact CG2-SD 4.16Å; L381-M420 HydrophobicContact CB-CB 4.43Å; L381-M420 HydrophobicContact CB-CE 4.18Å; L381-M420 HydrophobicContact CB-SD 4.2Å; L381-M420 HydrophobicContact CD1-SD 4.4Å; L381-M420 HydrophobicContact CD2-CB 3.64Å; L381-M420 HydrophobicContact CG-CB 4.45Å; L387-M420 HydrophobicContact CD1-CE 4.43Å; L387-M420 HydrophobicContact CD1-SD 3.5Å; L387-M420 WeakPolarHBondContact CD1-SD 3.5Å; M420-F422 HydrophobicContact CE-CE2 3.99Å; M420-F422 HydrophobicContact CG-CE2 4.28Å; M420-F422 HydrophobicContact SD-CD2 4.49Å; M420-F422 HydrophobicContact SD-CE2 3.72Å; M420-A431 WeakPolarHBondContact CA-O 3.34Å; M420-V432 HydrophobicContact CB-CG2 4.4Å; M420-V432 HydrophobicContact CG-CG2 4.28Å
421	S	93.2	Very high	87.2	Confident	24 Å²	24	46.2 Å²	46.2	17%	0.168	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	145	171.9	-167	0	0	0	0	110.7	Y430 A431 I471 T473	S421-Y430 WeakPolarHBondContact O-CA 3.35Å; S421-A431 PolarHBondContact N-O 3.26Å; S421-A431 PolarHBondContact O-N 2.89Å; S421-I471 WeakPolarHBondContact CB-O 3.07Å; S421-T473 PolarHBondContact OG-OG1 2.92Å
422	F	92.6	Very high	88	Confident	22 Å²	22	44.8 Å²	44.8	10%	0.096	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	138.2	-179.8	-85.3	-101.5	0	0	0	110.1	T368 I370 I379 M420 V427 N429 Y430 T473	T368-F422 HydrophobicContact CG2-CD2 3.78Å; T368-F422 HydrophobicContact CG2-CE2 3.84Å; I370-F422 HydrophobicContact CD1-CD1 3.53Å; I370-F422 HydrophobicContact CD1-CD2 3.4Å; I370-F422 VanDerWaalsContact CD1-CD2 3.4Å; I370-F422 HydrophobicContact CD1-CE1 3.35Å; I370-F422 HydrophobicContact CD1-CE2 3.22Å; I370-F422 HydrophobicContact CD1-CG 3.55Å; I370-F422 HydrophobicContact CD1-CZ 3.19Å; I370-F422 HydrophobicContact CG1-CD2 4.47Å; I379-F422 HydrophobicContact CB-CE2 4.21Å; I379-F422 HydrophobicContact CB-CZ 4.29Å; I379-F422 HydrophobicContact CG1-CE2 4.36Å; I379-F422 HydrophobicContact CG1-CZ 4.04Å; I379-F422 HydrophobicContact CG2-CE2 4.04Å; I379-F422 HydrophobicContact CG2-CZ 4.01Å; M420-F422 HydrophobicContact CE-CE2 3.99Å; M420-F422 HydrophobicContact CG-CE2 4.28Å; M420-F422 HydrophobicContact SD-CD2 4.49Å; M420-F422 HydrophobicContact SD-CE2 3.72Å; F422-V427 WeakPolarHBondContact CE1-O 3.36Å; F422-N429 WeakPolarHBondContact CD1-O 3.44Å; F422-Y430 HydrophobicContact CE1-CD1 4.07Å; F422-Y430 HydrophobicContact CE1-CG 4.33Å; F422-Y430 HydrophobicContact CZ-CD1 4.06Å; F422-Y430 HydrophobicContact CZ-CG 4.19Å; F422-T473 PolarHBondContact O-OG1 3.11Å
423	F	90.4	Very high	88.9	Confident	13 Å²	13	39.9 Å²	39.9	6%	0.057	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-61.7	144.9	176.2	-66.9	-78	0	0	0	110.8	N425 D426 N429 A431 T473 S483 F486 T500	F423-N425 PolarHBondContact O-N 2.76Å; F423-D426 HydrophobicContact CB-CB 4.28Å; F423-D426 PolarHBondContact O-N 3.45Å; F423-D426 VanDerWaalsContact O-N 3.08Å; F423-N429 HydrophobicContact CB-CB 4.49Å; F423-N429 HydrophobicContact CD2-CB 3.64Å; F423-N429 HydrophobicContact CE2-CB 4.38Å; F423-N429 HydrophobicContact CG-CB 4.46Å; F423-N429 PolarHBondContact N-O 3.43Å; F423-N429 VanDerWaalsContact N-O 3.17Å; F423-A431 HydrophobicContact CE2-CB 4.17Å; F423-A431 HydrophobicContact CZ-CB 4Å; F423-T473 HydrophobicContact CD1-CG2 3.64Å; F423-T473 HydrophobicContact CE1-CG2 3.71Å; F423-T473 HydrophobicContact CG-CG2 4.09Å; F423-T473 HydrophobicContact CZ-CG2 4.19Å; F423-S483 WeakPolarHBondContact CD1-O 3.38Å; F423-F486 HydrophobicContact CE1-CB 4.4Å; F423-F486 HydrophobicContact CE1-CD1 4.18Å; F423-F486 HydrophobicContact CZ-CD1 4.19Å; F423-T500 HydrophobicContact CE1-CG2 3.68Å; F423-T500 HydrophobicContact CE2-CG2 4.12Å; F423-T500 HydrophobicContact CZ-CG2 3.28Å
424	A	82.9	Confident	89.4	Confident	22 Å²	22	34.7 Å²	34.7	18%	0.182	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	137.8	-175.7	0	0	0	0	0	111.9	D426 H474 S476	A424-D426 PolarHBondContact O-N 3.42Å; A424-D426 VanDerWaalsContact O-N 3.09Å; A424-H474 WeakPolarHBondContact CB-O 3.15Å; A424-S476 WeakPolarHBondContact CB-OG 3.27Å
425	N	79.7	Confident	89.8	Confident	154 Å²	154	34.6 Å²	34.6	82%	0.824	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	10.7	-175.6	-55.2	-25	0	0	0	115.4	F423 S476	F423-N425 PolarHBondContact O-N 2.76Å; N425-S476 PolarHBondContact ND2-O 2.81Å
426	D	83.1	Confident	90	Very high	43 Å²	43	37.9 Å²	37.9	23%	0.23	20%	0.196	C	C	.	.			trans	-115.1	129.6	178.1	-157.2	-34.4	0	0	0	111.5	F423 A424 N428 N429	F423-D426 HydrophobicContact CB-CB 4.28Å; F423-D426 PolarHBondContact O-N 3.45Å; F423-D426 VanDerWaalsContact O-N 3.08Å; A424-D426 PolarHBondContact O-N 3.42Å; A424-D426 VanDerWaalsContact O-N 3.09Å; D426-N428 WeakPolarHBondContact OD1-CA 3.49Å; D426-N428 WeakPolarHBondContact OD1-CB 3.46Å; D426-N428 PolarHBondContact OD1-N 3Å; D426-N429 HydrophobicContact CB-CB 4.29Å; D426-N429 PolarHBondContact OD1-N 3.11Å; D426-N429 WeakPolarHBondContact OD2-CB 3.27Å; D426-N429 PolarHBondContact OD2-ND2 2.86Å
427	V	83.5	Confident	89.9	Confident	46 Å²	46	31.7 Å²	31.7	28%	0.279	17%	0.172	S	C	.	.	S	Bend	trans	-97.2	-7.6	179.3	-165.8	0	0	0	0	111.5	I370 F422 R444	I370-V427 HydrophobicContact CB-CG1 4Å; I370-V427 HydrophobicContact CG2-CB 4.23Å; I370-V427 HydrophobicContact CG2-CG1 3.86Å; I370-V427 HydrophobicContact CG2-CG2 4.18Å; F422-V427 WeakPolarHBondContact CE1-O 3.36Å; V427-R444 PolarHBondContact O-NE 3.11Å
428	N	85.4	Confident	89.9	Confident	56 Å²	56	32.5 Å²	32.5	30%	0.299	18%	0.176	S	C	.	.	S	Bend	trans	-110.1	-47.7	-173.5	-62.1	-21.6	0	0	0	111.1	D426 Y430 Q443 R444 H445	D426-N428 WeakPolarHBondContact OD1-CA 3.49Å; D426-N428 WeakPolarHBondContact OD1-CB 3.46Å; D426-N428 PolarHBondContact OD1-N 3Å; N428-Y430 WeakPolarHBondContact O-CD1 3.24Å; N428-Q443 CarbonylContact O-C 3.59Å; N428-Q443 VanDerWaalsContact O-CA 3.3Å; N428-Q443 WeakPolarHBondContact O-CA 2.96Å; N428-R444 PolarHBondContact O-N 3.17Å; N428-H445 PolarHBondContact OD1-ND1 3.15Å
429	N	89	Confident	89.8	Confident	46 Å²	46	31.2 Å²	31.2	25%	0.246	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	127.5	-176.3	-64.5	-27	0	0	0	110.7	F422 F423 D426 G442 Q443	F422-N429 WeakPolarHBondContact CD1-O 3.44Å; F423-N429 HydrophobicContact CB-CB 4.49Å; F423-N429 HydrophobicContact CD2-CB 3.64Å; F423-N429 HydrophobicContact CE2-CB 4.38Å; F423-N429 HydrophobicContact CG-CB 4.46Å; F423-N429 PolarHBondContact N-O 3.43Å; F423-N429 VanDerWaalsContact N-O 3.17Å; D426-N429 HydrophobicContact CB-CB 4.29Å; D426-N429 PolarHBondContact OD1-N 3.11Å; D426-N429 WeakPolarHBondContact OD2-CB 3.27Å; D426-N429 PolarHBondContact OD2-ND2 2.86Å; N429-G442 WeakPolarHBondContact CA-O 3.31Å; N429-Q443 WeakPolarHBondContact OD1-CG 3.48Å; N429-Q443 PolarHBondContact OD1-NE2 3.05Å
430	Y	91.4	Very high	89.7	Confident	13 Å²	13	30.8 Å²	30.8	5%	0.051	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	156.9	177.5	63.7	-96.2	0	0	0	110.7	L387 V404 S421 F422 N428 V432 C441 G442 R444	L387-Y430 HydrophobicContact CD2-CD1 4.2Å; L387-Y430 HydrophobicContact CD2-CE1 3.56Å; L387-Y430 HydrophobicContact CD2-CE2 4.33Å; V404-Y430 HydrophobicContact CG2-CE2 4.29Å; S421-Y430 WeakPolarHBondContact O-CA 3.35Å; F422-Y430 HydrophobicContact CE1-CD1 4.07Å; F422-Y430 HydrophobicContact CE1-CG 4.33Å; F422-Y430 HydrophobicContact CZ-CD1 4.06Å; F422-Y430 HydrophobicContact CZ-CG 4.19Å; N428-Y430 WeakPolarHBondContact O-CD1 3.24Å; Y430-V432 HydrophobicContact CD2-CG2 3.49Å; Y430-V432 VanDerWaalsContact CD2-CG2 3.49Å; Y430-V432 HydrophobicContact CE2-CG2 3.49Å; Y430-V432 VanDerWaalsContact CE2-CG2 3.49Å; Y430-C441 WeakPolarHBondContact O-CA 3.41Å; Y430-G442 PolarHBondContact N-O 2.99Å; Y430-G442 PolarHBondContact O-N 3.11Å; Y430-R444 HydrophobicContact CD1-CB 4.49Å; Y430-R444 HydrophobicContact CE1-CB 4.26Å
431	A	92.4	Very high	89.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	139.9	171	0	0	0	0	0	109.1	M420 S421 F423 Y440 I471 T473	M420-A431 WeakPolarHBondContact CA-O 3.34Å; S421-A431 PolarHBondContact N-O 3.26Å; S421-A431 PolarHBondContact O-N 2.89Å; F423-A431 HydrophobicContact CE2-CB 4.17Å; F423-A431 HydrophobicContact CZ-CB 4Å; A431-Y440 CarbonylContact C-O 3.58Å; A431-Y440 WeakPolarHBondContact CA-O 3.03Å; A431-I471 HydrophobicContact CB-CD1 3.45Å; A431-I471 VanDerWaalsContact CB-CD1 3.45Å; A431-I471 HydrophobicContact CB-CG1 4.33Å; A431-T473 HydrophobicContact CB-CG2 4.3Å
432	V	92.8	Very high	89.1	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.2	-178.8	177	0	0	0	0	108.7	L381 P417 C419 M420 Y430 A439 Y440	L381-V432 HydrophobicContact CD1-CG2 4.46Å; L381-V432 HydrophobicContact CD2-CG1 4.36Å; P417-V432 HydrophobicContact CB-CG1 3.22Å; P417-V432 HydrophobicContact CG-CG1 4.44Å; C419-V432 WeakPolarHBondContact O-CA 3.44Å; M420-V432 HydrophobicContact CB-CG2 4.4Å; M420-V432 HydrophobicContact CG-CG2 4.28Å; Y430-V432 HydrophobicContact CD2-CG2 3.49Å; Y430-V432 VanDerWaalsContact CD2-CG2 3.49Å; Y430-V432 HydrophobicContact CE2-CG2 3.49Å; Y430-V432 VanDerWaalsContact CE2-CG2 3.49Å; V432-A439 CarbonylContact O-C 3.56Å; V432-A439 WeakPolarHBondContact O-CA 3.3Å; V432-Y440 PolarHBondContact N-O 3.43Å; V432-Y440 PolarHBondContact O-N 3.09Å
433	G	93.6	Very high	88.7	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	147	166.4	0	0	0	0	0	111	P417 T418 C419	P417-G433 CarbonylContact C-O 3.53Å; P417-G433 VanDerWaalsContact CA-O 3.27Å; P417-G433 WeakPolarHBondContact CA-O 3.45Å; T418-G433 PolarHBondContact N-O 3.28Å; T418-G433 PolarHBondContact OG1-O 2.93Å; C419-G433 PolarHBondContact N-O 2.88Å; C419-G433 PolarHBondContact O-N 2.98Å
434	A	93	Very high	88	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	164.7	-178.1	0	0	0	0	0	113.8	L415 Y416 N436 G437 N438 Y440 L468	L415-A434 HydrophobicContact CD1-CB 3.42Å; L415-A434 VanDerWaalsContact CD1-CB 3.42Å; L415-A434 HydrophobicContact CD2-CB 4.14Å; L415-A434 HydrophobicContact CG-CB 3.86Å; Y416-A434 WeakPolarHBondContact O-CA 3.45Å; Y416-A434 WeakPolarHBondContact O-CB 3.37Å; A434-N436 WeakPolarHBondContact CB-OD1 3.33Å; A434-N436 PolarHBondContact O-N 2.58Å; A434-G437 PolarHBondContact O-N 3.13Å; A434-G437 VanDerWaalsContact O-N 3.11Å; A434-N438 PolarHBondContact N-O 3.31Å; A434-N438 VanDerWaalsContact N-O 3.11Å; A434-Y440 HydrophobicContact CB-CD2 4.25Å; A434-Y440 HydrophobicContact CB-CE2 3.79Å; A434-L468 PolarHBondContact O-N 2.8Å
435	E	92.2	Very high	87.4	Confident	93 Å²	93	34.4 Å²	34.4	44%	0.435	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.8	-179.3	-68	-173.9	171.1	0	0	113.4	Y416 T418 G437 P467	Y416-E435 PolarHBondContact O-N 3.2Å; T418-E435 HydrophobicContact CG2-CB 4.36Å; T418-E435 HydrophobicContact CG2-CG 3.37Å; E435-G437 PolarHBondContact O-N 3.24Å; E435-P467 WeakPolarHBondContact O-CA 3.38Å; E435-P467 WeakPolarHBondContact O-CB 3.36Å; E435-P467 VanDerWaalsContact O-CG 3.26Å; E435-P467 WeakPolarHBondContact O-CG 3.39Å
436	N	90.8	Very high	86.3	Confident	73 Å²	73	29.8 Å²	29.8	39%	0.39	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	2	175.6	66.3	-2.9	0	0	0	113.6	A434 N438 Y440	A434-N436 WeakPolarHBondContact CB-OD1 3.33Å; A434-N436 PolarHBondContact O-N 2.58Å; N436-N438 VanDerWaalsContact C-N 3.31Å; N436-N438 PolarHBondContact ND2-ND2 3.26Å; N436-N438 WeakPolarHBondContact OD1-CB 3.38Å; N436-N438 PolarHBondContact OD1-N 3.27Å; N436-Y440 PolarHBondContact ND2-OH 2.86Å
437	G	89.5	Confident	85	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	82.4	1.7	-178.2	0	0	0	0	0	114.9	A434 E435 H464 A466	A434-G437 PolarHBondContact O-N 3.13Å; A434-G437 VanDerWaalsContact O-N 3.11Å; E435-G437 PolarHBondContact O-N 3.24Å; G437-H464 WeakPolarHBondContact O-CB 3.12Å; G437-A466 WeakPolarHBondContact CA-O 3.33Å
438	N	92.3	Very high	83.4	Confident	18 Å²	18	40.9 Å²	40.9	10%	0.096	21%	0.206	C	C	.	.			trans	-94.1	145.6	177.7	-59.1	-34.8	0	0	0	110.8	A434 N436 Y440 P460 Y461 K462 L468	A434-N438 PolarHBondContact N-O 3.31Å; A434-N438 VanDerWaalsContact N-O 3.11Å; N436-N438 VanDerWaalsContact C-N 3.31Å; N436-N438 PolarHBondContact ND2-ND2 3.26Å; N436-N438 WeakPolarHBondContact OD1-CB 3.38Å; N436-N438 PolarHBondContact OD1-N 3.27Å; N438-Y440 HydrophobicContact CB-CE2 3.64Å; N438-Y440 WeakPolarHBondContact O-CE2 3.31Å; N438-P460 HydrophobicContact CB-CB 3.92Å; N438-Y461 WeakPolarHBondContact CA-O 3.49Å; N438-K462 WeakPolarHBondContact OD1-CA 3.33Å; N438-K462 WeakPolarHBondContact OD1-CG 3.3Å; N438-L468 WeakPolarHBondContact O-CD1 3.31Å
439	A	91.7	Very high	81.7	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	152.2	165.7	0	0	0	0	0	110.5	V432 Y461 L468 I471 F486 T488	V432-A439 CarbonylContact O-C 3.56Å; V432-A439 WeakPolarHBondContact O-CA 3.3Å; A439-Y461 PolarHBondContact N-O 2.86Å; A439-Y461 WeakPolarHBondContact O-CD2 3.27Å; A439-Y461 PolarHBondContact O-N 3.15Å; A439-L468 HydrophobicContact CB-CD1 3.94Å; A439-I471 HydrophobicContact CB-CD1 4.45Å; A439-F486 HydrophobicContact CB-CE2 3.93Å; A439-F486 HydrophobicContact CB-CZ 4.49Å; A439-T488 HydrophobicContact CB-CG2 4.08Å
440	Y	90.9	Very high	79.6	Confident	3 Å²	3	40.8 Å²	40.8	1%	0.012	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	131.3	-179.8	-59.4	-96.8	0	0	0	109.2	E406 L415 A431 V432 A434 N436 N438 P460	E406-Y440 HydrophobicContact CB-CE1 3.73Å; E406-Y440 HydrophobicContact CG-CE1 3.82Å; E406-Y440 PolarHBondContact OE2-OH 2.9Å; L415-Y440 HydrophobicContact CD1-CD2 4.2Å; L415-Y440 HydrophobicContact CD1-CE1 4.46Å; L415-Y440 HydrophobicContact CD1-CE2 3.43Å; L415-Y440 VanDerWaalsContact CD1-CE2 3.43Å; L415-Y440 HydrophobicContact CD2-CD1 4.31Å; L415-Y440 HydrophobicContact CD2-CD2 3.42Å; L415-Y440 VanDerWaalsContact CD2-CD2 3.42Å; L415-Y440 HydrophobicContact CD2-CE1 4.39Å; L415-Y440 HydrophobicContact CD2-CE2 3.57Å; L415-Y440 HydrophobicContact CD2-CG 3.84Å; L415-Y440 HydrophobicContact CG-CD2 4.43Å; L415-Y440 HydrophobicContact CG-CE2 4.12Å; A431-Y440 CarbonylContact C-O 3.58Å; A431-Y440 WeakPolarHBondContact CA-O 3.03Å; V432-Y440 PolarHBondContact N-O 3.43Å; V432-Y440 PolarHBondContact O-N 3.09Å; A434-Y440 HydrophobicContact CB-CD2 4.25Å; A434-Y440 HydrophobicContact CB-CE2 3.79Å; N436-Y440 PolarHBondContact ND2-OH 2.86Å; N438-Y440 HydrophobicContact CB-CE2 3.64Å; N438-Y440 WeakPolarHBondContact O-CE2 3.31Å; Y440-P460 HydrophobicContact CD1-CB 4.37Å; Y440-P460 HydrophobicContact CE1-CB 3.69Å
441	C	89.7	Confident	77.6	Confident	18 Å²	18	45.4 Å²	45.4	12%	0.122	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.5	175.5	-66.8	0	0	0	0	109.2	Y430 R457 Y461	Y430-C441 WeakPolarHBondContact O-CA 3.41Å; C441-R457 WeakPolarHBondContact O-CA 3.26Å; C441-Y461 HydrophobicContact CB-CE2 3.83Å; C441-Y461 WeakPolarHBondContact SG-CE2 3.35Å
442	G	84.6	Confident	75.3	Confident	10 Å²	10	49.4 Å²	49.4	10%	0.103	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	166.9	-174.9	0	0	0	0	0	112.6	N429 Y430	N429-G442 WeakPolarHBondContact CA-O 3.31Å; Y430-G442 PolarHBondContact N-O 2.99Å; Y430-G442 PolarHBondContact O-N 3.11Å
443	Q	83.8	Confident	73.1	Confident	51 Å²	51	54 Å²	54	24%	0.238	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.4	172.9	-41.3	-170.6	-77.5	0	0	108.7	N428 N429	N428-Q443 CarbonylContact O-C 3.59Å; N428-Q443 VanDerWaalsContact O-CA 3.3Å; N428-Q443 WeakPolarHBondContact O-CA 2.96Å; N429-Q443 WeakPolarHBondContact OD1-CG 3.48Å; N429-Q443 PolarHBondContact OD1-NE2 3.05Å
444	R	75	Confident	71	Confident	18 Å²	18	57.9 Å²	57.9	7%	0.068	32%	0.322	C	S	.	.	S	Bend	trans	-65.5	-56.3	-179.7	-177.7	171.3	65.4	103.7	-6.8	111.6	E400 V427 N428 Y430 S446	E400-R444 IonicContact OE2-NH1 2.74Å; E400-R444 PolarHBondContact OE2-NH1 3.41Å; V427-R444 PolarHBondContact O-NE 3.11Å; N428-R444 PolarHBondContact O-N 3.17Å; Y430-R444 HydrophobicContact CD1-CB 4.49Å; Y430-R444 HydrophobicContact CE1-CB 4.26Å; R444-S446 PolarHBondContact O-N 3.44Å
445	H	71.9	Confident	68.9	Low	80 Å²	80	62.1 Å²	62.1	37%	0.37	35%	0.348	S	S	.	.	S	Bend	trans	-85.4	97.4	176.4	-60.5	113.6	0	0	0	109.9	N428 S447	N428-H445 PolarHBondContact OD1-ND1 3.15Å; H445-S447 PolarHBondContact O-N 2.82Å
446	S	56.5	Low	67.1	Low	57 Å²	57	60.2 Å²	60.2	40%	0.399	35%	0.345	S	S	.	.			trans	-75.7	64.4	171.5	-170.9	0	0	0	0	110.5	R444 R448 R457	R444-S446 PolarHBondContact O-N 3.44Å; S446-R448 PolarHBondContact O-N 3.41Å; S446-R457 PolarHBondContact OG-NH1 2.88Å; S446-R457 PolarHBondContact OG-NH2 3.38Å
447	S	55	Low	65.6	Low	86 Å²	86	58.7 Å²	58.7	60%	0.601	33%	0.333	S	S	*	.			trans	-74.9	70.6	177.7	60.4	0	0	0	0	110.8	H445 T449	H445-S447 PolarHBondContact O-N 2.82Å; S447-T449 PolarHBondContact O-N 3.21Å
448	R	51	Low	64.5	Low	235 Å²	235	61.1 Å²	61.1	89%	0.887	35%	0.345	S	S	*	.			trans	50.1	18	163.7	-59.1	173.3	61.6	-177.6	-0.8	115.8	S446 G450	S446-R448 PolarHBondContact O-N 3.41Å; R448-G450 PolarHBondContact O-N 2.86Å
449	T	49.7	Very low	63.8	Low	49 Å²	49	62.7 Å²	62.7	30%	0.301	36%	0.355	S	S	.	.			trans	-67.8	129.6	174.8	57.1	0	0	0	0	106.1	S447 E453	S447-T449 PolarHBondContact O-N 3.21Å; T449-E453 WeakPolarHBondContact CB-OE2 3.4Å; T449-E453 PolarHBondContact OG1-OE2 2.88Å
450	G	44.7	Very low	63.5	Low	51 Å²	51	63.3 Å²	63.3	53%	0.526	36%	0.359	S	S	.	.			trans	-52.9	161.9	-153.9	0	0	0	0	0	115.4	R448 A452 E453	R448-G450 PolarHBondContact O-N 2.86Å; G450-A452 PolarHBondContact O-N 3.16Å; G450-E453 PolarHBondContact O-N 3.45Å
451	V	47.8	Very low	63.4	Low	110 Å²	110	63.3 Å²	63.3	67%	0.667	36%	0.359	S	S	*	.	H	α-helix	trans	-39.5	-28.3	179.4	-173.2	0	0	0	0	114.8	T455	V451-T455 PolarHBondContact O-N 2.92Å; V451-T455 VanDerWaalsContact O-N 3.15Å; V451-T455 PolarHBondContact O-OG1 3.02Å
452	A	45.1	Very low	63.4	Low	85 Å²	85	68.4 Å²	68.4	70%	0.702	38%	0.379	S	S	*	.	H	α-helix	trans	-62.7	-44.1	175.5	0	0	0	0	0	113.7	G450 T455 S456	G450-A452 PolarHBondContact O-N 3.16Å; A452-T455 PolarHBondContact O-N 2.96Å; A452-S456 PolarHBondContact O-N 2.66Å
453	E	47.4	Very low	63.4	Low	96 Å²	96	69.4 Å²	69.4	45%	0.449	39%	0.389	S	S	.	.	H	α-helix	trans	-75.8	-33.8	178.6	-73.6	-175	169.4	0	0	111.8	T449 G450 T455 S456 R457	T449-E453 WeakPolarHBondContact CB-OE2 3.4Å; T449-E453 PolarHBondContact OG1-OE2 2.88Å; G450-E453 PolarHBondContact O-N 3.45Å; E453-T455 PolarHBondContact O-N 2.79Å; E453-S456 PolarHBondContact O-N 3.44Å; E453-R457 PolarHBondContact O-N 2.81Å; E453-R457 VanDerWaalsContact O-N 3.17Å
454	E	48	Very low	63.8	Low	81 Å²	81	67.6 Å²	67.6	38%	0.379	38%	0.381	S	S	.	.	H	α-helix	trans	-56.7	-38	170.8	-77.3	178.4	173.9	0	0	111.8	R457 H458	E454-R457 IonicContact OE1-NH2 3.23Å; E454-H458 PolarHBondContact O-CD2 2.78Å; E454-H458 VanDerWaalsContact O-CD2 3.28Å
455	T	49.6	Very low	64.6	Low	89 Å²	89	70.3 Å²	70.3	55%	0.546	41%	0.414	S	S	.	.	H	α-helix	trans	-65.9	-44.6	178.1	-52	0	0	0	0	110.9	V451 A452 E453 R457 H458 V459	V451-T455 PolarHBondContact O-N 2.92Å; V451-T455 VanDerWaalsContact O-N 3.15Å; V451-T455 PolarHBondContact O-OG1 3.02Å; A452-T455 PolarHBondContact O-N 2.96Å; E453-T455 PolarHBondContact O-N 2.79Å; T455-R457 VanDerWaalsContact C-N 3.35Å; T455-R457 PolarHBondContact O-N 3.14Å; T455-H458 PolarHBondContact O-N 2.93Å; T455-V459 WeakPolarHBondContact O-CG2 3.5Å
456	S	54.1	Low	65.7	Low	54 Å²	54	67.4 Å²	67.4	38%	0.378	40%	0.404	S	S	.	.	H	α-helix	trans	-64.4	-34.5	-179.3	-178.9	0	0	0	0	113.2	A452 E453 H458 V459	A452-S456 PolarHBondContact O-N 2.66Å; E453-S456 PolarHBondContact O-N 3.44Å; S456-H458 PolarHBondContact O-N 3.16Å; S456-H458 VanDerWaalsContact O-N 3.09Å; S456-V459 PolarHBondContact O-N 2.82Å; S456-V459 VanDerWaalsContact O-N 3.15Å
457	R	59.4	Low	67.5	Low	40 Å²	40	67 Å²	67	15%	0.151	40%	0.399	C	S	.	.	H	α-helix	trans	-55.3	-29.9	179.7	-78.3	-174.4	-110.1	178.2	-5.8	114.7	C441 S446 E453 E454 T455	C441-R457 WeakPolarHBondContact O-CA 3.26Å; S446-R457 PolarHBondContact OG-NH1 2.88Å; S446-R457 PolarHBondContact OG-NH2 3.38Å; E453-R457 PolarHBondContact O-N 2.81Å; E453-R457 VanDerWaalsContact O-N 3.17Å; E454-R457 IonicContact OE1-NH2 3.23Å; T455-R457 VanDerWaalsContact C-N 3.35Å; T455-R457 PolarHBondContact O-N 3.14Å
458	H	66.7	Low	69.5	Low	51 Å²	51	63 Å²	63	24%	0.236	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	0.3	-172.4	-66.3	-68.9	0	0	0	113.2	C405 M407 E454 T455 S456 P460	C405-H458 PolarHBondContact O-ND1 3.49Å; M407-H458 HydrophobicContact CB-CB 3.23Å; M407-H458 PolarHBondContact N-O 3.07Å; E454-H458 PolarHBondContact O-CD2 2.78Å; E454-H458 VanDerWaalsContact O-CD2 3.28Å; T455-H458 PolarHBondContact O-N 2.93Å; S456-H458 PolarHBondContact O-N 3.16Å; S456-H458 VanDerWaalsContact O-N 3.09Å; H458-P460 WeakPolarHBondContact O-CD 3.4Å
459	V	77.7	Confident	71.6	Confident	51 Å²	51	53.2 Å²	53.2	31%	0.309	34%	0.338	S	S	.	.			trans	-81.5	116.5	175	-179.2	0	0	0	0	108.4	T455 S456 H503	T455-V459 WeakPolarHBondContact O-CG2 3.5Å; S456-V459 PolarHBondContact O-N 2.82Å; S456-V459 VanDerWaalsContact O-N 3.15Å; V459-H503 VanDerWaalsContact CG1-CE1 3.44Å; V459-H503 WeakPolarHBondContact CG1-CE1 3.39Å
460	P	84.4	Confident	73.8	Confident	14 Å²	14	51.1 Å²	51.1	9%	0.091	33%	0.325	C	S	.	.			trans	-67.9	140.4	177.6	28.1	-36.1	0	0	0	111.6	N438 Y440 H458 K462	N438-P460 HydrophobicContact CB-CB 3.92Å; Y440-P460 HydrophobicContact CD1-CB 4.37Å; Y440-P460 HydrophobicContact CE1-CB 3.69Å; H458-P460 WeakPolarHBondContact O-CD 3.4Å; P460-K462 HydrophobicContact CB-CG 3.93Å; P460-K462 HydrophobicContact CG-CD 4.18Å; P460-K462 HydrophobicContact CG-CG 3.87Å; P460-K462 PolarHBondContact O-N 2.91Å
461	Y	89.7	Confident	76.2	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.016	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-81.3	96	162.9	-64.1	-97.1	0	0	0	107.4	N438 A439 C441 F486 W498 S499 T500 E502 H503	N438-Y461 WeakPolarHBondContact CA-O 3.49Å; A439-Y461 PolarHBondContact N-O 2.86Å; A439-Y461 WeakPolarHBondContact O-CD2 3.27Å; A439-Y461 PolarHBondContact O-N 3.15Å; C441-Y461 HydrophobicContact CB-CE2 3.83Å; C441-Y461 WeakPolarHBondContact SG-CE2 3.35Å; Y461-F486 HydrophobicContact CD1-CZ 4.1Å; Y461-F486 HydrophobicContact CD2-CZ 4.28Å; Y461-F486 HydrophobicContact CE1-CE1 4.43Å; Y461-F486 HydrophobicContact CE1-CZ 4.27Å; Y461-F486 HydrophobicContact CE2-CZ 4.46Å; Y461-F486 HydrophobicContact CG-CZ 4.12Å; Y461-W498 AromaticContact CD1-CE3 3.98Å; Y461-W498 HydrophobicContact CD1-CE3 3.98Å; Y461-W498 HydrophobicContact CD1-CZ3 4.5Å; Y461-W498 HydrophobicContact CG-CE3 4.41Å; Y461-S499 WeakPolarHBondContact CE1-O 3.35Å; Y461-T500 WeakPolarHBondContact OH-CA 3.37Å; Y461-T500 PolarHBondContact OH-O 3.26Å; Y461-E502 WeakPolarHBondContact CD1-O 3.35Å; Y461-E502 WeakPolarHBondContact CE1-O 3.41Å; Y461-H503 AromaticContact CD1-ND1 3.84Å; Y461-H503 AromaticContact CE1-ND1 3.67Å; Y461-H503 AromaticContact CZ-CE1 3.89Å; Y461-H503 AromaticContact CZ-ND1 3.78Å
462	K	88.3	Confident	78.5	Confident	125 Å²	125	44.4 Å²	44.4	54%	0.543	27%	0.274	S	S	.	.			trans	-91	128.7	-175.5	-61.3	-166.9	175.9	-174.4	0	110.2	N438 P460	N438-K462 WeakPolarHBondContact OD1-CA 3.33Å; N438-K462 WeakPolarHBondContact OD1-CG 3.3Å; P460-K462 HydrophobicContact CB-CG 3.93Å; P460-K462 HydrophobicContact CG-CD 4.18Å; P460-K462 HydrophobicContact CG-CG 3.87Å; P460-K462 PolarHBondContact O-N 2.91Å
463	G	85.2	Confident	80.9	Confident	30 Å²	30	41 Å²	41	31%	0.309	25%	0.245	S	C	.	.			trans	-172.5	-41.9	172.3	0	0	0	0	0	114.2	R496	G463-R496 PolarHBondContact O-NH1 3.4Å; G463-R496 PolarHBondContact O-NH2 3.02Å
464	H	93.1	Very high	83.1	Confident	14 Å²	14	36.4 Å²	36.4	7%	0.065	22%	0.223	C	C	.	.			trans	-70.7	147.6	-178.3	-71.9	-81.5	0	0	0	112.3	G437 L468 T488 S490 D492 T494 R496	G437-H464 WeakPolarHBondContact O-CB 3.12Å; H464-L468 HydrophobicContact CB-CD2 3.96Å; H464-L468 WeakPolarHBondContact CD2-CD2 3.46Å; H464-T488 PolarHBondContact NE2-OG1 2.89Å; H464-S490 VanDerWaalsContact ND1-CB 3.27Å; H464-S490 WeakPolarHBondContact ND1-CB 3.42Å; H464-D492 WeakPolarHBondContact CA-OD2 3.44Å; H464-D492 WeakPolarHBondContact CB-OD2 3.38Å; H464-D492 IonicContact CE1-OD1 2.65Å; H464-D492 IonicContact CG-OD2 3.07Å; H464-D492 IonicContact ND1-OD1 3.99Å; H464-D492 PolarHBondContact ND1-OD1 2.78Å; H464-D492 IonicContact ND1-OD2 3.83Å; H464-D492 PolarHBondContact ND1-OD2 2.88Å; H464-T494 PolarHBondContact CE1-OG1 2.87Å; H464-T494 VanDerWaalsContact CE1-OG1 3.26Å; H464-T494 PolarHBondContact ND1-OG1 3.05Å; H464-T494 VanDerWaalsContact ND1-OG1 3.11Å; H464-R496 VanDerWaalsContact CE1-CG 3.43Å; H464-R496 WeakPolarHBondContact CE1-CG 3.26Å; H464-R496 WeakPolarHBondContact NE2-CD 3.44Å
465	G	91	Very high	84.9	Confident	74 Å²	74	33.9 Å²	33.9	76%	0.763	21%	0.214	S	C	*	.	S	Bend	trans	-90.6	-5.2	178.3	0	0	0	0	0	114.1	D492	G465-D492 PolarHBondContact N-OD2 2.85Å
466	A	94.8	Very high	85.9	Confident	20 Å²	20	30.6 Å²	30.6	17%	0.165	20%	0.195	C	C	.	.	S	Bend	trans	-146	169.3	-175	0	0	0	0	0	111.1	G437 S490 L491 D492	G437-A466 WeakPolarHBondContact CA-O 3.33Å; A466-S490 PolarHBondContact O-OG 2.72Å; A466-S490 VanDerWaalsContact O-OG 3.07Å; A466-L491 HydrophobicContact CB-CB 3.95Å; A466-D492 HydrophobicContact CB-CB 3.75Å
467	P	95.2	Very high	86.3	Confident	47 Å²	47	32.4 Å²	32.4	31%	0.305	21%	0.205	S	C	.	.			trans	-53.6	140.8	178.6	-26.1	33.2	0	0	0	113.5	E435 S490 L491	E435-P467 WeakPolarHBondContact O-CA 3.38Å; E435-P467 WeakPolarHBondContact O-CB 3.36Å; E435-P467 VanDerWaalsContact O-CG 3.26Å; E435-P467 WeakPolarHBondContact O-CG 3.39Å; P467-S490 WeakPolarHBondContact O-CA 3.32Å; P467-S490 PolarHBondContact O-OG 3.38Å; P467-L491 HydrophobicContact CB-CD1 4.31Å; P467-L491 HydrophobicContact CG-CD1 4.3Å; P467-L491 PolarHBondContact O-N 3.16Å
468	L	96.1	Very high	86.4	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.016	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	132.7	172.8	-59.7	-173.4	0	0	0	110.4	T418 A434 N438 A439 H464 T488 A489	T418-L468 VanDerWaalsContact CB-O 3.24Å; T418-L468 WeakPolarHBondContact CB-O 3.45Å; T418-L468 PolarHBondContact OG1-O 3.24Å; A434-L468 PolarHBondContact O-N 2.8Å; N438-L468 WeakPolarHBondContact O-CD1 3.31Å; A439-L468 HydrophobicContact CB-CD1 3.94Å; H464-L468 HydrophobicContact CB-CD2 3.96Å; H464-L468 WeakPolarHBondContact CD2-CD2 3.46Å; L468-T488 HydrophobicContact CD1-CG2 4.06Å; L468-A489 CarbonylContact C-O 3.59Å; L468-A489 WeakPolarHBondContact CA-O 3.46Å
469	T	95.7	Very high	86.2	Confident	30 Å²	30	34.9 Å²	34.9	18%	0.184	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-39.4	179.6	51.3	0	0	0	0	111.4	A489 L491 V516 Y517	T469-A489 PolarHBondContact N-O 2.87Å; T469-A489 VanDerWaalsContact OG1-C 3.26Å; T469-A489 WeakPolarHBondContact OG1-CB 3.45Å; T469-A489 PolarHBondContact OG1-O 3.15Å; T469-L491 HydrophobicContact CG2-CD2 3.39Å; T469-L491 HydrophobicContact CG2-CG 3.61Å; T469-V516 WeakPolarHBondContact CB-O 3.29Å; T469-V516 WeakPolarHBondContact CG2-O 3.22Å; T469-V516 PolarHBondContact OG1-O 2.87Å; T469-Y517 WeakPolarHBondContact CB-O 3.29Å
470	A	95.9	Very high	85.6	Confident	4 Å²	4	37.3 Å²	37.3	3%	0.033	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	156.1	-179.1	0	0	0	0	0	112.3	T488 A489 D518 V519	A470-T488 WeakPolarHBondContact O-CA 3.03Å; A470-A489 HydrophobicContact CB-CB 4.32Å; A470-A489 PolarHBondContact O-N 3.05Å; A470-D518 HydrophobicContact CB-CB 4.43Å; A470-D518 WeakPolarHBondContact CB-OD1 3.41Å; A470-V519 HydrophobicContact CB-CG1 4.14Å
471	I	95.8	Very high	84.9	Confident	13 Å²	13	41.1 Å²	41.1	7%	0.067	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	133.6	175.5	-168.4	164.8	0	0	0	108.9	C419 S421 A431 A439 F486 L487 T488	C419-I471 HydrophobicContact CB-CG2 4.02Å; C419-I471 VanDerWaalsContact SG-CG2 3.56Å; S421-I471 WeakPolarHBondContact CB-O 3.07Å; A431-I471 HydrophobicContact CB-CD1 3.45Å; A431-I471 VanDerWaalsContact CB-CD1 3.45Å; A431-I471 HydrophobicContact CB-CG1 4.33Å; A439-I471 HydrophobicContact CB-CD1 4.45Å; I471-F486 HydrophobicContact CD1-CD2 3.93Å; I471-F486 HydrophobicContact CD1-CE2 4.29Å; I471-F486 HydrophobicContact CG1-CD2 4.19Å; I471-L487 CarbonylContact C-O 3.59Å; I471-L487 WeakPolarHBondContact CA-O 3.36Å; I471-L487 WeakPolarHBondContact CG1-O 3.49Å; I471-T488 HydrophobicContact CD1-CG2 3.98Å; I471-T488 HydrophobicContact CG1-CG2 3.97Å
472	S	95.5	Very high	84.6	Confident	8 Å²	8	41.7 Å²	41.7	6%	0.056	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	115.3	-178.8	179.3	0	0	0	0	109.5	F486 L487 V519 W521	S472-F486 CarbonylContact O-C 3.53Å; S472-F486 WeakPolarHBondContact O-CA 3.43Å; S472-L487 PolarHBondContact N-O 3.02Å; S472-L487 PolarHBondContact O-N 3.14Å; S472-V519 VanDerWaalsContact CB-O 3.31Å; S472-V519 WeakPolarHBondContact CB-O 3.5Å; S472-W521 PolarHBondContact O-NE1 2.83Å; S472-W521 PolarHBondContact OG-N 2.97Å
473	T	94.4	Very high	84.4	Confident	13 Å²	13	37.6 Å²	37.6	8%	0.08	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	147.6	175.1	54.7	0	0	0	0	110.6	S421 F422 F423 A431 F486 W521	S421-T473 PolarHBondContact OG-OG1 2.92Å; F422-T473 PolarHBondContact O-OG1 3.11Å; F423-T473 HydrophobicContact CD1-CG2 3.64Å; F423-T473 HydrophobicContact CE1-CG2 3.71Å; F423-T473 HydrophobicContact CG-CG2 4.09Å; F423-T473 HydrophobicContact CZ-CG2 4.19Å; A431-T473 HydrophobicContact CB-CG2 4.3Å; T473-F486 HydrophobicContact CG2-CB 4.1Å; T473-W521 VanDerWaalsContact C-CD1 3.46Å
474	H	93.3	Very high	84.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	26%	0.262	C	S	.	.			trans	-62.4	132	-179.6	-169.1	-84.2	0	0	0	111.9	A424 S476 F482 L485 W521 P526	A424-H474 WeakPolarHBondContact CB-O 3.15Å; H474-S476 PolarHBondContact O-N 2.89Å; H474-F482 WeakPolarHBondContact ND1-CB 3.44Å; H474-L485 HydrophobicContact CB-CB 3.98Å; H474-L485 WeakPolarHBondContact CB-O 3.41Å; H474-L485 PolarHBondContact N-O 3.15Å; H474-W521 AromaticContact CD2-CD2 3.95Å; H474-W521 AromaticContact CD2-CE3 3.79Å; H474-W521 AromaticContact CD2-CH2 3.86Å; H474-W521 AromaticContact CD2-CZ2 3.99Å; H474-W521 AromaticContact CD2-CZ3 3.76Å; H474-P526 PolarHBondContact NE2-O 2.84Å
475	P	87.3	Confident	84.6	Confident	27 Å²	27	36.6 Å²	36.6	18%	0.175	26%	0.26	C	S	.	.			trans	-77.2	114.2	174.8	27	-24.6	0	0	0	109.5	P477 W521 S522	P475-P477 WeakPolarHBondContact O-CD 3.42Å; P475-W521 HydrophobicContact CG-CB 4.12Å; P475-S522 WeakPolarHBondContact CG-O 3.48Å
476	S	70	Confident	84.7	Confident	21 Å²	21	33 Å²	33	15%	0.147	22%	0.223	C	C	.	.			trans	-101.9	75.2	-175	72.6	0	0	0	0	114.9	A424 N425 H474	A424-S476 WeakPolarHBondContact CB-OG 3.27Å; N425-S476 PolarHBondContact ND2-O 2.81Å; H474-S476 PolarHBondContact O-N 2.89Å
477	P	62.1	Low	84.8	Confident	92 Å²	92	32.1 Å²	32.1	60%	0.597	22%	0.215	S	C	*	.			trans	-115	81.4	154	34.8	-23.6	0	0	0	110.2	P475	P475-P477 WeakPolarHBondContact O-CD 3.42Å
478	G	62.8	Low	84.9	Confident	38 Å²	38	29.9 Å²	29.9	39%	0.392	20%	0.201	S	C	.	.	S	Bend	trans	-152.3	170.8	175.3	0	0	0	0	0	112.8	F480	G478-F480 VanDerWaalsContact C-N 3.26Å; G478-F480 PolarHBondContact O-N 3.35Å
479	A	62.5	Low	84.9	Confident	105 Å²	105	29.7 Å²	29.7	87%	0.868	20%	0.2	S	C	*	.	S	Bend	trans	-65.6	-31.2	179.2	0	0	0	0	0	112.6
480	F	65.2	Low	85	Confident	101 Å²	101	28.3 Å²	28.3	44%	0.443	19%	0.191	S	C	.	.	S	Bend	trans	-96	138.3	176.5	-63	-86.2	0	0	0	110.5	G478 F482 W615	G478-F480 VanDerWaalsContact C-N 3.26Å; G478-F480 PolarHBondContact O-N 3.35Å; F480-F482 HydrophobicContact CB-CD2 4.34Å; F480-F482 HydrophobicContact CB-CE1 4.36Å; F480-F482 HydrophobicContact CB-CE2 3.8Å; F480-F482 HydrophobicContact CB-CZ 3.8Å; F480-F482 HydrophobicContact CG-CZ 4.45Å; F480-F482 PolarHBondContact O-N 3.2Å; F480-W615 HydrophobicContact CD2-CB 3.89Å; F480-W615 HydrophobicContact CE2-CB 4.22Å
481	S	69.6	Low	85	Confident	95 Å²	95	30.7 Å²	30.7	66%	0.664	20%	0.203	S	C	*	.			trans	-87.5	87	-179.8	51.6	0	0	0	0	111.1	S483	S481-S483 PolarHBondContact O-N 3.42Å
482	F	83.8	Confident	85	Confident	15 Å²	15	31.7 Å²	31.7	7%	0.066	21%	0.209	C	C	.	.			trans	-86.2	11.4	169.9	-59.9	-55.6	0	0	0	113.4	H474 F480 S484 L485 P526 W615 F618 A619	H474-F482 WeakPolarHBondContact ND1-CB 3.44Å; F480-F482 HydrophobicContact CB-CD2 4.34Å; F480-F482 HydrophobicContact CB-CE1 4.36Å; F480-F482 HydrophobicContact CB-CE2 3.8Å; F480-F482 HydrophobicContact CB-CZ 3.8Å; F480-F482 HydrophobicContact CG-CZ 4.45Å; F480-F482 PolarHBondContact O-N 3.2Å; F482-S484 PolarHBondContact O-N 3.18Å; F482-L485 HydrophobicContact CB-CD1 4.11Å; F482-L485 HydrophobicContact CD1-CD1 4.11Å; F482-L485 HydrophobicContact CG-CD1 4.41Å; F482-L485 WeakPolarHBondContact O-CB 3.43Å; F482-L485 PolarHBondContact O-N 2.97Å; F482-P526 HydrophobicContact CD2-CB 4.41Å; F482-P526 HydrophobicContact CE2-CB 4.37Å; F482-W615 AromaticContact CD2-CE3 3.91Å; F482-W615 HydrophobicContact CD2-CE3 3.91Å; F482-W615 AromaticContact CD2-CZ3 3.85Å; F482-W615 HydrophobicContact CD2-CZ3 3.85Å; F482-W615 AromaticContact CE2-CE3 3.61Å; F482-W615 HydrophobicContact CE2-CE3 3.61Å; F482-W615 HydrophobicContact CE2-CZ3 4.06Å; F482-F618 HydrophobicContact CD1-CD1 4.24Å; F482-F618 HydrophobicContact CD1-CE1 4.08Å; F482-F618 HydrophobicContact CD2-CD1 4.02Å; F482-F618 HydrophobicContact CD2-CE1 4.22Å; F482-F618 AromaticContact CE1-CD1 3.92Å; F482-F618 HydrophobicContact CE1-CD1 3.92Å; F482-F618 HydrophobicContact CE1-CE1 4.17Å; F482-F618 AromaticContact CE2-CD1 3.66Å; F482-F618 HydrophobicContact CE2-CD1 3.66Å; F482-F618 HydrophobicContact CE2-CE1 4.3Å; F482-F618 HydrophobicContact CG-CD1 4.29Å; F482-F618 HydrophobicContact CG-CE1 4.12Å; F482-F618 AromaticContact CZ-CD1 3.62Å; F482-F618 HydrophobicContact CZ-CD1 3.62Å; F482-F618 HydrophobicContact CZ-CE1 4.29Å; F482-A619 HydrophobicContact CE1-CB 4.28Å; F482-A619 HydrophobicContact CZ-CB 4.07Å
483	S	83.7	Confident	84.9	Confident	39 Å²	39	37.2 Å²	37.2	27%	0.273	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.5	-178.6	-179.8	0	0	0	0	114.1	F423 S481 L485	F423-S483 WeakPolarHBondContact CD1-O 3.38Å; S481-S483 PolarHBondContact O-N 3.42Å; S483-L485 VanDerWaalsContact C-N 3.34Å
484	S	87.9	Confident	85	Confident	21 Å²	21	37.4 Å²	37.4	15%	0.147	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.2	174.7	53.9	0	0	0	0	114.7	F482 S499 T500	F482-S484 PolarHBondContact O-N 3.18Å; S484-S499 CarbonylContact O-C 3.55Å; S484-S499 WeakPolarHBondContact O-CA 3.34Å; S484-T500 WeakPolarHBondContact CB-OG1 3.42Å; S484-T500 WeakPolarHBondContact O-CG2 3.45Å; S484-T500 PolarHBondContact O-N 3.27Å
485	L	93	Very high	85.1	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	143	-174.8	-62.2	179.5	0	0	0	112.1	H474 F482 S483 L497 W498 I506 F618 L622	H474-L485 HydrophobicContact CB-CB 3.98Å; H474-L485 WeakPolarHBondContact CB-O 3.41Å; H474-L485 PolarHBondContact N-O 3.15Å; F482-L485 HydrophobicContact CB-CD1 4.11Å; F482-L485 HydrophobicContact CD1-CD1 4.11Å; F482-L485 HydrophobicContact CG-CD1 4.41Å; F482-L485 WeakPolarHBondContact O-CB 3.43Å; F482-L485 PolarHBondContact O-N 2.97Å; S483-L485 VanDerWaalsContact C-N 3.34Å; L485-L497 HydrophobicContact CB-CD1 4.45Å; L485-W498 WeakPolarHBondContact CA-O 3.39Å; L485-W498 WeakPolarHBondContact CD2-O 3.16Å; L485-I506 HydrophobicContact CD2-CD1 3.8Å; L485-F618 HydrophobicContact CD1-CE1 3.83Å; L485-F618 HydrophobicContact CD1-CZ 3.89Å; L485-L622 HydrophobicContact CD1-CD1 4.3Å; L485-L622 HydrophobicContact CD1-CD2 4.01Å; L485-L622 HydrophobicContact CD2-CD1 4.23Å; L485-L622 HydrophobicContact CD2-CD2 4.32Å
486	F	94.8	Very high	85.6	Confident	0 Å²	0	38 Å²	38	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	151.1	171.2	63.9	-85.3	0	0	0	111.1	F423 A439 Y461 I471 S472 T473 T488 W498 T500	F423-F486 HydrophobicContact CE1-CB 4.4Å; F423-F486 HydrophobicContact CE1-CD1 4.18Å; F423-F486 HydrophobicContact CZ-CD1 4.19Å; A439-F486 HydrophobicContact CB-CE2 3.93Å; A439-F486 HydrophobicContact CB-CZ 4.49Å; Y461-F486 HydrophobicContact CD1-CZ 4.1Å; Y461-F486 HydrophobicContact CD2-CZ 4.28Å; Y461-F486 HydrophobicContact CE1-CE1 4.43Å; Y461-F486 HydrophobicContact CE1-CZ 4.27Å; Y461-F486 HydrophobicContact CE2-CZ 4.46Å; Y461-F486 HydrophobicContact CG-CZ 4.12Å; I471-F486 HydrophobicContact CD1-CD2 3.93Å; I471-F486 HydrophobicContact CD1-CE2 4.29Å; I471-F486 HydrophobicContact CG1-CD2 4.19Å; S472-F486 CarbonylContact O-C 3.53Å; S472-F486 WeakPolarHBondContact O-CA 3.43Å; T473-F486 HydrophobicContact CG2-CB 4.1Å; F486-T488 HydrophobicContact CD2-CG2 4.01Å; F486-T488 HydrophobicContact CE2-CG2 4.02Å; F486-W498 HydrophobicContact CD1-CB 3.94Å; F486-W498 HydrophobicContact CD2-CB 3.86Å; F486-W498 AromaticContact CD2-CD1 3.94Å; F486-W498 HydrophobicContact CD2-CG 4.16Å; F486-W498 HydrophobicContact CE1-CB 3.5Å; F486-W498 VanDerWaalsContact CE1-CB 3.5Å; F486-W498 HydrophobicContact CE1-CG 4.46Å; F486-W498 HydrophobicContact CE2-CB 3.41Å; F486-W498 VanDerWaalsContact CE2-CB 3.41Å; F486-W498 AromaticContact CE2-CD1 3.59Å; F486-W498 HydrophobicContact CE2-CD2 4.44Å; F486-W498 AromaticContact CE2-CG 3.54Å; F486-W498 HydrophobicContact CE2-CG 3.54Å; F486-W498 HydrophobicContact CG-CB 4.12Å; F486-W498 HydrophobicContact CZ-CB 3.21Å; F486-W498 HydrophobicContact CZ-CD2 4.5Å; F486-W498 AromaticContact CZ-CG 3.72Å; F486-W498 HydrophobicContact CZ-CG 3.72Å; F486-W498 PolarHBondContact N-O 3.24Å; F486-W498 PolarHBondContact O-N 3.13Å; F486-T500 HydrophobicContact CD1-CG2 4.18Å; F486-T500 HydrophobicContact CE1-CG2 4.08Å
487	L	96.5	Very high	86.8	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	145.3	175.1	-70.7	168.8	0	0	0	109.7	I471 S472 V495 R496 L497 F509 V519 W521 F529	I471-L487 CarbonylContact C-O 3.59Å; I471-L487 WeakPolarHBondContact CA-O 3.36Å; I471-L487 WeakPolarHBondContact CG1-O 3.49Å; S472-L487 PolarHBondContact N-O 3.02Å; S472-L487 PolarHBondContact O-N 3.14Å; L487-V495 HydrophobicContact CD2-CG1 4.12Å; L487-R496 CarbonylContact C-O 3.57Å; L487-R496 VanDerWaalsContact CA-O 3.3Å; L487-R496 WeakPolarHBondContact CA-O 3.24Å; L487-L497 HydrophobicContact CD2-CB 4.03Å; L487-L497 HydrophobicContact CD2-CD1 3.84Å; L487-L497 HydrophobicContact CG-CD1 4.41Å; L487-F509 HydrophobicContact CD2-CE2 4.15Å; L487-V519 HydrophobicContact CB-CG1 4.24Å; L487-V519 HydrophobicContact CB-CG2 4.01Å; L487-V519 HydrophobicContact CD1-CG2 3.82Å; L487-W521 HydrophobicContact CD1-CD2 3.68Å; L487-W521 HydrophobicContact CD1-CE3 4.32Å; L487-W521 HydrophobicContact CD1-CG 4.11Å; L487-W521 HydrophobicContact CD1-CH2 4.15Å; L487-W521 HydrophobicContact CD1-CZ2 3.5Å; L487-W521 HydrophobicContact CD2-CZ2 4.02Å; L487-W521 HydrophobicContact CG-CD2 4.37Å; L487-W521 VanDerWaalsContact CG-CE2 3.42Å; L487-W521 HydrophobicContact CG-CH2 4.38Å; L487-W521 HydrophobicContact CG-CZ2 3.44Å; L487-W521 VanDerWaalsContact CG-CZ2 3.44Å; L487-F529 HydrophobicContact CD1-CB 3.58Å; L487-F529 HydrophobicContact CD1-CD1 3.67Å; L487-F529 HydrophobicContact CD1-CD2 3.79Å; L487-F529 HydrophobicContact CD1-CE1 4.26Å; L487-F529 HydrophobicContact CD1-CE2 4.36Å; L487-F529 HydrophobicContact CD1-CG 3.4Å
488	T	97.3	Very high	88.3	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	137.2	170.5	54.6	0	0	0	0	109.8	A439 H464 L468 A470 I471 F486 V495 R496 W498	A439-T488 HydrophobicContact CB-CG2 4.08Å; H464-T488 PolarHBondContact NE2-OG1 2.89Å; L468-T488 HydrophobicContact CD1-CG2 4.06Å; A470-T488 WeakPolarHBondContact O-CA 3.03Å; I471-T488 HydrophobicContact CD1-CG2 3.98Å; I471-T488 HydrophobicContact CG1-CG2 3.97Å; F486-T488 HydrophobicContact CD2-CG2 4.01Å; F486-T488 HydrophobicContact CE2-CG2 4.02Å; T488-V495 CarbonylContact O-C 3.53Å; T488-V495 VanDerWaalsContact O-CA 3.27Å; T488-V495 WeakPolarHBondContact O-CA 3.33Å; T488-R496 PolarHBondContact N-O 3.15Å; T488-R496 PolarHBondContact O-N 3.07Å; T488-W498 PolarHBondContact OG1-NE1 2.7Å
489	A	96.7	Very high	89.6	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	151	169	0	0	0	0	0	109.7	L468 T469 A470 V495 V516 V519	L468-A489 CarbonylContact C-O 3.59Å; L468-A489 WeakPolarHBondContact CA-O 3.46Å; T469-A489 PolarHBondContact N-O 2.87Å; T469-A489 VanDerWaalsContact OG1-C 3.26Å; T469-A489 WeakPolarHBondContact OG1-CB 3.45Å; T469-A489 PolarHBondContact OG1-O 3.15Å; A470-A489 HydrophobicContact CB-CB 4.32Å; A470-A489 PolarHBondContact O-N 3.05Å; A489-V495 HydrophobicContact CB-CG2 4.34Å; A489-V516 HydrophobicContact CB-CB 4.21Å; A489-V516 HydrophobicContact CB-CG1 3.7Å; A489-V519 HydrophobicContact CB-CB 3.97Å; A489-V519 HydrophobicContact CB-CG1 3.73Å
490	S	97.1	Very high	90.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	160.4	-173.3	177.6	0	0	0	0	112.1	H464 A466 P467 D492 W493 T494 V516	H464-S490 VanDerWaalsContact ND1-CB 3.27Å; H464-S490 WeakPolarHBondContact ND1-CB 3.42Å; A466-S490 PolarHBondContact O-OG 2.72Å; A466-S490 VanDerWaalsContact O-OG 3.07Å; P467-S490 WeakPolarHBondContact O-CA 3.32Å; P467-S490 PolarHBondContact O-OG 3.38Å; S490-D492 WeakPolarHBondContact CB-OD1 3.47Å; S490-D492 PolarHBondContact O-N 2.8Å; S490-D492 VanDerWaalsContact OG-CG 3.3Å; S490-D492 PolarHBondContact OG-N 3.13Å; S490-D492 PolarHBondContact OG-OD1 2.73Å; S490-W493 PolarHBondContact O-N 3.18Å; S490-T494 PolarHBondContact N-O 3.22Å; S490-V516 PolarHBondContact O-N 3.45Å
491	L	96	Very high	91.8	Very high	55 Å²	55	32.2 Å²	32.2	29%	0.288	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-1.3	170.8	-60	-179.6	0	0	0	113.1	A466 P467 T469 W493 Y515 Y517	A466-L491 HydrophobicContact CB-CB 3.95Å; P467-L491 HydrophobicContact CB-CD1 4.31Å; P467-L491 HydrophobicContact CG-CD1 4.3Å; P467-L491 PolarHBondContact O-N 3.16Å; T469-L491 HydrophobicContact CG2-CD2 3.39Å; T469-L491 HydrophobicContact CG2-CG 3.61Å; L491-W493 PolarHBondContact O-N 3.33Å; L491-Y515 HydrophobicContact CB-CD1 4.13Å; L491-Y515 HydrophobicContact CD2-CD1 4.24Å; L491-Y515 HydrophobicContact CD2-CD2 4.35Å; L491-Y515 HydrophobicContact CD2-CG 3.87Å; L491-Y515 WeakPolarHBondContact O-CD1 3.35Å; L491-Y515 WeakPolarHBondContact O-CE1 3.47Å; L491-Y517 HydrophobicContact CD2-CE1 4.44Å
492	D	95.3	Very high	92.6	Very high	34 Å²	34	31 Å²	31	18%	0.182	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	12.2	173.1	68	7.8	0	0	0	113.3	H464 G465 A466 S490 T494	H464-D492 WeakPolarHBondContact CA-OD2 3.44Å; H464-D492 WeakPolarHBondContact CB-OD2 3.38Å; H464-D492 IonicContact CE1-OD1 2.65Å; H464-D492 IonicContact CG-OD2 3.07Å; H464-D492 IonicContact ND1-OD1 3.99Å; H464-D492 PolarHBondContact ND1-OD1 2.78Å; H464-D492 IonicContact ND1-OD2 3.83Å; H464-D492 PolarHBondContact ND1-OD2 2.88Å; G465-D492 PolarHBondContact N-OD2 2.85Å; A466-D492 HydrophobicContact CB-CB 3.75Å; S490-D492 WeakPolarHBondContact CB-OD1 3.47Å; S490-D492 PolarHBondContact O-N 2.8Å; S490-D492 VanDerWaalsContact OG-CG 3.3Å; S490-D492 PolarHBondContact OG-N 3.13Å; S490-D492 PolarHBondContact OG-OD1 2.73Å; D492-T494 VanDerWaalsContact CG-OG1 3.28Å; D492-T494 PolarHBondContact O-N 3.08Å; D492-T494 WeakPolarHBondContact OD1-CB 3.43Å; D492-T494 PolarHBondContact OD1-N 2.9Å; D492-T494 PolarHBondContact OD1-OG1 2.89Å; D492-T494 PolarHBondContact OD2-OG1 2.87Å
493	W	94.7	Very high	92.6	Very high	124 Å²	124	33.6 Å²	33.6	47%	0.47	16%	0.155	S	C	.	.	S	Bend	trans	68.6	13.9	-179.5	-42.8	-29.9	0	0	0	113.6	S490 L491 Y512 Y515	S490-W493 PolarHBondContact O-N 3.18Å; L491-W493 PolarHBondContact O-N 3.33Å; W493-Y512 WeakPolarHBondContact O-CB 3.35Å; W493-Y515 AromaticContact CD1-CD1 3.54Å; W493-Y515 AromaticContact NE1-CD1 3.21Å; W493-Y515 AromaticContact NE1-CE1 3.33Å; W493-Y515 VanDerWaalsContact NE1-CE1 3.33Å
494	T	95.5	Very high	92.8	Very high	17 Å²	17	37.3 Å²	37.3	10%	0.104	17%	0.166	C	C	.	.			trans	-116.3	146.1	179.9	71.2	0	0	0	0	112.3	H464 S490 D492 T508 F509 D510	H464-T494 PolarHBondContact CE1-OG1 2.87Å; H464-T494 VanDerWaalsContact CE1-OG1 3.26Å; H464-T494 PolarHBondContact ND1-OG1 3.05Å; H464-T494 VanDerWaalsContact ND1-OG1 3.11Å; S490-T494 PolarHBondContact N-O 3.22Å; D492-T494 VanDerWaalsContact CG-OG1 3.28Å; D492-T494 PolarHBondContact O-N 3.08Å; D492-T494 WeakPolarHBondContact OD1-CB 3.43Å; D492-T494 PolarHBondContact OD1-N 2.9Å; D492-T494 PolarHBondContact OD1-OG1 2.89Å; D492-T494 PolarHBondContact OD2-OG1 2.87Å; T494-T508 HydrophobicContact CG2-CG2 3.94Å; T494-F509 WeakPolarHBondContact CA-O 3.26Å; T494-D510 HydrophobicContact CG2-CB 4.28Å
495	V	96.6	Very high	93	Very high	0 Å²	0	37 Å²	37	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138.4	160.6	179.5	0	0	0	0	107.4	L487 T488 A489 F509 Y512 V516 V519 F529 A531	L487-V495 HydrophobicContact CD2-CG1 4.12Å; T488-V495 CarbonylContact O-C 3.53Å; T488-V495 VanDerWaalsContact O-CA 3.27Å; T488-V495 WeakPolarHBondContact O-CA 3.33Å; A489-V495 HydrophobicContact CB-CG2 4.34Å; V495-F509 HydrophobicContact CB-CB 4.19Å; V495-F509 HydrophobicContact CB-CD2 4.13Å; V495-F509 HydrophobicContact CG1-CD2 4.08Å; V495-F509 PolarHBondContact N-O 3.18Å; V495-F509 VanDerWaalsContact N-O 3.08Å; V495-F509 WeakPolarHBondContact O-CD2 3.39Å; V495-F509 PolarHBondContact O-N 3.19Å; V495-Y512 HydrophobicContact CG2-CE2 3.98Å; V495-V516 HydrophobicContact CG2-CB 4.5Å; V495-V516 HydrophobicContact CG2-CG1 3.81Å; V495-V516 HydrophobicContact CG2-CG2 4.4Å; V495-V519 HydrophobicContact CG1-CG2 4.04Å; V495-F529 HydrophobicContact CG1-CE2 4.15Å; V495-A531 HydrophobicContact CG2-CB 4.21Å
496	R	95.9	Very high	92.9	Very high	38 Å²	38	37 Å²	37	14%	0.143	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.7	178.6	-67.6	-175.7	-169.1	-157.9	9.5	112.2	G463 H464 L487 T488 W498 P505 H507 T508	G463-R496 PolarHBondContact O-NH1 3.4Å; G463-R496 PolarHBondContact O-NH2 3.02Å; H464-R496 VanDerWaalsContact CE1-CG 3.43Å; H464-R496 WeakPolarHBondContact CE1-CG 3.26Å; H464-R496 WeakPolarHBondContact NE2-CD 3.44Å; L487-R496 CarbonylContact C-O 3.57Å; L487-R496 VanDerWaalsContact CA-O 3.3Å; L487-R496 WeakPolarHBondContact CA-O 3.24Å; T488-R496 PolarHBondContact N-O 3.15Å; T488-R496 PolarHBondContact O-N 3.07Å; R496-W498 HydrophobicContact CB-CZ2 4.12Å; R496-P505 HydrophobicContact CB-CB 4.35Å; R496-H507 WeakPolarHBondContact CA-O 3.43Å; R496-T508 HydrophobicContact CG-CG2 3.92Å
497	L	95.4	Very high	92.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.8	172.8	-179.7	64.8	0	0	0	110	L485 L487 P505 I506 H507 F509 W521 M543 L622	L485-L497 HydrophobicContact CB-CD1 4.45Å; L487-L497 HydrophobicContact CD2-CB 4.03Å; L487-L497 HydrophobicContact CD2-CD1 3.84Å; L487-L497 HydrophobicContact CG-CD1 4.41Å; L497-P505 CarbonylContact O-C 3.52Å; L497-I506 HydrophobicContact CD2-CB 4.39Å; L497-I506 HydrophobicContact CD2-CD1 4.43Å; L497-I506 HydrophobicContact CD2-CG2 4.46Å; L497-I506 HydrophobicContact CG-CB 4.36Å; L497-I506 HydrophobicContact CG-CD1 4.24Å; L497-I506 PolarHBondContact O-N 3.33Å; L497-H507 HydrophobicContact CB-CB 4.29Å; L497-H507 PolarHBondContact N-O 2.92Å; L497-F509 HydrophobicContact CB-CE2 4.19Å; L497-W521 HydrophobicContact CD1-CH2 4.27Å; L497-W521 HydrophobicContact CD1-CZ2 3.83Å; L497-M543 HydrophobicContact CD2-SD 4.16Å; L497-L622 HydrophobicContact CD2-CD1 4Å
498	W	93.7	Very high	92.7	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	153.9	-179	-56.4	90	0	0	0	110.9	Y461 L485 F486 T488 R496 K504 P505	Y461-W498 AromaticContact CD1-CE3 3.98Å; Y461-W498 HydrophobicContact CD1-CE3 3.98Å; Y461-W498 HydrophobicContact CD1-CZ3 4.5Å; Y461-W498 HydrophobicContact CG-CE3 4.41Å; L485-W498 WeakPolarHBondContact CA-O 3.39Å; L485-W498 WeakPolarHBondContact CD2-O 3.16Å; F486-W498 HydrophobicContact CD1-CB 3.94Å; F486-W498 HydrophobicContact CD2-CB 3.86Å; F486-W498 AromaticContact CD2-CD1 3.94Å; F486-W498 HydrophobicContact CD2-CG 4.16Å; F486-W498 HydrophobicContact CE1-CB 3.5Å; F486-W498 VanDerWaalsContact CE1-CB 3.5Å; F486-W498 HydrophobicContact CE1-CG 4.46Å; F486-W498 HydrophobicContact CE2-CB 3.41Å; F486-W498 VanDerWaalsContact CE2-CB 3.41Å; F486-W498 AromaticContact CE2-CD1 3.59Å; F486-W498 HydrophobicContact CE2-CD2 4.44Å; F486-W498 AromaticContact CE2-CG 3.54Å; F486-W498 HydrophobicContact CE2-CG 3.54Å; F486-W498 HydrophobicContact CG-CB 4.12Å; F486-W498 HydrophobicContact CZ-CB 3.21Å; F486-W498 HydrophobicContact CZ-CD2 4.5Å; F486-W498 AromaticContact CZ-CG 3.72Å; F486-W498 HydrophobicContact CZ-CG 3.72Å; F486-W498 PolarHBondContact N-O 3.24Å; F486-W498 PolarHBondContact O-N 3.13Å; T488-W498 PolarHBondContact OG1-NE1 2.7Å; R496-W498 HydrophobicContact CB-CZ2 4.12Å; W498-K504 VanDerWaalsContact CZ3-C 3.5Å; W498-P505 HydrophobicContact CD2-CB 4.08Å; W498-P505 VanDerWaalsContact CE3-CA 3.45Å; W498-P505 HydrophobicContact CE3-CB 3.88Å; W498-P505 HydrophobicContact CH2-CB 3.62Å; W498-P505 HydrophobicContact CH2-CG 3.87Å; W498-P505 HydrophobicContact CZ2-CB 3.81Å; W498-P505 HydrophobicContact CZ2-CG 4.41Å; W498-P505 HydrophobicContact CZ3-CB 3.67Å; W498-P505 VanDerWaalsContact CZ3-CD 3.43Å; W498-P505 HydrophobicContact CZ3-CG 4.04Å
499	S	90.8	Very high	92.5	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.6	167.8	162.6	0	0	0	0	108.1	Y461 S484 R501 E502	Y461-S499 WeakPolarHBondContact CE1-O 3.35Å; S484-S499 CarbonylContact O-C 3.55Å; S484-S499 WeakPolarHBondContact O-CA 3.34Å; S499-R501 PolarHBondContact O-N 3.25Å; S499-R501 PolarHBondContact OG-N 2.74Å; S499-E502 PolarHBondContact O-N 3.26Å
500	T	87.1	Confident	92.3	Very high	42 Å²	42	46.3 Å²	46.3	26%	0.258	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-19.5	174.9	54.9	0	0	0	0	113.2	F423 Y461 S484 F486	F423-T500 HydrophobicContact CE1-CG2 3.68Å; F423-T500 HydrophobicContact CE2-CG2 4.12Å; F423-T500 HydrophobicContact CZ-CG2 3.28Å; Y461-T500 WeakPolarHBondContact OH-CA 3.37Å; Y461-T500 PolarHBondContact OH-O 3.26Å; S484-T500 WeakPolarHBondContact CB-OG1 3.42Å; S484-T500 WeakPolarHBondContact O-CG2 3.45Å; S484-T500 PolarHBondContact O-N 3.27Å; F486-T500 HydrophobicContact CD1-CG2 4.18Å; F486-T500 HydrophobicContact CE1-CG2 4.08Å
501	R	87	Confident	92	Very high	191 Å²	191	49.2 Å²	49.2	72%	0.721	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-21.5	179.2	-54.5	-178.6	-176.6	173.2	3.4	113.8	S499	S499-R501 PolarHBondContact O-N 3.25Å; S499-R501 PolarHBondContact OG-N 2.74Å
502	E	85.2	Confident	91.8	Very high	70 Å²	70	47.2 Å²	47.2	33%	0.327	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.2	-170.3	-72.7	159.4	-151.7	0	0	109.6	Y461 S499 K504 K626	Y461-E502 WeakPolarHBondContact CD1-O 3.35Å; Y461-E502 WeakPolarHBondContact CE1-O 3.41Å; S499-E502 PolarHBondContact O-N 3.26Å; E502-K504 VanDerWaalsContact C-N 3.29Å; E502-K504 PolarHBondContact O-N 2.94Å; E502-K626 IonicContact OE1-NZ 2.7Å; E502-K626 PolarHBondContact OE1-NZ 3.23Å; E502-K626 IonicContact OE2-NZ 2.73Å; E502-K626 PolarHBondContact OE2-NZ 3.11Å
503	H	84.1	Confident	91.4	Very high	70 Å²	70	50 Å²	50	32%	0.324	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-1.1	-178.5	-71.7	-72.2	0	0	0	114.2	V459 Y461	V459-H503 VanDerWaalsContact CG1-CE1 3.44Å; V459-H503 WeakPolarHBondContact CG1-CE1 3.39Å; Y461-H503 AromaticContact CD1-ND1 3.84Å; Y461-H503 AromaticContact CE1-ND1 3.67Å; Y461-H503 AromaticContact CZ-CE1 3.89Å; Y461-H503 AromaticContact CZ-ND1 3.78Å
504	K	88.4	Confident	91.3	Very high	116 Å²	116	46.3 Å²	46.3	50%	0.504	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	148.5	170.9	-70.5	-175.2	177.4	-177.7	0	109.6	W498 E502 E633	W498-K504 VanDerWaalsContact CZ3-C 3.5Å; E502-K504 VanDerWaalsContact C-N 3.29Å; E502-K504 PolarHBondContact O-N 2.94Å; K504-E633 IonicContact NZ-OE1 3.77Å; K504-E633 PolarHBondContact NZ-OE1 3.25Å
505	P	91.3	Very high	91.3	Very high	14 Å²	14	50.3 Å²	50.3	9%	0.091	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128.5	178.1	28.1	-31	0	0	0	110.1	R496 L497 W498 H507 E629	R496-P505 HydrophobicContact CB-CB 4.35Å; L497-P505 CarbonylContact O-C 3.52Å; W498-P505 HydrophobicContact CD2-CB 4.08Å; W498-P505 VanDerWaalsContact CE3-CA 3.45Å; W498-P505 HydrophobicContact CE3-CB 3.88Å; W498-P505 HydrophobicContact CH2-CB 3.62Å; W498-P505 HydrophobicContact CH2-CG 3.87Å; W498-P505 HydrophobicContact CZ2-CB 3.81Å; W498-P505 HydrophobicContact CZ2-CG 4.41Å; W498-P505 HydrophobicContact CZ3-CB 3.67Å; W498-P505 VanDerWaalsContact CZ3-CD 3.43Å; W498-P505 HydrophobicContact CZ3-CG 4.04Å; P505-H507 VanDerWaalsContact C-N 3.32Å; P505-H507 PolarHBondContact O-N 3.46Å; P505-E629 VanDerWaalsContact O-CD 3.22Å; P505-E629 VanDerWaalsContact O-OE1 3.09Å
506	I	91.9	Very high	91.2	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.015	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	-38.7	-179.6	-53.9	173.5	0	0	0	111.4	L485 L497 L622 L625 K626	L485-I506 HydrophobicContact CD2-CD1 3.8Å; L497-I506 HydrophobicContact CD2-CB 4.39Å; L497-I506 HydrophobicContact CD2-CD1 4.43Å; L497-I506 HydrophobicContact CD2-CG2 4.46Å; L497-I506 HydrophobicContact CG-CB 4.36Å; L497-I506 HydrophobicContact CG-CD1 4.24Å; L497-I506 PolarHBondContact O-N 3.33Å; I506-L622 HydrophobicContact CD1-CD1 3.88Å; I506-L622 HydrophobicContact CG2-CD1 4.1Å; I506-L625 HydrophobicContact CG2-CB 4.16Å; I506-K626 HydrophobicContact CG2-CG 3.84Å
507	H	92.7	Very high	91.3	Very high	36 Å²	36	51.7 Å²	51.7	17%	0.167	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	148.7	-178.6	-169.7	-100.2	0	0	0	110.3	R496 L497 P505 F509 A547 L625	R496-H507 WeakPolarHBondContact CA-O 3.43Å; L497-H507 HydrophobicContact CB-CB 4.29Å; L497-H507 PolarHBondContact N-O 2.92Å; P505-H507 VanDerWaalsContact C-N 3.32Å; P505-H507 PolarHBondContact O-N 3.46Å; H507-F509 AromaticContact CE1-CD1 3.74Å; H507-F509 AromaticContact CE1-CE1 3.77Å; H507-F509 AromaticContact ND1-CD1 3.58Å; H507-F509 AromaticContact ND1-CD2 3.96Å; H507-F509 AromaticContact ND1-CE1 3.36Å; H507-F509 WeakPolarHBondContact ND1-CE1 3.1Å; H507-F509 AromaticContact ND1-CE2 3.77Å; H507-F509 AromaticContact ND1-CG 3.87Å; H507-F509 AromaticContact ND1-CZ 3.46Å; H507-F509 WeakPolarHBondContact ND1-CZ 3.33Å; H507-A547 PolarHBondContact CE1-O 3.47Å; H507-L625 HydrophobicContact CB-CD1 4.16Å
508	T	93.5	Very high	91.3	Very high	44 Å²	44	52.7 Å²	52.7	27%	0.27	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	123.4	176	-58.1	0	0	0	0	108.6	T494 R496	T494-T508 HydrophobicContact CG2-CG2 3.94Å; R496-T508 HydrophobicContact CG-CG2 3.92Å
509	F	94.9	Very high	91.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	112.6	174.6	-52.9	-87.5	0	0	0	108.3	L487 T494 V495 L497 H507 F529 W541 M543 A547	L487-F509 HydrophobicContact CD2-CE2 4.15Å; T494-F509 WeakPolarHBondContact CA-O 3.26Å; V495-F509 HydrophobicContact CB-CB 4.19Å; V495-F509 HydrophobicContact CB-CD2 4.13Å; V495-F509 HydrophobicContact CG1-CD2 4.08Å; V495-F509 PolarHBondContact N-O 3.18Å; V495-F509 VanDerWaalsContact N-O 3.08Å; V495-F509 WeakPolarHBondContact O-CD2 3.39Å; V495-F509 PolarHBondContact O-N 3.19Å; L497-F509 HydrophobicContact CB-CE2 4.19Å; H507-F509 AromaticContact CE1-CD1 3.74Å; H507-F509 AromaticContact CE1-CE1 3.77Å; H507-F509 AromaticContact ND1-CD1 3.58Å; H507-F509 AromaticContact ND1-CD2 3.96Å; H507-F509 AromaticContact ND1-CE1 3.36Å; H507-F509 WeakPolarHBondContact ND1-CE1 3.1Å; H507-F509 AromaticContact ND1-CE2 3.77Å; H507-F509 AromaticContact ND1-CG 3.87Å; H507-F509 AromaticContact ND1-CZ 3.46Å; H507-F509 WeakPolarHBondContact ND1-CZ 3.33Å; F509-F529 HydrophobicContact CD1-CZ 4.15Å; F509-F529 AromaticContact CD2-CZ 3.92Å; F509-F529 HydrophobicContact CD2-CZ 3.92Å; F509-F529 HydrophobicContact CE1-CE1 4.16Å; F509-F529 AromaticContact CE1-CZ 4Å; F509-F529 HydrophobicContact CE1-CZ 4Å; F509-F529 HydrophobicContact CE2-CE1 4.02Å; F509-F529 AromaticContact CE2-CZ 3.77Å; F509-F529 HydrophobicContact CE2-CZ 3.77Å; F509-F529 HydrophobicContact CG-CZ 4.13Å; F509-F529 AromaticContact CZ-CE1 3.77Å; F509-F529 HydrophobicContact CZ-CE1 3.77Å; F509-F529 AromaticContact CZ-CZ 3.81Å; F509-F529 HydrophobicContact CZ-CZ 3.81Å; F509-W541 HydrophobicContact CB-CH2 4.09Å; F509-W541 HydrophobicContact CB-CZ2 4.23Å; F509-W541 HydrophobicContact CB-CZ3 4.41Å; F509-W541 HydrophobicContact CD1-CD2 4.22Å; F509-W541 AromaticContact CD1-CE3 3.65Å; F509-W541 HydrophobicContact CD1-CE3 3.65Å; F509-W541 HydrophobicContact CD1-CH2 4.14Å; F509-W541 AromaticContact CD1-CZ3 3.6Å; F509-W541 HydrophobicContact CD1-CZ3 3.6Å; F509-W541 HydrophobicContact CE1-CE3 4.1Å; F509-W541 HydrophobicContact CE1-CZ3 4.38Å; F509-W541 HydrophobicContact CG-CZ3 4.44Å; F509-M543 HydrophobicContact CE1-CG 4.1Å; F509-M543 HydrophobicContact CZ-CG 3.92Å; F509-M543 HydrophobicContact CZ-SD 3.81Å; F509-A547 WeakPolarHBondContact CD1-O 3.45Å; F509-A547 VanDerWaalsContact CE1-O 3.31Å; F509-A547 WeakPolarHBondContact CE1-O 2.95Å
510	D	91.5	Very high	91.7	Very high	116 Å²	116	53 Å²	53	62%	0.62	26%	0.257	S	S	*	.			trans	-123.7	22.5	-169.2	66.2	-21	0	0	0	114.5	T494 Y512	T494-D510 HydrophobicContact CG2-CB 4.28Å; D510-Y512 PolarHBondContact O-N 3.43Å
511	D	91.1	Very high	92.2	Very high	60 Å²	60	51.3 Å²	51.3	32%	0.321	25%	0.246	S	C	.	.			trans	-74.6	-3.4	177.9	-173.4	62	0	0	0	114.3	W541 P550 R553	D511-W541 HydrophobicContact CB-CH2 3.92Å; D511-W541 HydrophobicContact CB-CZ2 4.24Å; D511-P550 VanDerWaalsContact OD2-CD 3.29Å; D511-P550 WeakPolarHBondContact OD2-CD 3.43Å; D511-R553 IonicContact OD2-CZ 2.68Å; D511-R553 IonicContact OD2-NH1 2.78Å; D511-R553 PolarHBondContact OD2-NH1 3.31Å; D511-R553 IonicContact OD2-NH2 3.76Å; D511-R553 PolarHBondContact OD2-NH2 2.74Å
512	Y	90.5	Very high	92.5	Very high	14 Å²	14	42.2 Å²	42.2	6%	0.055	21%	0.212	C	C	.	.			trans	-82.1	150	-176.2	-62.8	-83.2	0	0	0	113.3	W493 V495 D510 V516 A531 D533 D539 W541	W493-Y512 WeakPolarHBondContact O-CB 3.35Å; V495-Y512 HydrophobicContact CG2-CE2 3.98Å; D510-Y512 PolarHBondContact O-N 3.43Å; Y512-V516 HydrophobicContact CD1-CG2 3.93Å; Y512-V516 HydrophobicContact CD2-CG2 3.65Å; Y512-V516 HydrophobicContact CE1-CG2 4.28Å; Y512-V516 HydrophobicContact CE2-CG2 4.06Å; Y512-V516 HydrophobicContact CG-CG2 3.6Å; Y512-A531 WeakPolarHBondContact OH-CB 3.39Å; Y512-D533 HydrophobicContact CD1-CB 3.89Å; Y512-D533 HydrophobicContact CE1-CB 4.23Å; Y512-D539 HydrophobicContact CE1-CB 4.4Å; Y512-D539 WeakPolarHBondContact CE1-OD2 3.41Å; Y512-D539 PolarHBondContact OH-OD2 2.89Å; Y512-W541 HydrophobicContact CE2-CZ2 4.02Å; Y512-W541 AromaticContact CZ-NE1 3.87Å; Y512-W541 PolarHBondContact OH-NE1 3.13Å
513	S	88.3	Confident	92.8	Very high	91 Å²	91	40.8 Å²	40.8	64%	0.636	21%	0.208	S	C	*	.	S	Bend	trans	-109.8	-2	176.8	60.4	0	0	0	0	114.3
514	D	92.1	Very high	93.1	Very high	47 Å²	47	39.9 Å²	39.9	25%	0.251	21%	0.208	S	C	.	.	S	Bend	trans	-152.1	179	-177.8	-159.1	-0.4	0	0	0	110.5	V516 T535	D514-V516 PolarHBondContact O-N 3.34Å; D514-T535 HydrophobicContact CB-CG2 3.39Å
515	Y	94.6	Very high	93.2	Very high	101 Å²	101	34.5 Å²	34.5	40%	0.396	18%	0.184	S	C	.	.			trans	-56.5	131.2	-177.8	-56.4	-35	0	0	0	112.6	L491 W493 D533 G534	L491-Y515 HydrophobicContact CB-CD1 4.13Å; L491-Y515 HydrophobicContact CD2-CD1 4.24Å; L491-Y515 HydrophobicContact CD2-CD2 4.35Å; L491-Y515 HydrophobicContact CD2-CG 3.87Å; L491-Y515 WeakPolarHBondContact O-CD1 3.35Å; L491-Y515 WeakPolarHBondContact O-CE1 3.47Å; W493-Y515 AromaticContact CD1-CD1 3.54Å; W493-Y515 AromaticContact NE1-CD1 3.21Å; W493-Y515 AromaticContact NE1-CE1 3.33Å; W493-Y515 VanDerWaalsContact NE1-CE1 3.33Å; Y515-D533 CarbonylContact O-C 3.53Å; Y515-D533 VanDerWaalsContact O-CA 3.3Å; Y515-D533 WeakPolarHBondContact O-CA 3.44Å; Y515-G534 PolarHBondContact O-N 2.68Å
516	V	96.4	Very high	93.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	114.9	171.6	-171.2	0	0	0	0	108	T469 A489 S490 V495 Y512 D514 A531 V532	T469-V516 WeakPolarHBondContact CB-O 3.29Å; T469-V516 WeakPolarHBondContact CG2-O 3.22Å; T469-V516 PolarHBondContact OG1-O 2.87Å; A489-V516 HydrophobicContact CB-CB 4.21Å; A489-V516 HydrophobicContact CB-CG1 3.7Å; S490-V516 PolarHBondContact O-N 3.45Å; V495-V516 HydrophobicContact CG2-CB 4.5Å; V495-V516 HydrophobicContact CG2-CG1 3.81Å; V495-V516 HydrophobicContact CG2-CG2 4.4Å; Y512-V516 HydrophobicContact CD1-CG2 3.93Å; Y512-V516 HydrophobicContact CD2-CG2 3.65Å; Y512-V516 HydrophobicContact CE1-CG2 4.28Å; Y512-V516 HydrophobicContact CE2-CG2 4.06Å; Y512-V516 HydrophobicContact CG-CG2 3.6Å; D514-V516 PolarHBondContact O-N 3.34Å; V516-A531 HydrophobicContact CG1-CB 4.36Å; V516-V532 CarbonylContact C-O 3.53Å; V516-V532 WeakPolarHBondContact CA-O 3.27Å; V516-V532 WeakPolarHBondContact CG1-O 3.19Å
517	Y	96	Very high	93.2	Very high	67 Å²	67	33.7 Å²	33.7	26%	0.263	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-29.8	-172.9	-74	-70.4	0	0	0	113.9	T469 L491 V532 G534 L577 N578	T469-Y517 WeakPolarHBondContact CB-O 3.29Å; L491-Y517 HydrophobicContact CD2-CE1 4.44Å; Y517-V532 PolarHBondContact N-O 2.85Å; Y517-G534 VanDerWaalsContact CE2-CA 3.44Å; Y517-L577 WeakPolarHBondContact CD2-O 3.18Å; Y517-N578 WeakPolarHBondContact CB-O 3.26Å
518	D	96.9	Very high	93.3	Very high	22 Å²	22	32 Å²	32	12%	0.118	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	152.2	-179.5	-156.2	5.8	0	0	0	112.2	A470 A531 V532 K579 C580	A470-D518 HydrophobicContact CB-CB 4.43Å; A470-D518 WeakPolarHBondContact CB-OD1 3.41Å; D518-A531 WeakPolarHBondContact O-CA 3.18Å; D518-V532 PolarHBondContact O-N 3.46Å; D518-K579 HydrophobicContact CB-CD 4.41Å; D518-K579 WeakPolarHBondContact OD2-CA 3.49Å; D518-K579 WeakPolarHBondContact OD2-CD 3.41Å; D518-C580 PolarHBondContact OD2-N 2.76Å
519	V	96.9	Very high	93.4	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	133.3	173.5	63.6	0	0	0	0	108.7	A470 S472 L487 A489 V495 F529 S530 A531	A470-V519 HydrophobicContact CB-CG1 4.14Å; S472-V519 VanDerWaalsContact CB-O 3.31Å; S472-V519 WeakPolarHBondContact CB-O 3.5Å; L487-V519 HydrophobicContact CB-CG1 4.24Å; L487-V519 HydrophobicContact CB-CG2 4.01Å; L487-V519 HydrophobicContact CD1-CG2 3.82Å; A489-V519 HydrophobicContact CB-CB 3.97Å; A489-V519 HydrophobicContact CB-CG1 3.73Å; V495-V519 HydrophobicContact CG1-CG2 4.04Å; V519-F529 HydrophobicContact CG2-CD2 3.84Å; V519-F529 HydrophobicContact CG2-CE2 4.4Å; V519-S530 CarbonylContact C-O 3.57Å; V519-S530 WeakPolarHBondContact CA-O 3.44Å; V519-A531 HydrophobicContact CG2-CB 4.39Å
520	C	96.2	Very high	93.5	Very high	7 Å²	7	29.9 Å²	29.9	5%	0.047	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	127.7	178.9	-168.8	0	0	0	0	110.2	F529 S530 W582	C520-F529 CarbonylContact O-C 3.48Å; C520-F529 WeakPolarHBondContact O-CA 3.46Å; C520-F529 WeakPolarHBondContact O-CB 3.5Å; C520-S530 PolarHBondContact N-O 2.88Å; C520-S530 PolarHBondContact O-N 3.08Å; C520-S530 PolarHBondContact O-OG 2.8Å; C520-W582 PolarHBondContact O-NE1 3.15Å; C520-W582 VanDerWaalsContact O-NE1 3.07Å
521	W	95.9	Very high	93.7	Very high	7 Å²	7	24.3 Å²	24.3	3%	0.027	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	146.5	171.8	-79	106.9	0	0	0	110.3	S472 T473 H474 P475 L487 L497 P526 F529 M543 W582 F618	S472-W521 PolarHBondContact O-NE1 2.83Å; S472-W521 PolarHBondContact OG-N 2.97Å; T473-W521 VanDerWaalsContact C-CD1 3.46Å; H474-W521 AromaticContact CD2-CD2 3.95Å; H474-W521 AromaticContact CD2-CE3 3.79Å; H474-W521 AromaticContact CD2-CH2 3.86Å; H474-W521 AromaticContact CD2-CZ2 3.99Å; H474-W521 AromaticContact CD2-CZ3 3.76Å; P475-W521 HydrophobicContact CG-CB 4.12Å; L487-W521 HydrophobicContact CD1-CD2 3.68Å; L487-W521 HydrophobicContact CD1-CE3 4.32Å; L487-W521 HydrophobicContact CD1-CG 4.11Å; L487-W521 HydrophobicContact CD1-CH2 4.15Å; L487-W521 HydrophobicContact CD1-CZ2 3.5Å; L487-W521 HydrophobicContact CD2-CZ2 4.02Å; L487-W521 HydrophobicContact CG-CD2 4.37Å; L487-W521 VanDerWaalsContact CG-CE2 3.42Å; L487-W521 HydrophobicContact CG-CH2 4.38Å; L487-W521 HydrophobicContact CG-CZ2 3.44Å; L487-W521 VanDerWaalsContact CG-CZ2 3.44Å; L497-W521 HydrophobicContact CD1-CH2 4.27Å; L497-W521 HydrophobicContact CD1-CZ2 3.83Å; W521-P526 WeakPolarHBondContact CZ3-O 3.49Å; W521-F529 HydrophobicContact CD2-CB 4.25Å; W521-F529 HydrophobicContact CE3-CB 4.06Å; W521-F529 HydrophobicContact CZ3-CD1 4.34Å; W521-M543 HydrophobicContact CH2-CE 3.36Å; W521-M543 HydrophobicContact CH2-SD 4.49Å; W521-M543 HydrophobicContact CZ3-CE 3.5Å; W521-M543 VanDerWaalsContact CZ3-CE 3.5Å; W521-W582 VanDerWaalsContact O-CD1 3.26Å; W521-F618 HydrophobicContact CH2-CZ 4.31Å
522	S	94	Very high	93.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.113	C	C	.	.			trans	-64	130	164.2	175.8	0	0	0	0	109.1	P475 V524 H525 V528	P475-S522 WeakPolarHBondContact CG-O 3.48Å; S522-V524 PolarHBondContact O-N 2.81Å; S522-H525 PolarHBondContact OG-N 2.88Å; S522-V528 VanDerWaalsContact CB-O 3.29Å; S522-V528 WeakPolarHBondContact CB-O 3.46Å; S522-V528 PolarHBondContact N-O 3.08Å
523	P	91	Very high	94.1	Very high	39 Å²	39	20.9 Å²	20.9	25%	0.253	11%	0.111	S	C	.	.	S	Bend	trans	-71.1	-13.4	-178.5	26	-31	0	0	0	113.5	W582 N583	P523-W582 HydrophobicContact CG-CB 4.05Å; P523-N583 WeakPolarHBondContact CG-O 3.5Å
524	V	90.3	Very high	94.2	Very high	52 Å²	52	16.9 Å²	16.9	32%	0.315	9%	0.085	S	C	.	.	S	Bend	trans	-114.5	-50.3	-174.5	-172.8	0	0	0	0	111.1	S522 P610	S522-V524 PolarHBondContact O-N 2.81Å; V524-P610 HydrophobicContact CG1-CG 3.98Å
525	H	91	Very high	94.1	Very high	2 Å²	2	16.1 Å²	16.1	1%	0.009	8%	0.082	C	C	.	.			trans	-87.3	126.6	-174.6	-170.6	-72.3	0	0	0	111.9	S522 A527 V528 D542 P610 D614	S522-H525 PolarHBondContact OG-N 2.88Å; H525-A527 PolarHBondContact ND1-N 2.91Å; H525-A527 VanDerWaalsContact ND1-N 3.2Å; H525-A527 PolarHBondContact O-N 2.71Å; H525-V528 HydrophobicContact CB-CB 4.01Å; H525-V528 HydrophobicContact CB-CG2 4.22Å; H525-V528 WeakPolarHBondContact ND1-CG2 2.99Å; H525-V528 PolarHBondContact ND1-N 3.04Å; H525-D542 IonicContact CE1-OD1 2.68Å; H525-P610 HydrophobicContact CB-CB 4.37Å; H525-D614 IonicContact NE2-OD2 2.81Å
526	P	90.8	Very high	93.9	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-31	-169.5	27.9	-35.9	0	0	0	114.5	H474 F482 W521 W615 F618	H474-P526 PolarHBondContact NE2-O 2.84Å; F482-P526 HydrophobicContact CD2-CB 4.41Å; F482-P526 HydrophobicContact CE2-CB 4.37Å; W521-P526 WeakPolarHBondContact CZ3-O 3.49Å; P526-W615 HydrophobicContact CB-CD2 4.03Å; P526-W615 HydrophobicContact CB-CE3 3.81Å; P526-W615 HydrophobicContact CB-CH2 3.9Å; P526-W615 HydrophobicContact CB-CZ2 4.15Å; P526-W615 HydrophobicContact CB-CZ3 3.73Å; P526-W615 HydrophobicContact CG-CD2 3.76Å; P526-W615 HydrophobicContact CG-CE3 4.08Å; P526-W615 HydrophobicContact CG-CG 4.1Å; P526-W615 HydrophobicContact CG-CH2 4.37Å; P526-W615 HydrophobicContact CG-CZ2 4.11Å; P526-W615 HydrophobicContact CG-CZ3 4.36Å; P526-F618 HydrophobicContact CB-CD1 4.25Å
527	A	92.1	Very high	93.7	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	2.4	-175.7	0	0	0	0	0	114	H525 D542 M543 N544 F618	H525-A527 PolarHBondContact ND1-N 2.91Å; H525-A527 VanDerWaalsContact ND1-N 3.2Å; H525-A527 PolarHBondContact O-N 2.71Å; A527-D542 WeakPolarHBondContact CB-OD1 3.43Å; A527-M543 HydrophobicContact CB-CB 4.43Å; A527-M543 HydrophobicContact CB-CE 4.22Å; A527-M543 WeakPolarHBondContact O-CE 3.5Å; A527-M543 PolarHBondContact O-N 2.99Å; A527-M543 VanDerWaalsContact O-N 3.13Å; A527-N544 HydrophobicContact CB-CB 4.35Å; A527-F618 HydrophobicContact CB-CB 4.1Å; A527-F618 HydrophobicContact CB-CD2 3.55Å; A527-F618 HydrophobicContact CB-CE2 4.21Å; A527-F618 HydrophobicContact CB-CG 3.86Å
528	V	94.7	Very high	93.7	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.6	-173.2	168.9	0	0	0	0	111.7	S522 H525 I540 W541 D542 W582	S522-V528 VanDerWaalsContact CB-O 3.29Å; S522-V528 WeakPolarHBondContact CB-O 3.46Å; S522-V528 PolarHBondContact N-O 3.08Å; H525-V528 HydrophobicContact CB-CB 4.01Å; H525-V528 HydrophobicContact CB-CG2 4.22Å; H525-V528 WeakPolarHBondContact ND1-CG2 2.99Å; H525-V528 PolarHBondContact ND1-N 3.04Å; V528-I540 HydrophobicContact CG1-CG2 3.88Å; V528-W541 WeakPolarHBondContact CA-O 3.48Å; V528-D542 HydrophobicContact CG2-CB 3.74Å; V528-W582 HydrophobicContact CG1-CH2 3.78Å; V528-W582 HydrophobicContact CG1-CZ2 3.84Å
529	F	96.3	Very high	93.6	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	156.2	170.5	65.4	-90.1	0	0	0	111	L487 V495 F509 V519 C520 W521 A531 W541 M543	L487-F529 HydrophobicContact CD1-CB 3.58Å; L487-F529 HydrophobicContact CD1-CD1 3.67Å; L487-F529 HydrophobicContact CD1-CD2 3.79Å; L487-F529 HydrophobicContact CD1-CE1 4.26Å; L487-F529 HydrophobicContact CD1-CE2 4.36Å; L487-F529 HydrophobicContact CD1-CG 3.4Å; V495-F529 HydrophobicContact CG1-CE2 4.15Å; F509-F529 HydrophobicContact CD1-CZ 4.15Å; F509-F529 AromaticContact CD2-CZ 3.92Å; F509-F529 HydrophobicContact CD2-CZ 3.92Å; F509-F529 HydrophobicContact CE1-CE1 4.16Å; F509-F529 AromaticContact CE1-CZ 4Å; F509-F529 HydrophobicContact CE1-CZ 4Å; F509-F529 HydrophobicContact CE2-CE1 4.02Å; F509-F529 AromaticContact CE2-CZ 3.77Å; F509-F529 HydrophobicContact CE2-CZ 3.77Å; F509-F529 HydrophobicContact CG-CZ 4.13Å; F509-F529 AromaticContact CZ-CE1 3.77Å; F509-F529 HydrophobicContact CZ-CE1 3.77Å; F509-F529 AromaticContact CZ-CZ 3.81Å; F509-F529 HydrophobicContact CZ-CZ 3.81Å; V519-F529 HydrophobicContact CG2-CD2 3.84Å; V519-F529 HydrophobicContact CG2-CE2 4.4Å; C520-F529 CarbonylContact O-C 3.48Å; C520-F529 WeakPolarHBondContact O-CA 3.46Å; C520-F529 WeakPolarHBondContact O-CB 3.5Å; W521-F529 HydrophobicContact CD2-CB 4.25Å; W521-F529 HydrophobicContact CE3-CB 4.06Å; W521-F529 HydrophobicContact CZ3-CD1 4.34Å; F529-A531 HydrophobicContact CE2-CB 4.45Å; F529-W541 HydrophobicContact CD1-CB 3.83Å; F529-W541 HydrophobicContact CD2-CB 4.09Å; F529-W541 AromaticContact CD2-CD1 3.88Å; F529-W541 HydrophobicContact CD2-CG 4.18Å; F529-W541 HydrophobicContact CE1-CB 3.42Å; F529-W541 VanDerWaalsContact CE1-CB 3.42Å; F529-W541 AromaticContact CE1-CG 3.96Å; F529-W541 HydrophobicContact CE1-CG 3.96Å; F529-W541 HydrophobicContact CE2-CB 3.7Å; F529-W541 AromaticContact CE2-CD1 3.26Å; F529-W541 HydrophobicContact CE2-CD2 4.25Å; F529-W541 AromaticContact CE2-CG 3.46Å; F529-W541 HydrophobicContact CE2-CG 3.46Å; F529-W541 VanDerWaalsContact CE2-CG 3.46Å; F529-W541 AromaticContact CE2-NE1 3.92Å; F529-W541 HydrophobicContact CG-CB 4.15Å; F529-W541 HydrophobicContact CZ-CB 3.35Å; F529-W541 AromaticContact CZ-CD1 3.67Å; F529-W541 AromaticContact CZ-CD2 3.9Å; F529-W541 HydrophobicContact CZ-CD2 3.9Å; F529-W541 AromaticContact CZ-CG 3.33Å; F529-W541 HydrophobicContact CZ-CG 3.33Å; F529-W541 PolarHBondContact N-O 3.19Å; F529-W541 VanDerWaalsContact N-O 3.15Å; F529-W541 PolarHBondContact O-N 2.99Å; F529-M543 HydrophobicContact CD1-CE 4.35Å; F529-M543 HydrophobicContact CE1-CE 4.42Å; F529-M543 HydrophobicContact CE1-CG 4.25Å; F529-M543 HydrophobicContact CE1-SD 4.32Å
530	S	96.7	Very high	93.6	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	145.5	170.9	63.9	0	0	0	0	110	V519 C520 D539 C580 W582	V519-S530 CarbonylContact C-O 3.57Å; V519-S530 WeakPolarHBondContact CA-O 3.44Å; C520-S530 PolarHBondContact N-O 2.88Å; C520-S530 PolarHBondContact O-N 3.08Å; C520-S530 PolarHBondContact O-OG 2.8Å; S530-D539 CarbonylContact C-O 3.46Å; S530-D539 VanDerWaalsContact CA-O 3.26Å; S530-D539 WeakPolarHBondContact CA-O 3.18Å; S530-C580 PolarHBondContact OG-SG 3.11Å; S530-W582 VanDerWaalsContact CB-NE1 3.35Å; S530-W582 PolarHBondContact OG-NE1 3.35Å
531	A	97.1	Very high	93.5	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	153.2	171	0	0	0	0	0	110.2	V495 Y512 V516 D518 V519 F529 D539	V495-A531 HydrophobicContact CG2-CB 4.21Å; Y512-A531 WeakPolarHBondContact OH-CB 3.39Å; V516-A531 HydrophobicContact CG1-CB 4.36Å; D518-A531 WeakPolarHBondContact O-CA 3.18Å; V519-A531 HydrophobicContact CG2-CB 4.39Å; F529-A531 HydrophobicContact CE2-CB 4.45Å; A531-D539 PolarHBondContact N-O 2.91Å; A531-D539 PolarHBondContact O-N 3.39Å
532	V	95.6	Very high	93.4	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.3	-168.4	162.2	0	0	0	0	110.5	V516 Y517 D518 L538 L577 C580 V591	V516-V532 CarbonylContact C-O 3.53Å; V516-V532 WeakPolarHBondContact CA-O 3.27Å; V516-V532 WeakPolarHBondContact CG1-O 3.19Å; Y517-V532 PolarHBondContact N-O 2.85Å; D518-V532 PolarHBondContact O-N 3.46Å; V532-L538 HydrophobicContact CG2-CD1 3.79Å; V532-L577 HydrophobicContact CB-CB 4.45Å; V532-L577 VanDerWaalsContact CG1-C 3.49Å; V532-L577 HydrophobicContact CG1-CB 3.09Å; V532-L577 HydrophobicContact CG1-CD1 4.13Å; V532-L577 HydrophobicContact CG1-CG 4.27Å; V532-L577 WeakPolarHBondContact CG1-O 3.27Å; V532-C580 HydrophobicContact CG2-CB 3.55Å; V532-V591 HydrophobicContact CG2-CG1 4.08Å
533	D	93.3	Very high	93.4	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.005	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	167.7	-177.9	83.6	8.2	0	0	0	114.2	Y512 Y515 T535 G536 N537 L577	Y512-D533 HydrophobicContact CD1-CB 3.89Å; Y512-D533 HydrophobicContact CE1-CB 4.23Å; Y515-D533 CarbonylContact O-C 3.53Å; Y515-D533 VanDerWaalsContact O-CA 3.3Å; Y515-D533 WeakPolarHBondContact O-CA 3.44Å; D533-T535 VanDerWaalsContact C-N 3.31Å; D533-T535 VanDerWaalsContact CG-OG1 3.32Å; D533-T535 WeakPolarHBondContact OD1-CA 3.46Å; D533-T535 PolarHBondContact OD1-N 2.78Å; D533-T535 PolarHBondContact OD1-OG1 3.49Å; D533-T535 VanDerWaalsContact OD1-OG1 3.08Å; D533-T535 PolarHBondContact OD2-OG1 2.82Å; D533-G536 PolarHBondContact OD1-N 3.24Å; D533-N537 PolarHBondContact N-O 3.34Å; D533-N537 VanDerWaalsContact N-O 3.14Å; D533-N537 PolarHBondContact OD1-N 2.71Å; D533-N537 WeakPolarHBondContact OD2-CB 3.3Å; D533-N537 PolarHBondContact OD2-ND2 3.2Å; D533-L577 PolarHBondContact O-N 3.3Å
534	G	89.9	Confident	93.4	Very high	8 Å²	8	7 Å²	7	8%	0.082	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-11.8	174.5	0	0	0	0	0	116	Y515 Y517 G536 A576	Y515-G534 PolarHBondContact O-N 2.68Å; Y517-G534 VanDerWaalsContact CE2-CA 3.44Å; G534-G536 VanDerWaalsContact C-N 3.28Å; G534-A576 WeakPolarHBondContact O-CA 3.17Å; G534-A576 WeakPolarHBondContact O-CB 3.48Å
535	T	90.1	Very high	93.3	Very high	31 Å²	31	11.4 Å²	11.4	19%	0.19	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-6	178.4	81.5	0	0	0	0	113.4	D514 D533 N537 K555	D514-T535 HydrophobicContact CB-CG2 3.39Å; D533-T535 VanDerWaalsContact C-N 3.31Å; D533-T535 VanDerWaalsContact CG-OG1 3.32Å; D533-T535 WeakPolarHBondContact OD1-CA 3.46Å; D533-T535 PolarHBondContact OD1-N 2.78Å; D533-T535 PolarHBondContact OD1-OG1 3.49Å; D533-T535 VanDerWaalsContact OD1-OG1 3.08Å; D533-T535 PolarHBondContact OD2-OG1 2.82Å; T535-N537 PolarHBondContact OG1-ND2 2.96Å; T535-K555 WeakPolarHBondContact O-CE 3.46Å; T535-K555 PolarHBondContact O-NZ 2.84Å
536	G	90.6	Very high	93.2	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.075	C	C	.	.	S	Bend	trans	104.3	10.2	179.6	0	0	0	0	0	114.2	D533 G534 K555 L556 V575 L577	D533-G536 PolarHBondContact OD1-N 3.24Å; G534-G536 VanDerWaalsContact C-N 3.28Å; G536-K555 CarbonylContact O-C 3.4Å; G536-K555 WeakPolarHBondContact O-CA 3.2Å; G536-L556 PolarHBondContact O-N 3.13Å; G536-V575 VanDerWaalsContact CA-O 3.24Å; G536-V575 WeakPolarHBondContact CA-O 3.43Å; G536-L577 VanDerWaalsContact O-CD1 3.26Å; G536-L577 WeakPolarHBondContact O-CD1 3.17Å
537	N	93.1	Very high	93.1	Very high	20 Å²	20	15 Å²	15	11%	0.107	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.2	-175.4	-53.6	-39.1	0	0	0	112.3	D533 T535 R553 R554 K555	D533-N537 PolarHBondContact N-O 3.34Å; D533-N537 VanDerWaalsContact N-O 3.14Å; D533-N537 PolarHBondContact OD1-N 2.71Å; D533-N537 WeakPolarHBondContact OD2-CB 3.3Å; D533-N537 PolarHBondContact OD2-ND2 3.2Å; T535-N537 PolarHBondContact OG1-ND2 2.96Å; N537-R553 HydrophobicContact CB-CG 4.27Å; N537-R554 WeakPolarHBondContact CA-O 3.09Å; N537-K555 WeakPolarHBondContact OD1-CB 3.3Å; N537-K555 WeakPolarHBondContact OD1-CG 3.22Å
538	L	95	Very high	93	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.6	160.3	173.2	66.6	0	0	0	108.3	V532 I540 R554 L556 V589 V591 C601	V532-L538 HydrophobicContact CG2-CD1 3.79Å; L538-I540 HydrophobicContact CD1-CD1 4.41Å; L538-I540 HydrophobicContact CG-CD1 4.46Å; L538-R554 PolarHBondContact N-O 3.06Å; L538-R554 PolarHBondContact O-N 3.19Å; L538-L556 HydrophobicContact CB-CD1 4.05Å; L538-V589 HydrophobicContact CD1-CG1 4.13Å; L538-V589 HydrophobicContact CD2-CB 4.46Å; L538-V589 HydrophobicContact CD2-CG1 4.27Å; L538-V591 HydrophobicContact CB-CG2 4.44Å; L538-V591 HydrophobicContact CD1-CG2 3.84Å; L538-V591 HydrophobicContact CD2-CG2 3.79Å; L538-V591 HydrophobicContact CG-CG2 4.22Å; L538-C601 HydrophobicContact CD2-CB 4.02Å
539	D	95.3	Very high	92.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.3	177.4	-68.1	-16.1	0	0	0	110.6	Y512 S530 A531 P550 A552 R553	Y512-D539 HydrophobicContact CE1-CB 4.4Å; Y512-D539 WeakPolarHBondContact CE1-OD2 3.41Å; Y512-D539 PolarHBondContact OH-OD2 2.89Å; S530-D539 CarbonylContact C-O 3.46Å; S530-D539 VanDerWaalsContact CA-O 3.26Å; S530-D539 WeakPolarHBondContact CA-O 3.18Å; A531-D539 PolarHBondContact N-O 2.91Å; A531-D539 PolarHBondContact O-N 3.39Å; D539-P550 HydrophobicContact CB-CB 4.06Å; D539-A552 WeakPolarHBondContact CA-O 3.47Å; D539-R553 VanDerWaalsContact CG-NE 3.33Å; D539-R553 VanDerWaalsContact OD1-CB 3.26Å; D539-R553 WeakPolarHBondContact OD1-CB 3.44Å; D539-R553 WeakPolarHBondContact OD1-CD 3.3Å; D539-R553 WeakPolarHBondContact OD1-CG 3.49Å; D539-R553 IonicContact OD1-CZ 3.46Å; D539-R553 IonicContact OD1-NE 3.1Å; D539-R553 PolarHBondContact OD1-NE 3.46Å; D539-R553 IonicContact OD1-NH2 2.74Å; D539-R553 IonicContact OD2-CZ 3.8Å; D539-R553 IonicContact OD2-NE 3.68Å; D539-R553 PolarHBondContact OD2-NE 2.89Å; D539-R553 IonicContact OD2-NH2 2.78Å; D539-R553 PolarHBondContact OD2-NH2 3.46Å
540	I	96.1	Very high	92.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.6	172.7	-55.1	-63.7	0	0	0	107.9	L244 V528 L538 V551 A552 W582 V589 L607	L244-I540 HydrophobicContact CD1-CB 4.36Å; L244-I540 HydrophobicContact CD1-CG1 3.59Å; L244-I540 HydrophobicContact CD2-CD1 4.36Å; L244-I540 HydrophobicContact CD2-CG1 3.61Å; L244-I540 HydrophobicContact CG-CG1 4.09Å; V528-I540 HydrophobicContact CG1-CG2 3.88Å; L538-I540 HydrophobicContact CD1-CD1 4.41Å; L538-I540 HydrophobicContact CG-CD1 4.46Å; I540-V551 PolarHBondContact O-N 3.11Å; I540-A552 HydrophobicContact CB-CB 4.41Å; I540-A552 PolarHBondContact N-O 2.82Å; I540-A552 PolarHBondContact O-N 3.16Å; I540-W582 HydrophobicContact CD1-CH2 3.97Å; I540-W582 HydrophobicContact CD1-CZ2 3.67Å; I540-W582 HydrophobicContact CG2-CH2 4.37Å; I540-W582 HydrophobicContact CG2-CZ2 4.5Å; I540-V589 HydrophobicContact CD1-CG2 4.3Å; I540-L607 HydrophobicContact CG2-CD1 4.13Å
541	W	95.7	Very high	92.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.7	179.4	-67	83.7	0	0	0	109.1	F509 D511 Y512 V528 F529 E548 P550	F509-W541 HydrophobicContact CB-CH2 4.09Å; F509-W541 HydrophobicContact CB-CZ2 4.23Å; F509-W541 HydrophobicContact CB-CZ3 4.41Å; F509-W541 HydrophobicContact CD1-CD2 4.22Å; F509-W541 AromaticContact CD1-CE3 3.65Å; F509-W541 HydrophobicContact CD1-CE3 3.65Å; F509-W541 HydrophobicContact CD1-CH2 4.14Å; F509-W541 AromaticContact CD1-CZ3 3.6Å; F509-W541 HydrophobicContact CD1-CZ3 3.6Å; F509-W541 HydrophobicContact CE1-CE3 4.1Å; F509-W541 HydrophobicContact CE1-CZ3 4.38Å; F509-W541 HydrophobicContact CG-CZ3 4.44Å; D511-W541 HydrophobicContact CB-CH2 3.92Å; D511-W541 HydrophobicContact CB-CZ2 4.24Å; Y512-W541 HydrophobicContact CE2-CZ2 4.02Å; Y512-W541 AromaticContact CZ-NE1 3.87Å; Y512-W541 PolarHBondContact OH-NE1 3.13Å; V528-W541 WeakPolarHBondContact CA-O 3.48Å; F529-W541 HydrophobicContact CD1-CB 3.83Å; F529-W541 HydrophobicContact CD2-CB 4.09Å; F529-W541 AromaticContact CD2-CD1 3.88Å; F529-W541 HydrophobicContact CD2-CG 4.18Å; F529-W541 HydrophobicContact CE1-CB 3.42Å; F529-W541 VanDerWaalsContact CE1-CB 3.42Å; F529-W541 AromaticContact CE1-CG 3.96Å; F529-W541 HydrophobicContact CE1-CG 3.96Å; F529-W541 HydrophobicContact CE2-CB 3.7Å; F529-W541 AromaticContact CE2-CD1 3.26Å; F529-W541 HydrophobicContact CE2-CD2 4.25Å; F529-W541 AromaticContact CE2-CG 3.46Å; F529-W541 HydrophobicContact CE2-CG 3.46Å; F529-W541 VanDerWaalsContact CE2-CG 3.46Å; F529-W541 AromaticContact CE2-NE1 3.92Å; F529-W541 HydrophobicContact CG-CB 4.15Å; F529-W541 HydrophobicContact CZ-CB 3.35Å; F529-W541 AromaticContact CZ-CD1 3.67Å; F529-W541 AromaticContact CZ-CD2 3.9Å; F529-W541 HydrophobicContact CZ-CD2 3.9Å; F529-W541 AromaticContact CZ-CG 3.33Å; F529-W541 HydrophobicContact CZ-CG 3.33Å; F529-W541 PolarHBondContact N-O 3.19Å; F529-W541 VanDerWaalsContact N-O 3.15Å; F529-W541 PolarHBondContact O-N 2.99Å; W541-E548 WeakPolarHBondContact CH2-O 3.27Å; W541-P550 HydrophobicContact CD2-CB 4.04Å; W541-P550 HydrophobicContact CE3-CB 4.47Å; W541-P550 HydrophobicContact CG-CB 4.45Å; W541-P550 HydrophobicContact CZ2-CB 4.07Å; W541-P550 HydrophobicContact CZ2-CG 4.21Å
542	D	93.7	Very high	92.4	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.016	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	105	165.7	-177	5.1	0	0	0	108.1	H525 A527 V528 N544 Q545 D546 V551 L607	H525-D542 IonicContact CE1-OD1 2.68Å; A527-D542 WeakPolarHBondContact CB-OD1 3.43Å; V528-D542 HydrophobicContact CG2-CB 3.74Å; D542-N544 PolarHBondContact O-N 3.4Å; D542-N544 VanDerWaalsContact O-N 3.16Å; D542-N544 WeakPolarHBondContact OD1-CB 3.42Å; D542-N544 PolarHBondContact OD1-N 3.09Å; D542-N544 VanDerWaalsContact OD1-N 3.11Å; D542-Q545 HydrophobicContact CB-CB 4.46Å; D542-Q545 HydrophobicContact CB-CG 4.15Å; D542-Q545 PolarHBondContact O-N 3.07Å; D542-Q545 WeakPolarHBondContact OD2-CG 3.11Å; D542-D546 PolarHBondContact O-N 2.92Å; D542-D546 VanDerWaalsContact O-N 3.12Å; D542-D546 VanDerWaalsContact O-O 3.06Å; D542-V551 HydrophobicContact CB-CG2 3.83Å; D542-L607 HydrophobicContact CB-CD2 4.26Å
543	M	92.2	Very high	92.2	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.015	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-17	-176.5	-62.6	168.6	-75.8	0	0	112.7	L497 F509 W521 A527 F529 Q545 F618 V621	L497-M543 HydrophobicContact CD2-SD 4.16Å; F509-M543 HydrophobicContact CE1-CG 4.1Å; F509-M543 HydrophobicContact CZ-CG 3.92Å; F509-M543 HydrophobicContact CZ-SD 3.81Å; W521-M543 HydrophobicContact CH2-CE 3.36Å; W521-M543 HydrophobicContact CH2-SD 4.49Å; W521-M543 HydrophobicContact CZ3-CE 3.5Å; W521-M543 VanDerWaalsContact CZ3-CE 3.5Å; A527-M543 HydrophobicContact CB-CB 4.43Å; A527-M543 HydrophobicContact CB-CE 4.22Å; A527-M543 WeakPolarHBondContact O-CE 3.5Å; A527-M543 PolarHBondContact O-N 2.99Å; A527-M543 VanDerWaalsContact O-N 3.13Å; F529-M543 HydrophobicContact CD1-CE 4.35Å; F529-M543 HydrophobicContact CE1-CE 4.42Å; F529-M543 HydrophobicContact CE1-CG 4.25Å; F529-M543 HydrophobicContact CE1-SD 4.32Å; M543-Q545 VanDerWaalsContact C-N 3.26Å; M543-F618 HydrophobicContact CB-CD2 4.46Å; M543-F618 HydrophobicContact CB-CE2 4.3Å; M543-F618 HydrophobicContact CE-CD2 4.06Å; M543-F618 HydrophobicContact CE-CE2 3.19Å; M543-F618 HydrophobicContact CE-CZ 3.61Å; M543-F618 HydrophobicContact SD-CE2 3.75Å; M543-F618 HydrophobicContact SD-CZ 4.38Å; M543-V621 HydrophobicContact CB-CG1 4.47Å
544	N	91.3	Very high	92.1	Very high	28 Å²	28	38.9 Å²	38.9	15%	0.15	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.7	174.4	-73.1	-13	0	0	0	112.3	A527 D542 D614 F618	A527-N544 HydrophobicContact CB-CB 4.35Å; D542-N544 PolarHBondContact O-N 3.4Å; D542-N544 VanDerWaalsContact O-N 3.16Å; D542-N544 WeakPolarHBondContact OD1-CB 3.42Å; D542-N544 PolarHBondContact OD1-N 3.09Å; D542-N544 VanDerWaalsContact OD1-N 3.11Å; N544-D614 PolarHBondContact ND2-O 3.37Å; N544-F618 WeakPolarHBondContact OD1-CA 3.31Å; N544-F618 WeakPolarHBondContact OD1-CB 3.4Å; N544-F618 PolarHBondContact OD1-N 3.17Å; N544-F618 VanDerWaalsContact OD1-N 3.09Å
545	Q	89.5	Confident	92.1	Very high	143 Å²	143	42.8 Å²	42.8	67%	0.668	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-59.1	179.6	-59.6	-65.3	-19.9	0	0	110.6	D542 M543 V551	D542-Q545 HydrophobicContact CB-CB 4.46Å; D542-Q545 HydrophobicContact CB-CG 4.15Å; D542-Q545 PolarHBondContact O-N 3.07Å; D542-Q545 WeakPolarHBondContact OD2-CG 3.11Å; M543-Q545 VanDerWaalsContact C-N 3.26Å; Q545-V551 HydrophobicContact CB-CG2 3.98Å; Q545-V551 HydrophobicContact CG-CG2 4.41Å
546	D	89.1	Confident	91.9	Very high	63 Å²	63	41.7 Å²	41.7	34%	0.337	20%	0.199	S	C	.	.			trans	-150.4	132	-178.5	-161.6	-22	0	0	0	109.6	D542 E548	D542-D546 PolarHBondContact O-N 2.92Å; D542-D546 VanDerWaalsContact O-N 3.12Å; D542-D546 VanDerWaalsContact O-O 3.06Å; D546-E548 PolarHBondContact OD1-N 3.09Å
547	A	88.3	Confident	90.9	Very high	15 Å²	15	43.2 Å²	43.2	12%	0.124	22%	0.215	C	C	.	.	S	Bend	trans	-94.4	-16	177.3	0	0	0	0	0	112.3	H507 F509 L625	H507-A547 PolarHBondContact CE1-O 3.47Å; F509-A547 WeakPolarHBondContact CD1-O 3.45Å; F509-A547 VanDerWaalsContact CE1-O 3.31Å; F509-A547 WeakPolarHBondContact CE1-O 2.95Å; A547-L625 HydrophobicContact CB-CD2 4.46Å
548	E	89.8	Confident	89.4	Confident	142 Å²	142	46.6 Å²	46.6	66%	0.664	23%	0.233	S	C	*	.	S	Bend	trans	-95.1	-31.6	-175.6	-63.6	-175.4	175.9	0	0	112.5	W541 D546	W541-E548 WeakPolarHBondContact CH2-O 3.27Å; D546-E548 PolarHBondContact OD1-N 3.09Å
549	I	92.9	Very high	87.4	Confident	91 Å²	91	49.6 Å²	49.6	47%	0.467	25%	0.253	S	S	.	.	S	Bend	trans	-125.5	137.7	-173.5	-54.8	172.3	0	0	0	110.1	V551	I549-V551 PolarHBondContact O-N 2.83Å
550	P	93.9	Very high	84.9	Confident	12 Å²	12	55 Å²	55	8%	0.078	29%	0.291	C	S	.	.			trans	-65.5	136.8	174.6	27.6	-34.4	0	0	0	110.8	D511 D539 W541 A552 R553	D511-P550 VanDerWaalsContact OD2-CD 3.29Å; D511-P550 WeakPolarHBondContact OD2-CD 3.43Å; D539-P550 HydrophobicContact CB-CB 4.06Å; W541-P550 HydrophobicContact CD2-CB 4.04Å; W541-P550 HydrophobicContact CE3-CB 4.47Å; W541-P550 HydrophobicContact CG-CB 4.45Å; W541-P550 HydrophobicContact CZ2-CB 4.07Å; W541-P550 HydrophobicContact CZ2-CG 4.21Å; P550-A552 VanDerWaalsContact C-N 3.31Å; P550-A552 PolarHBondContact O-N 3.03Å; P550-R553 HydrophobicContact CG-CB 4.48Å
551	V	92.4	Very high	82.2	Confident	47 Å²	47	61.5 Å²	61.5	29%	0.285	33%	0.326	S	S	.	.	S	Bend	trans	-67	-36.3	-179.7	176.6	0	0	0	0	111.4	L243 I540 D542 Q545 I549 L607	L243-V551 HydrophobicContact CD1-CG1 3.73Å; I540-V551 PolarHBondContact O-N 3.11Å; D542-V551 HydrophobicContact CB-CG2 3.83Å; Q545-V551 HydrophobicContact CB-CG2 3.98Å; Q545-V551 HydrophobicContact CG-CG2 4.41Å; I549-V551 PolarHBondContact O-N 2.83Å; V551-L607 HydrophobicContact CG1-CD1 4.43Å; V551-L607 HydrophobicContact CG1-CD2 4.25Å
552	A	92	Very high	79.7	Confident	11 Å²	11	67.4 Å²	67.4	9%	0.091	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	128.3	175.2	0	0	0	0	0	110.4	L243 L244 D539 I540 P550	L243-A552 HydrophobicContact CB-CB 3.84Å; L243-A552 HydrophobicContact CD1-CB 4.27Å; L244-A552 HydrophobicContact CD1-CB 3.41Å; L244-A552 VanDerWaalsContact CD1-CB 3.41Å; L244-A552 HydrophobicContact CG-CB 3.71Å; D539-A552 WeakPolarHBondContact CA-O 3.47Å; I540-A552 HydrophobicContact CB-CB 4.41Å; I540-A552 PolarHBondContact N-O 2.82Å; I540-A552 PolarHBondContact O-N 3.16Å; P550-A552 VanDerWaalsContact C-N 3.31Å; P550-A552 PolarHBondContact O-N 3.03Å
553	R	91.9	Very high	76.9	Confident	106 Å²	106	73.3 Å²	73.3	40%	0.4	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.5	175.8	167.8	167.4	-70.2	157	-3	109.1	D511 N537 D539 P550	D511-R553 IonicContact OD2-CZ 2.68Å; D511-R553 IonicContact OD2-NH1 2.78Å; D511-R553 PolarHBondContact OD2-NH1 3.31Å; D511-R553 IonicContact OD2-NH2 3.76Å; D511-R553 PolarHBondContact OD2-NH2 2.74Å; N537-R553 HydrophobicContact CB-CG 4.27Å; D539-R553 VanDerWaalsContact CG-NE 3.33Å; D539-R553 VanDerWaalsContact OD1-CB 3.26Å; D539-R553 WeakPolarHBondContact OD1-CB 3.44Å; D539-R553 WeakPolarHBondContact OD1-CD 3.3Å; D539-R553 WeakPolarHBondContact OD1-CG 3.49Å; D539-R553 IonicContact OD1-CZ 3.46Å; D539-R553 IonicContact OD1-NE 3.1Å; D539-R553 PolarHBondContact OD1-NE 3.46Å; D539-R553 IonicContact OD1-NH2 2.74Å; D539-R553 IonicContact OD2-CZ 3.8Å; D539-R553 IonicContact OD2-NE 3.68Å; D539-R553 PolarHBondContact OD2-NE 2.89Å; D539-R553 IonicContact OD2-NH2 2.78Å; D539-R553 PolarHBondContact OD2-NH2 3.46Å; P550-R553 HydrophobicContact CG-CB 4.48Å
554	R	90.7	Very high	74.1	Confident	93 Å²	93	80.7 Å²	80.7	35%	0.351	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	124.2	178.1	-179.6	146.7	170.4	72.9	4.1	111.8	L244 N537 L538 L556	L244-R554 HydrophobicContact CB-CB 4.37Å; L244-R554 HydrophobicContact CD1-CB 4.22Å; L244-R554 VanDerWaalsContact O-CD 3.29Å; L244-R554 WeakPolarHBondContact O-CD 3.26Å; N537-R554 WeakPolarHBondContact CA-O 3.09Å; L538-R554 PolarHBondContact N-O 3.06Å; L538-R554 PolarHBondContact O-N 3.19Å; R554-L556 HydrophobicContact CG-CD2 4.03Å
555	K	90	Very high	71.3	Confident	91 Å²	91	84.4 Å²	84.4	40%	0.396	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	116.6	175.1	-169.1	158	-175.8	145.5	0	111.3	T535 G536 N537 L558	T535-K555 WeakPolarHBondContact O-CE 3.46Å; T535-K555 PolarHBondContact O-NZ 2.84Å; G536-K555 CarbonylContact O-C 3.4Å; G536-K555 WeakPolarHBondContact O-CA 3.2Å; N537-K555 WeakPolarHBondContact OD1-CB 3.3Å; N537-K555 WeakPolarHBondContact OD1-CG 3.22Å; K555-L558 HydrophobicContact CD-CD1 3.57Å; K555-L558 HydrophobicContact CD-CG 4.36Å; K555-L558 HydrophobicContact CG-CD1 3.86Å; K555-L558 HydrophobicContact CG-CG 4.34Å
556	L	86.6	Confident	68.7	Low	8 Å²	8	81.4 Å²	81.4	4%	0.042	46%	0.462	C	S	.	.			trans	-99.4	159.2	176.5	-54.7	179.4	0	0	0	110.3	V246 G536 L538 R554 L558 L577 V591 T599	V246-L556 HydrophobicContact CG2-CD2 3.87Å; G536-L556 PolarHBondContact O-N 3.13Å; L538-L556 HydrophobicContact CB-CD1 4.05Å; R554-L556 HydrophobicContact CG-CD2 4.03Å; L556-L558 PolarHBondContact O-N 2.87Å; L556-L577 HydrophobicContact CB-CD1 4.18Å; L556-L577 HydrophobicContact CB-CD2 4.01Å; L556-L577 HydrophobicContact CD1-CD1 4.05Å; L556-L577 HydrophobicContact CD1-CD2 4.33Å; L556-L577 HydrophobicContact CG-CD1 4.37Å; L556-V591 HydrophobicContact CD1-CB 3.94Å; L556-V591 HydrophobicContact CD1-CG1 4.07Å; L556-V591 HydrophobicContact CD1-CG2 4Å; L556-T599 HydrophobicContact CD1-CG2 4.4Å; L556-T599 HydrophobicContact CD2-CG2 4.13Å
557	G	69.4	Low	66.1	Low	32 Å²	32	84.6 Å²	84.6	33%	0.33	49%	0.489	S	S	.	.	S	Bend	trans	85	-7.4	174.7	0	0	0	0	0	116.7	S559	G557-S559 VanDerWaalsContact C-N 3.31Å; G557-S559 PolarHBondContact O-N 2.81Å; G557-S559 VanDerWaalsContact O-N 3.16Å
558	L	62.6	Low	63.4	Low	91 Å²	91	87.8 Å²	87.8	48%	0.476	51%	0.511	S	S	.	.			trans	-84.7	68.5	166.8	-66.7	172.6	0	0	0	110.3	K555 L556 S560 L572	K555-L558 HydrophobicContact CD-CD1 3.57Å; K555-L558 HydrophobicContact CD-CG 4.36Å; K555-L558 HydrophobicContact CG-CD1 3.86Å; K555-L558 HydrophobicContact CG-CG 4.34Å; L556-L558 PolarHBondContact O-N 2.87Å; L558-S560 PolarHBondContact O-N 3.42Å; L558-S560 VanDerWaalsContact O-N 3.16Å; L558-L572 HydrophobicContact CD2-CD2 3.88Å
559	S	51.7	Low	60.9	Low	62 Å²	62	87.1 Å²	87.1	43%	0.434	52%	0.521	S	S	.	.			trans	-68.4	116.7	165.3	71.8	0	0	0	0	107.7	G557 N561	G557-S559 VanDerWaalsContact C-N 3.31Å; G557-S559 PolarHBondContact O-N 2.81Å; G557-S559 VanDerWaalsContact O-N 3.16Å; S559-N561 PolarHBondContact O-N 2.6Å
560	S	43.1	Very low	58.4	Low	113 Å²	113	86.7 Å²	86.7	79%	0.79	53%	0.526	S	S	*	.	S	Bend	trans	-64	19.5	-176.4	56	0	0	0	0	115.4	L558 V562	L558-S560 PolarHBondContact O-N 3.42Å; L558-S560 VanDerWaalsContact O-N 3.16Å; S560-V562 PolarHBondContact O-N 3Å
561	N	40.5	Very low	56	Low	137 Å²	137	92.5 Å²	92.5	73%	0.733	56%	0.557	S	S	*	*			trans	-92.9	12.7	-172.5	-68.8	-10.2	0	0	0	113.8	S559	S559-N561 PolarHBondContact O-N 2.6Å
562	V	42.6	Very low	53.6	Low	125 Å²	125	97.7 Å²	97.7	76%	0.758	58%	0.582	S	S	*	*	S	Bend	trans	-104.3	105	166.9	-176	0	0	0	0	108.9	S560	S560-V562 PolarHBondContact O-N 3Å
563	D	34.3	Very low	52	Low	127 Å²	127	102.9 Å²	102.9	68%	0.679	61%	0.613	S	S	*	*			trans	-25.2	127.3	169.3	-62.9	-51.2	0	0	0	114.9	S565	D563-S565 PolarHBondContact O-N 3.32Å
564	T	33.7	Very low	50.9	Low	158 Å²	158	99.2 Å²	99.2	97%	0.969	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	37.7	171.9	-59.9	0	0	0	0	113.1
565	S	33.3	Very low	50.8	Low	105 Å²	105	95.9 Å²	95.9	73%	0.734	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	-2	-172.1	68.8	0	0	0	0	116.4	D563	D563-S565 PolarHBondContact O-N 3.32Å
566	S	34.9	Very low	50.8	Low	80 Å²	80	92.4 Å²	92.4	56%	0.559	59%	0.586	S	S	*	*			trans	-114.2	91	168.2	66	0	0	0	0	111.5	S568	S566-S568 PolarHBondContact O-N 3.44Å
567	S	33.1	Very low	51.2	Low	130 Å²	130	92.2 Å²	92.2	91%	0.909	59%	0.585	S	S	*	*			trans	-70.7	35.8	168.8	-159.9	0	0	0	0	112.3
568	S	31.9	Very low	52.4	Low	83 Å²	83	92.2 Å²	92.2	58%	0.58	58%	0.577	S	S	*	*	S	Bend	trans	-97	126	168.7	-64.9	0	0	0	0	106.5	S566 S570	S566-S568 PolarHBondContact O-N 3.44Å; S568-S570 PolarHBondContact O-N 2.79Å; S568-S570 PolarHBondContact O-OG 3.26Å
569	S	36.7	Very low	53.9	Low	127 Å²	127	89.9 Å²	89.9	89%	0.888	56%	0.563	S	S	*	*			trans	-62.6	31.9	171.9	-52.7	0	0	0	0	113.5	N571	S569-N571 PolarHBondContact O-N 3.46Å
570	S	41	Very low	56	Low	82 Å²	82	87 Å²	87	57%	0.573	54%	0.543	S	S	*	.			trans	-67.6	91	162.8	55.4	0	0	0	0	106.6	S568 L572	S568-S570 PolarHBondContact O-N 2.79Å; S568-S570 PolarHBondContact O-OG 3.26Å; S570-L572 PolarHBondContact O-N 2.74Å
571	N	43.1	Very low	58.6	Low	135 Å²	135	85.9 Å²	85.9	72%	0.722	52%	0.521	S	S	*	.			trans	19.9	98.4	157.4	-56.3	-23.7	0	0	0	112.2	S569 V573	S569-N571 PolarHBondContact O-N 3.46Å; N571-V573 HydrophobicContact CB-CG2 3.89Å; N571-V573 WeakPolarHBondContact O-CG2 3.35Å; N571-V573 PolarHBondContact O-N 3.19Å
572	L	43.3	Very low	61.2	Low	155 Å²	155	79.9 Å²	79.9	81%	0.812	49%	0.489	S	S	*	.			trans	-56.4	89.5	152.1	-138.5	87.6	0	0	0	103.8	L558 S570 G574	L558-L572 HydrophobicContact CD2-CD2 3.88Å; S570-L572 PolarHBondContact O-N 2.74Å; L572-G574 PolarHBondContact O-N 2.73Å
573	V	57	Low	63.6	Low	121 Å²	121	74.5 Å²	74.5	73%	0.733	46%	0.456	S	S	*	.			trans	-69.2	93.5	177.2	-179.8	0	0	0	0	102.5	N571 V575	N571-V573 HydrophobicContact CB-CG2 3.89Å; N571-V573 WeakPolarHBondContact O-CG2 3.35Å; N571-V573 PolarHBondContact O-N 3.19Å; V573-V575 PolarHBondContact O-N 2.68Å
574	G	70.4	Confident	66.2	Low	29 Å²	29	71.9 Å²	71.9	30%	0.299	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-57.4	135.9	172.3	0	0	0	0	0	107.2	L572 A576	L572-G574 PolarHBondContact O-N 2.73Å; G574-A576 PolarHBondContact O-N 3.47Å
575	V	87.4	Confident	68.9	Low	23 Å²	23	67 Å²	67	14%	0.139	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-69.8	124.6	170.3	170.4	0	0	0	0	107.1	G536 V573 D593 T595	G536-V575 VanDerWaalsContact CA-O 3.24Å; G536-V575 WeakPolarHBondContact CA-O 3.43Å; V573-V575 PolarHBondContact O-N 2.68Å; V575-D593 HydrophobicContact CG1-CB 3.41Å; V575-D593 VanDerWaalsContact CG1-CB 3.41Å; V575-D593 VanDerWaalsContact CG1-OD2 3.3Å; V575-D593 WeakPolarHBondContact CG1-OD2 3.42Å; V575-T595 HydrophobicContact CG1-CG2 4.17Å; V575-T595 HydrophobicContact CG2-CG2 3.96Å
576	A	90.9	Very high	71.5	Confident	17 Å²	17	62 Å²	62	14%	0.14	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-88.2	136	178	0	0	0	0	0	109.2	G534 G574 D593 D594	G534-A576 WeakPolarHBondContact O-CA 3.17Å; G534-A576 WeakPolarHBondContact O-CB 3.48Å; G574-A576 PolarHBondContact O-N 3.47Å; A576-D593 CarbonylContact O-C 3.6Å; A576-D593 WeakPolarHBondContact O-CA 3.19Å; A576-D594 HydrophobicContact CB-CB 4.45Å; A576-D594 PolarHBondContact N-OD1 3.45Å; A576-D594 PolarHBondContact O-N 2.95Å
577	L	94.1	Very high	74.3	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.021	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.4	177	-62.1	174.1	0	0	0	109.2	Y517 V532 D533 G536 L556 V591 D593	Y517-L577 WeakPolarHBondContact CD2-O 3.18Å; V532-L577 HydrophobicContact CB-CB 4.45Å; V532-L577 VanDerWaalsContact CG1-C 3.49Å; V532-L577 HydrophobicContact CG1-CB 3.09Å; V532-L577 HydrophobicContact CG1-CD1 4.13Å; V532-L577 HydrophobicContact CG1-CG 4.27Å; V532-L577 WeakPolarHBondContact CG1-O 3.27Å; D533-L577 PolarHBondContact O-N 3.3Å; G536-L577 VanDerWaalsContact O-CD1 3.26Å; G536-L577 WeakPolarHBondContact O-CD1 3.17Å; L556-L577 HydrophobicContact CB-CD1 4.18Å; L556-L577 HydrophobicContact CB-CD2 4.01Å; L556-L577 HydrophobicContact CD1-CD1 4.05Å; L556-L577 HydrophobicContact CD1-CD2 4.33Å; L556-L577 HydrophobicContact CG-CD1 4.37Å; L577-V591 HydrophobicContact CB-CG1 4.1Å; L577-V591 HydrophobicContact CD1-CG1 3.86Å; L577-V591 HydrophobicContact CD2-CG1 3.71Å; L577-V591 HydrophobicContact CG-CG1 4.07Å; L577-D593 HydrophobicContact CD2-CB 3.97Å
578	N	94.2	Very high	77.2	Confident	32 Å²	32	56.4 Å²	56.4	17%	0.171	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-37.4	-172.8	-169	10.3	0	0	0	113.5	I261 Y517 G592	I261-N578 PolarHBondContact O-ND2 2.6Å; Y517-N578 WeakPolarHBondContact CB-O 3.26Å; N578-G592 PolarHBondContact N-O 3.34Å
579	K	95.7	Very high	80.2	Confident	42 Å²	42	52.4 Å²	52.4	18%	0.183	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	146.1	-174.4	-67.3	-70.6	163.7	-79.8	0	111.9	T262 L264 D518 V591 G592	T262-K579 VanDerWaalsContact O-CE 3.25Å; T262-K579 WeakPolarHBondContact O-CE 2.87Å; L264-K579 HydrophobicContact CD1-CB 3.95Å; L264-K579 WeakPolarHBondContact CD1-O 3.32Å; L264-K579 HydrophobicContact CG-CB 4.11Å; D518-K579 HydrophobicContact CB-CD 4.41Å; D518-K579 WeakPolarHBondContact OD2-CA 3.49Å; D518-K579 WeakPolarHBondContact OD2-CD 3.41Å; K579-V591 CarbonylContact O-C 3.58Å; K579-V591 VanDerWaalsContact O-CA 3.31Å; K579-V591 WeakPolarHBondContact O-CA 3.08Å; K579-G592 PolarHBondContact N-O 3.48Å; K579-G592 PolarHBondContact O-N 3.44Å
580	C	95.5	Very high	83	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.007	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.3	168.9	62.9	0	0	0	0	112.4	D518 S530 V532 V589 A590 V591	D518-C580 PolarHBondContact OD2-N 2.76Å; S530-C580 PolarHBondContact OG-SG 3.11Å; V532-C580 HydrophobicContact CG2-CB 3.55Å; C580-V589 HydrophobicContact CB-CG1 4.23Å; C580-A590 CarbonylContact C-O 3.6Å; C580-A590 WeakPolarHBondContact CA-O 3.5Å; C580-V591 HydrophobicContact CB-CG2 4.28Å
581	R	96.5	Very high	85.6	Confident	90 Å²	90	42.5 Å²	42.5	34%	0.34	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	127.1	177.7	-157.7	70.7	168.8	167	-4.1	111.5	L264 D265 W266 A590	L264-R581 HydrophobicContact CB-CB 3.86Å; D265-R581 IonicContact OD1-NE 2.94Å; W266-R581 PolarHBondContact NE1-O 3Å; R581-A590 PolarHBondContact N-O 3.3Å; R581-A590 PolarHBondContact O-N 2.7Å
582	W	95.6	Very high	88	Confident	11 Å²	11	36.1 Å²	36.1	4%	0.042	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	142.7	172.1	-68.6	81.3	0	0	0	111.2	W266 C520 W521 P523 V528 S530 I540 G586 H588 V589 V603	W266-W582 VanDerWaalsContact CD1-C 3.48Å; C520-W582 PolarHBondContact O-NE1 3.15Å; C520-W582 VanDerWaalsContact O-NE1 3.07Å; W521-W582 VanDerWaalsContact O-CD1 3.26Å; P523-W582 HydrophobicContact CG-CB 4.05Å; V528-W582 HydrophobicContact CG1-CH2 3.78Å; V528-W582 HydrophobicContact CG1-CZ2 3.84Å; S530-W582 VanDerWaalsContact CB-NE1 3.35Å; S530-W582 PolarHBondContact OG-NE1 3.35Å; I540-W582 HydrophobicContact CD1-CH2 3.97Å; I540-W582 HydrophobicContact CD1-CZ2 3.67Å; I540-W582 HydrophobicContact CG2-CH2 4.37Å; I540-W582 HydrophobicContact CG2-CZ2 4.5Å; W582-G586 VanDerWaalsContact CZ3-O 3.27Å; W582-G586 WeakPolarHBondContact CZ3-O 3.43Å; W582-H588 WeakPolarHBondContact CA-O 3.45Å; W582-V589 HydrophobicContact CD2-CG2 3.5Å; W582-V589 VanDerWaalsContact CD2-CG2 3.5Å; W582-V589 HydrophobicContact CE3-CG2 3.46Å; W582-V589 VanDerWaalsContact CE3-CG2 3.46Å; W582-V589 HydrophobicContact CG-CG2 4.19Å; W582-V589 HydrophobicContact CH2-CG2 3.75Å; W582-V589 HydrophobicContact CZ2-CG2 3.77Å; W582-V589 HydrophobicContact CZ3-CG2 3.59Å; W582-V603 HydrophobicContact CH2-CG1 4.27Å; W582-V603 HydrophobicContact CH2-CG2 3.91Å; W582-V603 HydrophobicContact CZ3-CB 4.23Å; W582-V603 HydrophobicContact CZ3-CG1 4.25Å; W582-V603 HydrophobicContact CZ3-CG2 3.68Å
583	N	93.4	Very high	90.4	Very high	12 Å²	12	29 Å²	29	6%	0.064	17%	0.17	C	C	.	.			trans	-67.2	154.1	165.6	-169.3	-2	0	0	0	109.8	W266 P271 P523 A585 G586 H588	W266-N583 HydrophobicContact CD2-CB 4.03Å; W266-N583 HydrophobicContact CE3-CB 4.37Å; W266-N583 HydrophobicContact CG-CB 4.38Å; W266-N583 HydrophobicContact CZ2-CB 4.25Å; P271-N583 PolarHBondContact O-ND2 2.89Å; P523-N583 WeakPolarHBondContact CG-O 3.5Å; N583-A585 PolarHBondContact O-N 3.2Å; N583-G586 PolarHBondContact O-N 2.86Å; N583-H588 HydrophobicContact CB-CB 4.12Å; N583-H588 PolarHBondContact N-O 3.32Å
584	T	89.2	Confident	92	Very high	72 Å²	72	26 Å²	26	44%	0.442	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-33.3	178.6	-48.7	0	0	0	0	113.1
585	A	89	Confident	92.9	Very high	56 Å²	56	26.5 Å²	26.5	46%	0.463	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.1	178.9	0	0	0	0	0	114.7	N583 T587	N583-A585 PolarHBondContact O-N 3.2Å; A585-T587 HydrophobicContact CB-CG2 4.46Å; A585-T587 PolarHBondContact O-N 3.12Å
586	G	89.6	Confident	93	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	73.7	4	-178.2	0	0	0	0	0	115.7	W582 N583 S608	W582-G586 VanDerWaalsContact CZ3-O 3.27Å; W582-G586 WeakPolarHBondContact CZ3-O 3.43Å; N583-G586 PolarHBondContact O-N 2.86Å; G586-S608 WeakPolarHBondContact O-CB 3.48Å
587	T	91.9	Very high	93	Very high	46 Å²	46	28 Å²	28	28%	0.282	15%	0.147	S	C	.	.	S	Bend	trans	-89	-19.7	-177.2	55.2	0	0	0	0	114.3	A585 V603	A585-T587 HydrophobicContact CB-CG2 4.46Å; A585-T587 PolarHBondContact O-N 3.12Å; T587-V603 PolarHBondContact O-N 3.09Å
588	H	94.3	Very high	93	Very high	46 Å²	46	27.8 Å²	27.8	21%	0.213	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	142.9	-175.5	-66.9	79.3	0	0	0	110.9	W582 N583 V600 C601	W582-H588 WeakPolarHBondContact CA-O 3.45Å; N583-H588 HydrophobicContact CB-CB 4.12Å; N583-H588 PolarHBondContact N-O 3.32Å; H588-V600 HydrophobicContact CB-CG1 3.91Å; H588-C601 CarbonylContact C-O 3.54Å; H588-C601 VanDerWaalsContact CA-O 3.27Å; H588-C601 WeakPolarHBondContact CA-O 3.34Å
589	V	95.7	Very high	92.9	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	115.3	172.8	-177.3	0	0	0	0	108.3	L538 I540 C580 W582 V591 V600 C601 V603	L538-V589 HydrophobicContact CD1-CG1 4.13Å; L538-V589 HydrophobicContact CD2-CB 4.46Å; L538-V589 HydrophobicContact CD2-CG1 4.27Å; I540-V589 HydrophobicContact CD1-CG2 4.3Å; C580-V589 HydrophobicContact CB-CG1 4.23Å; W582-V589 HydrophobicContact CD2-CG2 3.5Å; W582-V589 VanDerWaalsContact CD2-CG2 3.5Å; W582-V589 HydrophobicContact CE3-CG2 3.46Å; W582-V589 VanDerWaalsContact CE3-CG2 3.46Å; W582-V589 HydrophobicContact CG-CG2 4.19Å; W582-V589 HydrophobicContact CH2-CG2 3.75Å; W582-V589 HydrophobicContact CZ2-CG2 3.77Å; W582-V589 HydrophobicContact CZ3-CG2 3.59Å; V589-V591 HydrophobicContact CG1-CG2 4.07Å; V589-V600 WeakPolarHBondContact O-CA 3.36Å; V589-C601 PolarHBondContact N-O 3.02Å; V589-C601 PolarHBondContact O-N 3.09Å; V589-V603 HydrophobicContact CG2-CG2 3.7Å
590	A	95.5	Very high	92.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	136.2	168.3	0	0	0	0	0	109.3	L264 W266 L274 C580 R581 V600	L264-A590 HydrophobicContact CD1-CB 4.26Å; W266-A590 HydrophobicContact CZ2-CB 3.56Å; L274-A590 HydrophobicContact CD1-CB 3.83Å; L274-A590 HydrophobicContact CD2-CB 3.65Å; L274-A590 HydrophobicContact CG-CB 4.42Å; C580-A590 CarbonylContact C-O 3.6Å; C580-A590 WeakPolarHBondContact CA-O 3.5Å; R581-A590 PolarHBondContact N-O 3.3Å; R581-A590 PolarHBondContact O-N 2.7Å; A590-V600 HydrophobicContact CB-CG2 4.22Å
591	V	95.8	Very high	92.7	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134	176.3	-171.1	0	0	0	0	109.1	V532 L538 L556 L577 K579 C580 V589 V598 T599	V532-V591 HydrophobicContact CG2-CG1 4.08Å; L538-V591 HydrophobicContact CB-CG2 4.44Å; L538-V591 HydrophobicContact CD1-CG2 3.84Å; L538-V591 HydrophobicContact CD2-CG2 3.79Å; L538-V591 HydrophobicContact CG-CG2 4.22Å; L556-V591 HydrophobicContact CD1-CB 3.94Å; L556-V591 HydrophobicContact CD1-CG1 4.07Å; L556-V591 HydrophobicContact CD1-CG2 4Å; L577-V591 HydrophobicContact CB-CG1 4.1Å; L577-V591 HydrophobicContact CD1-CG1 3.86Å; L577-V591 HydrophobicContact CD2-CG1 3.71Å; L577-V591 HydrophobicContact CG-CG1 4.07Å; K579-V591 CarbonylContact O-C 3.58Å; K579-V591 VanDerWaalsContact O-CA 3.31Å; K579-V591 WeakPolarHBondContact O-CA 3.08Å; C580-V591 HydrophobicContact CB-CG2 4.28Å; V589-V591 HydrophobicContact CG1-CG2 4.07Å; V591-V598 CarbonylContact O-C 3.57Å; V591-V598 WeakPolarHBondContact O-CA 3.46Å; V591-T599 PolarHBondContact N-O 3.45Å; V591-T599 PolarHBondContact O-N 3.37Å
592	G	94.1	Very high	92.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.9	177.5	0	0	0	0	0	110.5	I261 N578 K579	I261-G592 VanDerWaalsContact CD1-CA 3.41Å; N578-G592 PolarHBondContact N-O 3.34Å; K579-G592 PolarHBondContact N-O 3.48Å; K579-G592 PolarHBondContact O-N 3.44Å
593	D	92.8	Very high	92.5	Very high	5 Å²	5	22 Å²	22	3%	0.027	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-176.2	178.7	73.9	-0.4	0	0	0	113.8	I261 V575 A576 L577 T595 G596 R597	I261-D593 PolarHBondContact N-O 3.46Å; I261-D593 VanDerWaalsContact N-O 3.09Å; V575-D593 HydrophobicContact CG1-CB 3.41Å; V575-D593 VanDerWaalsContact CG1-CB 3.41Å; V575-D593 VanDerWaalsContact CG1-OD2 3.3Å; V575-D593 WeakPolarHBondContact CG1-OD2 3.42Å; A576-D593 CarbonylContact O-C 3.6Å; A576-D593 WeakPolarHBondContact O-CA 3.19Å; L577-D593 HydrophobicContact CD2-CB 3.97Å; D593-T595 PolarHBondContact OD1-N 3Å; D593-T595 VanDerWaalsContact OD1-N 3.15Å; D593-T595 PolarHBondContact OD2-OG1 3.33Å; D593-G596 VanDerWaalsContact OD1-CA 3.31Å; D593-G596 WeakPolarHBondContact OD1-CA 3.39Å; D593-G596 PolarHBondContact OD1-N 3.34Å; D593-R597 PolarHBondContact N-O 2.87Å; D593-R597 PolarHBondContact OD1-N 2.86Å; D593-R597 VanDerWaalsContact OD1-O 3.05Å; D593-R597 VanDerWaalsContact OD2-CB 3.3Å; D593-R597 WeakPolarHBondContact OD2-CB 3.43Å
594	D	90.3	Very high	92.3	Very high	58 Å²	58	25.3 Å²	25.3	31%	0.31	14%	0.143	S	C	.	.	S	Bend	trans	-82.9	-19.8	173.6	69.2	-31.2	0	0	0	113.6	R259 T260 A576	R259-D594 CarbonylContact C-O 3.45Å; T260-D594 WeakPolarHBondContact CA-O 3.07Å; T260-D594 HydrophobicContact CG2-CB 4.08Å; T260-D594 WeakPolarHBondContact CG2-O 3.18Å; A576-D594 HydrophobicContact CB-CB 4.45Å; A576-D594 PolarHBondContact N-OD1 3.45Å; A576-D594 PolarHBondContact O-N 2.95Å
595	T	89.9	Confident	92.1	Very high	41 Å²	41	27.5 Å²	27.5	25%	0.252	15%	0.148	S	C	.	.	S	Bend	trans	-86.3	-13.4	179.4	79.6	0	0	0	0	114.6	H258 R259 V575 D593	H258-T595 PolarHBondContact N-O 3.08Å; H258-T595 VanDerWaalsContact N-O 3.11Å; R259-T595 CarbonylContact O-C 3.36Å; V575-T595 HydrophobicContact CG1-CG2 4.17Å; V575-T595 HydrophobicContact CG2-CG2 3.96Å; D593-T595 PolarHBondContact OD1-N 3Å; D593-T595 VanDerWaalsContact OD1-N 3.15Å; D593-T595 PolarHBondContact OD2-OG1 3.33Å
596	G	89.1	Confident	91.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	99.4	11.9	178.6	0	0	0	0	0	115.8	S256 R259 Y278 D593	S256-G596 VanDerWaalsContact CB-O 3.23Å; S256-G596 WeakPolarHBondContact CB-O 3.48Å; S256-G596 WeakPolarHBondContact O-CA 3.5Å; S256-G596 PolarHBondContact OG-O 2.91Å; R259-G596 WeakPolarHBondContact O-CA 3.36Å; R259-G596 PolarHBondContact O-N 3.06Å; R259-G596 VanDerWaalsContact O-N 3.1Å; Y278-G596 WeakPolarHBondContact CE1-O 3.11Å; Y278-G596 PolarHBondContact OH-O 2.95Å; D593-G596 VanDerWaalsContact OD1-CA 3.31Å; D593-G596 WeakPolarHBondContact OD1-CA 3.39Å; D593-G596 PolarHBondContact OD1-N 3.34Å
597	R	91.5	Very high	91.7	Very high	71 Å²	71	28.5 Å²	28.5	27%	0.268	15%	0.151	S	C	.	.			trans	-84.1	140.2	171.2	-58.1	171.4	173	-117.4	-2.6	110.9	E249 F251 I261 D593	E249-R597 WeakPolarHBondContact OE1-CD 3.13Å; E249-R597 IonicContact OE1-CZ 3.96Å; E249-R597 IonicContact OE1-NE 2.81Å; E249-R597 IonicContact OE1-NH1 3.97Å; E249-R597 PolarHBondContact OE1-NH1 3.18Å; F251-R597 HydrophobicContact CB-CG 4.13Å; F251-R597 HydrophobicContact CD2-CB 4.34Å; F251-R597 HydrophobicContact CD2-CG 3.39Å; F251-R597 HydrophobicContact CE2-CG 4.04Å; F251-R597 HydrophobicContact CG-CG 3.97Å; I261-R597 WeakPolarHBondContact CD1-O 3.37Å; D593-R597 PolarHBondContact N-O 2.87Å; D593-R597 PolarHBondContact OD1-N 2.86Å; D593-R597 VanDerWaalsContact OD1-O 3.05Å; D593-R597 VanDerWaalsContact OD2-CB 3.3Å; D593-R597 WeakPolarHBondContact OD2-CB 3.43Å
598	V	93.2	Very high	91.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	110.2	176.1	-177.1	0	0	0	0	107.3	F250 I261 L264 L274 T276 Y278 V591	F250-V598 HydrophobicContact CB-CB 4.28Å; F250-V598 PolarHBondContact N-O 3.35Å; F250-V598 PolarHBondContact O-N 3.31Å; I261-V598 HydrophobicContact CD1-CG2 3.49Å; I261-V598 VanDerWaalsContact CD1-CG2 3.49Å; I261-V598 HydrophobicContact CG1-CG2 4.45Å; L264-V598 HydrophobicContact CD2-CG1 4.38Å; L274-V598 HydrophobicContact CD2-CG1 3.56Å; T276-V598 HydrophobicContact CG2-CB 4.32Å; T276-V598 HydrophobicContact CG2-CG1 4Å; T276-V598 HydrophobicContact CG2-CG2 3.44Å; T276-V598 VanDerWaalsContact CG2-CG2 3.44Å; Y278-V598 WeakPolarHBondContact OH-CG2 3.32Å; V591-V598 CarbonylContact O-C 3.57Å; V591-V598 WeakPolarHBondContact O-CA 3.46Å
599	T	92.7	Very high	90.9	Very high	13 Å²	13	29.6 Å²	29.6	8%	0.08	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127	177.1	-53.3	0	0	0	0	108.7	V246 L556 V591	V246-T599 HydrophobicContact CB-CG2 4.41Å; V246-T599 HydrophobicContact CG1-CG2 3.65Å; V246-T599 HydrophobicContact CG2-CG2 3.88Å; L556-T599 HydrophobicContact CD1-CG2 4.4Å; L556-T599 HydrophobicContact CD2-CG2 4.13Å; V591-T599 PolarHBondContact N-O 3.45Å; V591-T599 PolarHBondContact O-N 3.37Å
600	V	94	Very high	90.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.9	171.6	-172	0	0	0	0	108.7	S247 N248 F250 W266 L274 M297 H588 V589 A590	S247-V600 PolarHBondContact N-O 3.25Å; S247-V600 PolarHBondContact OG-O 3.08Å; S247-V600 VanDerWaalsContact OG-O 3.05Å; N248-V600 HydrophobicContact CB-CB 4.35Å; N248-V600 PolarHBondContact N-O 3.4Å; N248-V600 PolarHBondContact O-N 3.05Å; F250-V600 HydrophobicContact CD2-CG2 4.37Å; F250-V600 HydrophobicContact CE2-CG2 4.01Å; W266-V600 HydrophobicContact CH2-CG1 4.03Å; W266-V600 HydrophobicContact CH2-CG2 4.35Å; W266-V600 HydrophobicContact CZ2-CG1 4.12Å; L274-V600 HydrophobicContact CD2-CG2 4.01Å; M297-V600 HydrophobicContact CE-CB 3.84Å; M297-V600 HydrophobicContact CE-CG1 3.48Å; M297-V600 VanDerWaalsContact CE-CG1 3.48Å; M297-V600 HydrophobicContact CE-CG2 4.22Å; M297-V600 HydrophobicContact SD-CB 3.99Å; M297-V600 HydrophobicContact SD-CG1 4.03Å; M297-V600 HydrophobicContact SD-CG2 3.68Å; H588-V600 HydrophobicContact CB-CG1 3.91Å; V589-V600 WeakPolarHBondContact O-CA 3.36Å; A590-V600 HydrophobicContact CB-CG2 4.22Å
601	C	93.6	Very high	89.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	134.4	176.9	-62.4	0	0	0	0	109.5	T245 L538 H588 V589	T245-C601 CarbonylContact O-C 3.55Å; T245-C601 VanDerWaalsContact O-CA 3.26Å; T245-C601 WeakPolarHBondContact O-CA 3.46Å; L538-C601 HydrophobicContact CD2-CB 4.02Å; H588-C601 CarbonylContact C-O 3.54Å; H588-C601 VanDerWaalsContact CA-O 3.27Å; H588-C601 WeakPolarHBondContact CA-O 3.34Å; V589-C601 PolarHBondContact N-O 3.02Å; V589-C601 PolarHBondContact O-N 3.09Å
602	S	93.4	Very high	89.3	Confident	35 Å²	35	40.7 Å²	40.7	25%	0.245	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	131.8	166.4	-171.7	0	0	0	0	108.9	T245	T245-S602 PolarHBondContact N-O 3.04Å; T245-S602 VanDerWaalsContact N-O 3.11Å; T245-S602 PolarHBondContact O-N 3.14Å
603	V	93.1	Very high	88.9	Confident	5 Å²	5	45.5 Å²	45.5	3%	0.03	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	134.3	176.2	-179.8	0	0	0	0	108	L244 W582 T587 V589 L607	L244-V603 HydrophobicContact CD2-CB 4.41Å; L244-V603 HydrophobicContact CD2-CG2 3.78Å; W582-V603 HydrophobicContact CH2-CG1 4.27Å; W582-V603 HydrophobicContact CH2-CG2 3.91Å; W582-V603 HydrophobicContact CZ3-CB 4.23Å; W582-V603 HydrophobicContact CZ3-CG1 4.25Å; W582-V603 HydrophobicContact CZ3-CG2 3.68Å; T587-V603 PolarHBondContact O-N 3.09Å; V589-V603 HydrophobicContact CG2-CG2 3.7Å; V603-L607 HydrophobicContact CG1-CB 3.68Å; V603-L607 HydrophobicContact CG1-CD1 4.32Å
604	H	89.9	Confident	88.7	Confident	83 Å²	83	46.6 Å²	46.6	38%	0.384	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-60.1	151.4	179.7	-177.1	-102.5	0	0	0	112.3	L243 S606 L607 S608	L243-H604 HydrophobicContact CB-CB 4.5Å; L243-H604 HydrophobicContact CD2-CB 4.03Å; L243-H604 PolarHBondContact O-N 3.32Å; H604-S606 WeakPolarHBondContact ND1-CB 3.29Å; H604-S606 PolarHBondContact ND1-N 3.1Å; H604-S606 PolarHBondContact ND1-OG 3.27Å; H604-S606 PolarHBondContact O-N 3.38Å; H604-S606 VanDerWaalsContact O-N 3.15Å; H604-L607 PolarHBondContact O-N 3.05Å; H604-S608 PolarHBondContact O-N 2.97Å; H604-S608 VanDerWaalsContact O-N 3.14Å
605	E	85.5	Confident	88.6	Confident	117 Å²	117	45.3 Å²	45.3	55%	0.547	24%	0.244	S	C	.	.	H	α-helix	trans	-55.6	-38.7	-172.7	-173.4	167.9	-165.7	0	0	112.3	L607 S608 Q609	E605-L607 PolarHBondContact O-N 2.97Å; E605-L607 VanDerWaalsContact O-N 3.15Å; E605-S608 WeakPolarHBondContact CA-OG 3.34Å; E605-S608 PolarHBondContact O-N 3.26Å; E605-S608 VanDerWaalsContact O-N 3.13Å; E605-S608 PolarHBondContact O-OG 3.31Å; E605-S608 VanDerWaalsContact O-OG 3.11Å; E605-Q609 HydrophobicContact CG-CG 4.27Å; E605-Q609 PolarHBondContact O-N 3.43Å; E605-Q609 PolarHBondContact OE1-NE2 3.08Å; E605-Q609 PolarHBondContact OE1-OE1 2.97Å
606	S	84.9	Confident	88.5	Confident	71 Å²	71	45.4 Å²	45.4	50%	0.497	25%	0.246	S	C	.	.	H	α-helix	trans	-58.5	-26.6	180	66.1	0	0	0	0	114.9	H604	H604-S606 WeakPolarHBondContact ND1-CB 3.29Å; H604-S606 PolarHBondContact ND1-N 3.1Å; H604-S606 PolarHBondContact ND1-OG 3.27Å; H604-S606 PolarHBondContact O-N 3.38Å; H604-S606 VanDerWaalsContact O-N 3.15Å
607	L	85.1	Confident	88.6	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-101.2	-25.1	177.9	-62.9	176.2	0	0	0	111.9	L243 I540 D542 V551 V603 H604 E605	L243-L607 HydrophobicContact CB-CD1 4.21Å; L243-L607 HydrophobicContact CD1-CD1 4.39Å; I540-L607 HydrophobicContact CG2-CD1 4.13Å; D542-L607 HydrophobicContact CB-CD2 4.26Å; V551-L607 HydrophobicContact CG1-CD1 4.43Å; V551-L607 HydrophobicContact CG1-CD2 4.25Å; V603-L607 HydrophobicContact CG1-CB 3.68Å; V603-L607 HydrophobicContact CG1-CD1 4.32Å; H604-L607 PolarHBondContact O-N 3.05Å; E605-L607 PolarHBondContact O-N 2.97Å; E605-L607 VanDerWaalsContact O-N 3.15Å
608	S	83	Confident	88.5	Confident	4 Å²	4	44.4 Å²	44.4	3%	0.028	25%	0.251	C	S	.	.	H	α-helix	trans	-80.8	-39.2	-176.6	72.7	0	0	0	0	113.2	G586 H604 E605	G586-S608 WeakPolarHBondContact O-CB 3.48Å; H604-S608 PolarHBondContact O-N 2.97Å; H604-S608 VanDerWaalsContact O-N 3.14Å; E605-S608 WeakPolarHBondContact CA-OG 3.34Å; E605-S608 PolarHBondContact O-N 3.26Å; E605-S608 VanDerWaalsContact O-N 3.13Å; E605-S608 PolarHBondContact O-OG 3.31Å; E605-S608 VanDerWaalsContact O-OG 3.11Å
609	Q	85.9	Confident	88.4	Confident	111 Å²	111	46 Å²	46	52%	0.519	26%	0.263	S	S	.	.	S	Bend	trans	-105.5	112.4	-176.8	-69.4	-174.2	31.4	0	0	110.4	E605	E605-Q609 HydrophobicContact CG-CG 4.27Å; E605-Q609 PolarHBondContact O-N 3.43Å; E605-Q609 PolarHBondContact OE1-NE2 3.08Å; E605-Q609 PolarHBondContact OE1-OE1 2.97Å
610	P	84.6	Confident	88.3	Confident	37 Å²	37	51.4 Å²	51.4	24%	0.24	29%	0.288	C	S	.	.			trans	-74.5	139.4	176.7	30.3	-34.6	0	0	0	111.6	V524 H525	V524-P610 HydrophobicContact CG1-CG 3.98Å; H525-P610 HydrophobicContact CB-CB 4.37Å
611	V	85.4	Confident	88.2	Confident	85 Å²	85	52.9 Å²	52.9	52%	0.515	30%	0.296	S	S	.	.			trans	-80.5	156.1	164.7	-173.6	0	0	0	0	108.9	D613 D614	V611-D613 HydrophobicContact CG1-CB 4.49Å; V611-D613 PolarHBondContact O-N 3.4Å; V611-D614 WeakPolarHBondContact CA-OD2 3.24Å; V611-D614 WeakPolarHBondContact CB-OD2 3.5Å; V611-D614 PolarHBondContact N-OD2 3.08Å; V611-D614 WeakPolarHBondContact O-CB 3.38Å; V611-D614 PolarHBondContact O-N 3.33Å; V611-D614 VanDerWaalsContact O-N 3.13Å
612	T	82.5	Confident	88	Confident	113 Å²	113	53.8 Å²	53.8	69%	0.693	30%	0.301	S	S	*	.	H	α-helix	trans	-56.4	-33.2	177.3	49.1	0	0	0	0	112.9	D614	T612-D614 VanDerWaalsContact C-N 3.29Å; T612-D614 PolarHBondContact O-N 3.38Å
613	D	87.1	Confident	87.9	Confident	100 Å²	100	54.1 Å²	54.1	54%	0.535	31%	0.306	S	S	.	.	H	α-helix	trans	-71.7	-25.3	-177.2	-64	-2.7	0	0	0	111.8	V611 W615 S616 S617	V611-D613 HydrophobicContact CG1-CB 4.49Å; V611-D613 PolarHBondContact O-N 3.4Å; D613-W615 PolarHBondContact O-N 3.11Å; D613-S616 WeakPolarHBondContact CA-OG 3.28Å; D613-S616 PolarHBondContact O-N 2.92Å; D613-S616 VanDerWaalsContact O-N 3.09Å; D613-S616 PolarHBondContact O-OG 3.45Å; D613-S617 WeakPolarHBondContact O-CB 3.46Å; D613-S617 PolarHBondContact O-N 3.37Å; D613-S617 PolarHBondContact O-OG 3.15Å; D613-S617 VanDerWaalsContact O-OG 3.06Å
614	D	87.8	Confident	87.8	Confident	28 Å²	28	58 Å²	58	15%	0.15	33%	0.326	C	S	.	.	H	α-helix	trans	-63.3	-29.9	-179.8	-65.4	-34.5	0	0	0	112.4	H525 N544 V611 T612 F618	H525-D614 IonicContact NE2-OD2 2.81Å; N544-D614 PolarHBondContact ND2-O 3.37Å; V611-D614 WeakPolarHBondContact CA-OD2 3.24Å; V611-D614 WeakPolarHBondContact CB-OD2 3.5Å; V611-D614 PolarHBondContact N-OD2 3.08Å; V611-D614 WeakPolarHBondContact O-CB 3.38Å; V611-D614 PolarHBondContact O-N 3.33Å; V611-D614 VanDerWaalsContact O-N 3.13Å; T612-D614 VanDerWaalsContact C-N 3.29Å; T612-D614 PolarHBondContact O-N 3.38Å; D614-F618 WeakPolarHBondContact O-CB 3.48Å; D614-F618 PolarHBondContact O-N 3.44Å
615	W	87.6	Confident	87.7	Confident	32 Å²	32	55 Å²	55	12%	0.121	31%	0.313	C	S	.	.	H	α-helix	trans	-68.9	-42.1	175.2	-66.5	83.8	0	0	0	111.9	F480 F482 P526 D613 A619	F480-W615 HydrophobicContact CD2-CB 3.89Å; F480-W615 HydrophobicContact CE2-CB 4.22Å; F482-W615 AromaticContact CD2-CE3 3.91Å; F482-W615 HydrophobicContact CD2-CE3 3.91Å; F482-W615 AromaticContact CD2-CZ3 3.85Å; F482-W615 HydrophobicContact CD2-CZ3 3.85Å; F482-W615 AromaticContact CE2-CE3 3.61Å; F482-W615 HydrophobicContact CE2-CE3 3.61Å; F482-W615 HydrophobicContact CE2-CZ3 4.06Å; P526-W615 HydrophobicContact CB-CD2 4.03Å; P526-W615 HydrophobicContact CB-CE3 3.81Å; P526-W615 HydrophobicContact CB-CH2 3.9Å; P526-W615 HydrophobicContact CB-CZ2 4.15Å; P526-W615 HydrophobicContact CB-CZ3 3.73Å; P526-W615 HydrophobicContact CG-CD2 3.76Å; P526-W615 HydrophobicContact CG-CE3 4.08Å; P526-W615 HydrophobicContact CG-CG 4.1Å; P526-W615 HydrophobicContact CG-CH2 4.37Å; P526-W615 HydrophobicContact CG-CZ2 4.11Å; P526-W615 HydrophobicContact CG-CZ3 4.36Å; D613-W615 PolarHBondContact O-N 3.11Å; W615-A619 PolarHBondContact O-N 3.01Å
616	S	89.3	Confident	87.7	Confident	42 Å²	42	51.7 Å²	51.7	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-71.4	-43.9	175.5	39.8	0	0	0	0	111.9	D613 F618 A619 H620	D613-S616 WeakPolarHBondContact CA-OG 3.28Å; D613-S616 PolarHBondContact O-N 2.92Å; D613-S616 VanDerWaalsContact O-N 3.09Å; D613-S616 PolarHBondContact O-OG 3.45Å; S616-F618 VanDerWaalsContact C-N 3.28Å; S616-F618 PolarHBondContact O-N 3.31Å; S616-A619 WeakPolarHBondContact O-CB 3.44Å; S616-A619 PolarHBondContact O-N 3.1Å; S616-A619 VanDerWaalsContact O-N 3.13Å; S616-H620 PolarHBondContact O-CD2 3.3Å; S616-H620 PolarHBondContact O-N 3.11Å
617	S	90.1	Very high	87.6	Confident	51 Å²	51	53.9 Å²	53.9	36%	0.357	30%	0.299	S	S	.	.	H	α-helix	trans	-57.6	-44.7	176.1	-62	0	0	0	0	110.6	D613 A619 H620 V621	D613-S617 WeakPolarHBondContact O-CB 3.46Å; D613-S617 PolarHBondContact O-N 3.37Å; D613-S617 PolarHBondContact O-OG 3.15Å; D613-S617 VanDerWaalsContact O-OG 3.06Å; S617-A619 VanDerWaalsContact C-N 3.33Å; S617-A619 PolarHBondContact O-N 3.36Å; S617-H620 WeakPolarHBondContact O-CB 3.21Å; S617-H620 PolarHBondContact O-N 3.46Å; S617-H620 VanDerWaalsContact O-N 3.09Å; S617-V621 WeakPolarHBondContact O-CG2 3.45Å; S617-V621 PolarHBondContact O-N 3.47Å
618	F	90.9	Very high	87.3	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-64.1	-38	177.5	-176	-124.9	0	0	0	112.7	F482 L485 W521 P526 A527 M543 N544 D614 S616 H620 V621 L622	F482-F618 HydrophobicContact CD1-CD1 4.24Å; F482-F618 HydrophobicContact CD1-CE1 4.08Å; F482-F618 HydrophobicContact CD2-CD1 4.02Å; F482-F618 HydrophobicContact CD2-CE1 4.22Å; F482-F618 AromaticContact CE1-CD1 3.92Å; F482-F618 HydrophobicContact CE1-CD1 3.92Å; F482-F618 HydrophobicContact CE1-CE1 4.17Å; F482-F618 AromaticContact CE2-CD1 3.66Å; F482-F618 HydrophobicContact CE2-CD1 3.66Å; F482-F618 HydrophobicContact CE2-CE1 4.3Å; F482-F618 HydrophobicContact CG-CD1 4.29Å; F482-F618 HydrophobicContact CG-CE1 4.12Å; F482-F618 AromaticContact CZ-CD1 3.62Å; F482-F618 HydrophobicContact CZ-CD1 3.62Å; F482-F618 HydrophobicContact CZ-CE1 4.29Å; L485-F618 HydrophobicContact CD1-CE1 3.83Å; L485-F618 HydrophobicContact CD1-CZ 3.89Å; W521-F618 HydrophobicContact CH2-CZ 4.31Å; P526-F618 HydrophobicContact CB-CD1 4.25Å; A527-F618 HydrophobicContact CB-CB 4.1Å; A527-F618 HydrophobicContact CB-CD2 3.55Å; A527-F618 HydrophobicContact CB-CE2 4.21Å; A527-F618 HydrophobicContact CB-CG 3.86Å; M543-F618 HydrophobicContact CB-CD2 4.46Å; M543-F618 HydrophobicContact CB-CE2 4.3Å; M543-F618 HydrophobicContact CE-CD2 4.06Å; M543-F618 HydrophobicContact CE-CE2 3.19Å; M543-F618 HydrophobicContact CE-CZ 3.61Å; M543-F618 HydrophobicContact SD-CE2 3.75Å; M543-F618 HydrophobicContact SD-CZ 4.38Å; N544-F618 WeakPolarHBondContact OD1-CA 3.31Å; N544-F618 WeakPolarHBondContact OD1-CB 3.4Å; N544-F618 PolarHBondContact OD1-N 3.17Å; N544-F618 VanDerWaalsContact OD1-N 3.09Å; D614-F618 WeakPolarHBondContact O-CB 3.48Å; D614-F618 PolarHBondContact O-N 3.44Å; S616-F618 VanDerWaalsContact C-N 3.28Å; S616-F618 PolarHBondContact O-N 3.31Å; F618-H620 VanDerWaalsContact C-N 3.31Å; F618-H620 PolarHBondContact O-N 3.14Å; F618-V621 PolarHBondContact O-N 3Å; F618-L622 VanDerWaalsContact O-CB 3.27Å; F618-L622 WeakPolarHBondContact O-CB 3.38Å; F618-L622 PolarHBondContact O-N 3.3Å
619	A	89.3	Confident	86.5	Confident	32 Å²	32	64.9 Å²	64.9	26%	0.264	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-37.3	173.8	0	0	0	0	0	112.4	F482 W615 S616 S617 A623	F482-A619 HydrophobicContact CE1-CB 4.28Å; F482-A619 HydrophobicContact CZ-CB 4.07Å; W615-A619 PolarHBondContact O-N 3.01Å; S616-A619 WeakPolarHBondContact O-CB 3.44Å; S616-A619 PolarHBondContact O-N 3.1Å; S616-A619 VanDerWaalsContact O-N 3.13Å; S617-A619 VanDerWaalsContact C-N 3.33Å; S617-A619 PolarHBondContact O-N 3.36Å; A619-A623 PolarHBondContact O-N 3.03Å; A619-A623 VanDerWaalsContact O-N 3.15Å
620	H	91.1	Very high	85.4	Confident	127 Å²	127	65.2 Å²	65.2	59%	0.588	35%	0.347	S	S	*	.	H	α-helix	trans	-67.9	-49.4	174.7	-73.8	-65.5	0	0	0	111.7	S616 S617 F618 L622 A623 D624	S616-H620 PolarHBondContact O-CD2 3.3Å; S616-H620 PolarHBondContact O-N 3.11Å; S617-H620 WeakPolarHBondContact O-CB 3.21Å; S617-H620 PolarHBondContact O-N 3.46Å; S617-H620 VanDerWaalsContact O-N 3.09Å; F618-H620 VanDerWaalsContact C-N 3.31Å; F618-H620 PolarHBondContact O-N 3.14Å; H620-L622 VanDerWaalsContact C-N 3.28Å; H620-L622 PolarHBondContact O-N 3.49Å; H620-A623 WeakPolarHBondContact O-CA 3.49Å; H620-A623 WeakPolarHBondContact O-CB 3.2Å; H620-A623 PolarHBondContact O-N 2.78Å; H620-D624 PolarHBondContact O-N 3.05Å
621	V	91.9	Very high	84.1	Confident	31 Å²	31	69.8 Å²	69.8	19%	0.188	37%	0.365	C	S	.	.	H	α-helix	trans	-56.7	-44	176	172.3	0	0	0	0	110.7	M543 S617 F618 A623 D624 L625	M543-V621 HydrophobicContact CB-CG1 4.47Å; S617-V621 WeakPolarHBondContact O-CG2 3.45Å; S617-V621 PolarHBondContact O-N 3.47Å; F618-V621 PolarHBondContact O-N 3Å; V621-A623 VanDerWaalsContact C-N 3.29Å; V621-A623 PolarHBondContact O-N 3.06Å; V621-D624 PolarHBondContact O-N 3.46Å; V621-L625 HydrophobicContact CG1-CD1 3.9Å; V621-L625 HydrophobicContact CG1-CG 4.16Å; V621-L625 WeakPolarHBondContact O-CB 3.3Å; V621-L625 VanDerWaalsContact O-CG 3.28Å; V621-L625 WeakPolarHBondContact O-CG 3.01Å; V621-L625 PolarHBondContact O-N 2.97Å
622	L	90.3	Very high	82.7	Confident	20 Å²	20	69.3 Å²	69.3	11%	0.105	36%	0.364	C	S	.	.	H	α-helix	trans	-62.4	-35.9	177.2	-173.2	71.4	0	0	0	112.4	L485 L497 I506 F618 H620 K626	L485-L622 HydrophobicContact CD1-CD1 4.3Å; L485-L622 HydrophobicContact CD1-CD2 4.01Å; L485-L622 HydrophobicContact CD2-CD1 4.23Å; L485-L622 HydrophobicContact CD2-CD2 4.32Å; L497-L622 HydrophobicContact CD2-CD1 4Å; I506-L622 HydrophobicContact CD1-CD1 3.88Å; I506-L622 HydrophobicContact CG2-CD1 4.1Å; F618-L622 VanDerWaalsContact O-CB 3.27Å; F618-L622 WeakPolarHBondContact O-CB 3.38Å; F618-L622 PolarHBondContact O-N 3.3Å; H620-L622 VanDerWaalsContact C-N 3.28Å; H620-L622 PolarHBondContact O-N 3.49Å; L622-K626 VanDerWaalsContact O-CG 3.24Å; L622-K626 WeakPolarHBondContact O-CG 3.42Å; L622-K626 PolarHBondContact O-N 3.32Å
623	A	89.9	Confident	81.1	Confident	41 Å²	41	69 Å²	69	34%	0.339	36%	0.355	S	S	.	.	H	α-helix	trans	-69.5	-42	175	0	0	0	0	0	111.3	A619 H620 V621 K626 H627	A619-A623 PolarHBondContact O-N 3.03Å; A619-A623 VanDerWaalsContact O-N 3.15Å; H620-A623 WeakPolarHBondContact O-CA 3.49Å; H620-A623 WeakPolarHBondContact O-CB 3.2Å; H620-A623 PolarHBondContact O-N 2.78Å; V621-A623 VanDerWaalsContact C-N 3.29Å; V621-A623 PolarHBondContact O-N 3.06Å; A623-K626 WeakPolarHBondContact O-CB 3.28Å; A623-K626 PolarHBondContact O-N 3.33Å; A623-H627 PolarHBondContact O-CD2 3.27Å; A623-H627 PolarHBondContact O-N 2.91Å; A623-H627 VanDerWaalsContact O-N 3.08Å
624	D	90.9	Very high	79.5	Confident	86 Å²	86	69.9 Å²	69.9	46%	0.46	36%	0.363	S	S	.	.	H	α-helix	trans	-65.2	-45.1	179.2	-66.6	-19.6	0	0	0	111.4	H620 V621 K626 H627 Y628	H620-D624 PolarHBondContact O-N 3.05Å; V621-D624 PolarHBondContact O-N 3.46Å; D624-K626 VanDerWaalsContact C-N 3.28Å; D624-K626 PolarHBondContact O-N 3.4Å; D624-H627 WeakPolarHBondContact O-CA 3.29Å; D624-H627 WeakPolarHBondContact O-CB 3.47Å; D624-H627 PolarHBondContact O-N 3.48Å; D624-Y628 WeakPolarHBondContact O-CD2 3.46Å; D624-Y628 PolarHBondContact O-N 3.03Å
625	L	88.3	Confident	77.8	Confident	21 Å²	21	76.6 Å²	76.6	11%	0.11	39%	0.394	C	S	.	.	H	α-helix	trans	-58.1	-40.9	175.7	-70.8	176.9	0	0	0	112	I506 H507 A547 V621 H627 Y628 E629	I506-L625 HydrophobicContact CG2-CB 4.16Å; H507-L625 HydrophobicContact CB-CD1 4.16Å; A547-L625 HydrophobicContact CB-CD2 4.46Å; V621-L625 HydrophobicContact CG1-CD1 3.9Å; V621-L625 HydrophobicContact CG1-CG 4.16Å; V621-L625 WeakPolarHBondContact O-CB 3.3Å; V621-L625 VanDerWaalsContact O-CG 3.28Å; V621-L625 WeakPolarHBondContact O-CG 3.01Å; V621-L625 PolarHBondContact O-N 2.97Å; L625-H627 VanDerWaalsContact C-N 3.31Å; L625-H627 PolarHBondContact O-N 3Å; L625-Y628 PolarHBondContact O-N 3.02Å; L625-E629 PolarHBondContact O-N 3.34Å
626	K	85.4	Confident	76.1	Confident	47 Å²	47	80.5 Å²	80.5	20%	0.204	42%	0.421	C	S	.	.	H	α-helix	trans	-65.1	-34.2	174.3	-73.2	176.4	177.9	-144	0	113.1	E502 I506 L622 A623 D624 M630	E502-K626 IonicContact OE1-NZ 2.7Å; E502-K626 PolarHBondContact OE1-NZ 3.23Å; E502-K626 IonicContact OE2-NZ 2.73Å; E502-K626 PolarHBondContact OE2-NZ 3.11Å; I506-K626 HydrophobicContact CG2-CG 3.84Å; L622-K626 VanDerWaalsContact O-CG 3.24Å; L622-K626 WeakPolarHBondContact O-CG 3.42Å; L622-K626 PolarHBondContact O-N 3.32Å; A623-K626 WeakPolarHBondContact O-CB 3.28Å; A623-K626 PolarHBondContact O-N 3.33Å; D624-K626 VanDerWaalsContact C-N 3.28Å; D624-K626 PolarHBondContact O-N 3.4Å; K626-M630 HydrophobicContact CB-CE 4.41Å; K626-M630 WeakPolarHBondContact O-CE 3.28Å
627	H	84.3	Confident	74	Confident	117 Å²	117	87.5 Å²	87.5	54%	0.542	45%	0.45	S	S	.	.	H	α-helix	trans	-71.2	-43.5	177.4	-81.4	-63.1	0	0	0	111.9	A623 D624 L625 E629 M630 E631	A623-H627 PolarHBondContact O-CD2 3.27Å; A623-H627 PolarHBondContact O-N 2.91Å; A623-H627 VanDerWaalsContact O-N 3.08Å; D624-H627 WeakPolarHBondContact O-CA 3.29Å; D624-H627 WeakPolarHBondContact O-CB 3.47Å; D624-H627 PolarHBondContact O-N 3.48Å; L625-H627 VanDerWaalsContact C-N 3.31Å; L625-H627 PolarHBondContact O-N 3Å; H627-E629 VanDerWaalsContact C-N 3.26Å; H627-E629 PolarHBondContact O-N 3.23Å; H627-M630 PolarHBondContact O-N 3.21Å; H627-M630 VanDerWaalsContact O-N 3.1Å; H627-E631 PolarHBondContact O-N 3.44Å
628	Y	78.1	Confident	71.7	Confident	165 Å²	165	92 Å²	92	65%	0.647	49%	0.49	S	S	*	.	H	α-helix	trans	-58.9	-35.7	178.2	-82.2	-66.4	0	0	0	113.1	D624 L625 M630 P632	D624-Y628 WeakPolarHBondContact O-CD2 3.46Å; D624-Y628 PolarHBondContact O-N 3.03Å; L625-Y628 PolarHBondContact O-N 3.02Å; Y628-M630 VanDerWaalsContact C-N 3.34Å; Y628-P632 WeakPolarHBondContact O-CD 3.47Å
629	E	66.9	Low	70.8	Confident	77 Å²	77	96.7 Å²	96.7	36%	0.36	52%	0.515	S	S	.	.	H	α-helix	trans	-76.6	-20	179.3	-151.4	-169.1	169.4	0	0	113.4	P505 L625 H627 P632	P505-E629 VanDerWaalsContact O-CD 3.22Å; P505-E629 VanDerWaalsContact O-OE1 3.09Å; L625-E629 PolarHBondContact O-N 3.34Å; H627-E629 VanDerWaalsContact C-N 3.26Å; H627-E629 PolarHBondContact O-N 3.23Å; E629-P632 VanDerWaalsContact O-CD 3.3Å; E629-P632 WeakPolarHBondContact O-CD 3.41Å; E629-P632 VanDerWaalsContact O-CG 3.28Å; E629-P632 WeakPolarHBondContact O-CG 3.43Å
630	M	62.2	Low	69.8	Low	118 Å²	118	100.1 Å²	100.1	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-80.9	-26.5	175.4	-73.8	-172.1	-106.1	0	0	113.2	K626 H627 Y628	K626-M630 HydrophobicContact CB-CE 4.41Å; K626-M630 WeakPolarHBondContact O-CE 3.28Å; H627-M630 PolarHBondContact O-N 3.21Å; H627-M630 VanDerWaalsContact O-N 3.1Å; Y628-M630 VanDerWaalsContact C-N 3.34Å
631	E	57.6	Low	68.6	Low	132 Å²	132	98.6 Å²	98.6	62%	0.617	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-64.6	-39.5	178.2	-68.4	-167.8	158.9	0	0	116.1	H627 E633 V634	H627-E631 PolarHBondContact O-N 3.44Å; E631-E633 PolarHBondContact O-N 3.44Å; E631-E633 VanDerWaalsContact O-N 3.08Å; E631-V634 PolarHBondContact O-N 3.28Å; E631-V634 VanDerWaalsContact O-N 3.11Å
632	P	54.3	Low	67.2	Low	75 Å²	75	102.5 Å²	102.5	49%	0.487	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-63.3	-16.8	-177.1	22	-34.5	0	0	0	114.8	Y628 E629 T636	Y628-P632 WeakPolarHBondContact O-CD 3.47Å; E629-P632 VanDerWaalsContact O-CD 3.3Å; E629-P632 WeakPolarHBondContact O-CD 3.41Å; E629-P632 VanDerWaalsContact O-CG 3.28Å; E629-P632 WeakPolarHBondContact O-CG 3.43Å; P632-T636 PolarHBondContact O-OG1 3.47Å
633	E	50.4	Low	65.8	Low	108 Å²	108	107.7 Å²	107.7	51%	0.505	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-75.3	-26.9	176.5	-69.4	-172.9	171.4	0	0	112.4	K504 E631 E635 T636	K504-E633 IonicContact NZ-OE1 3.77Å; K504-E633 PolarHBondContact NZ-OE1 3.25Å; E631-E633 PolarHBondContact O-N 3.44Å; E631-E633 VanDerWaalsContact O-N 3.08Å; E633-E635 VanDerWaalsContact C-N 3.32Å; E633-E635 PolarHBondContact O-N 3.39Å; E633-T636 PolarHBondContact O-N 2.97Å; E633-T636 PolarHBondContact O-OG1 3.11Å
634	V	53.3	Low	64.2	Low	118 Å²	118	112.1 Å²	112.1	72%	0.715	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-27	-177.7	-174.9	0	0	0	0	112.1	E631	E631-V634 PolarHBondContact O-N 3.28Å; E631-V634 VanDerWaalsContact O-N 3.11Å
635	E	51.6	Low	62.3	Low	168 Å²	168	114 Å²	114	79%	0.785	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-13	178.5	-69.5	-164.9	159.2	0	0	114.1	E633	E633-E635 VanDerWaalsContact C-N 3.32Å; E633-E635 PolarHBondContact O-N 3.39Å
636	T	51.2	Low	60.3	Low	114 Å²	114	121.2 Å²	121.2	70%	0.699	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-8.1	-178	44.1	0	0	0	0	114.7	P632 E633	P632-T636 PolarHBondContact O-OG1 3.47Å; E633-T636 PolarHBondContact O-N 2.97Å; E633-T636 PolarHBondContact O-OG1 3.11Å
637	E	46.8	Very low	58.2	Low	190 Å²	190	127.3 Å²	127.3	89%	0.888	67%	0.669	S	S	*	*			trans	-99.3	2.8	172.8	-69.3	-164	158.4	0	0	114.8
638	A	41.3	Very low	55.8	Low	146 Å²	146	128.3 Å²	128.3	100%	1.207	68%	0.681	S	S	*	*			trans	-99	0	172.9	0	0	0	0	0	111.9

Retrieved 638 of 638 residues in 138.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).