A0A077YYM5_TRITR Loading...

Metallothionein family protein

AlphaFold DB , UniProt , Accession A0A077YYM5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 602 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	T	34.1	Very low	63.2	Low	199 Å²	199	113.2 Å²	113.2	100%	1.221	66%	0.66	S	S	*	*				0	116.5	0	30.8	0	0	0	0	107.4
2	A	28.5	Very low	64.9	Low	114 Å²	114	109.4 Å²	109.4	94%	0.942	66%	0.664	S	S	*	*			trans	-79.3	132	-177.1	0	0	0	0	0	109.8
3	G	33.9	Very low	66.6	Low	66 Å²	66	106.8 Å²	106.8	68%	0.68	64%	0.643	S	S	*	*			trans	-152.8	89.9	-176.2	0	0	0	0	0	112.7	A5	G3-A5 PolarHBondContact O-N 3.04Å
4	E	40.3	Very low	68	Low	163 Å²	163	99.5 Å²	99.5	76%	0.762	60%	0.6	S	S	*	*			trans	35.7	70	144.1	-64.6	178.2	150.3	0	0	119.3	N6 T7	E4-N6 VanDerWaalsContact C-N 3.3Å; E4-N6 PolarHBondContact O-N 3.47Å; E4-T7 HydrophobicContact CB-CG2 4.22Å
5	A	53.1	Low	68.8	Low	106 Å²	106	102.3 Å²	102.3	88%	0.876	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	25.6	178.4	0	0	0	0	0	115.7	G3	G3-A5 PolarHBondContact O-N 3.04Å
6	N	67.9	Low	69.5	Low	93 Å²	93	99.9 Å²	99.9	50%	0.497	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-154.2	35.4	174	-139.8	-1.5	0	0	0	114.4	E4	E4-N6 VanDerWaalsContact C-N 3.3Å; E4-N6 PolarHBondContact O-N 3.47Å
7	T	83.6	Confident	70.3	Confident	92 Å²	92	101.8 Å²	101.8	56%	0.564	61%	0.612	S	S	*	*	B	Isolated β-bridge	trans	-105	141.1	175.6	63.2	0	0	0	0	110.9	E4 G23	E4-T7 HydrophobicContact CB-CG2 4.22Å; T7-G23 CarbonylContact C-O 3.52Å; T7-G23 WeakPolarHBondContact CA-O 3.36Å
8	C	88.8	Confident	71.2	Confident	11 Å²	11	98.6 Å²	98.6	7%	0.074	59%	0.589	C	S	.	*			trans	-137.2	155.4	-178.7	61	0	0	0	0	110.7	D13 C20 G23 K24	C8-D13 HydrophobicContact CB-CB 3.99Å; C8-C20 HydrophobicContact CB-CB 3.71Å; C8-C20 WeakPolarHBondContact CB-SG 2.98Å; C8-C20 PolarHBondContact O-SG 2.89Å; C8-C20 WeakPolarHBondContact SG-CA 3.1Å; C8-C20 WeakPolarHBondContact SG-CB 2.98Å; C8-C20 CovalentContact SG-SG 2.02Å; C8-C20 PolarHBondContact SG-SG 3.37Å; C8-G23 PolarHBondContact N-O 3.29Å; C8-G23 WeakPolarHBondContact O-CA 3.27Å; C8-K24 PolarHBondContact SG-N 3.1Å; C8-K24 PolarHBondContact SG-O 3.27Å; C8-K24 VanDerWaalsContact SG-O 3.36Å
9	K	87.2	Confident	72.1	Confident	195 Å²	195	93.4 Å²	93.4	85%	0.848	56%	0.558	S	S	*	*	S	Bend	trans	-112.9	-27	173.2	-67.8	-177.3	179.9	176.9	0	112.3	D13	K9-D13 WeakPolarHBondContact CA-OD2 2.96Å; K9-D13 PolarHBondContact N-OD2 2.04Å
10	R	89	Confident	73	Confident	184 Å²	184	89.5 Å²	89.5	69%	0.694	54%	0.535	S	S	*	.	S	Bend	trans	-141.3	157.1	-177.6	-55.1	-179	-67.6	-178.2	0.9	109.4	G12 D13 C20	R10-G12 PolarHBondContact O-N 3.49Å; R10-G12 VanDerWaalsContact O-N 3.11Å; R10-D13 PolarHBondContact N-OD2 3.09Å; R10-D13 WeakPolarHBondContact O-CB 3.44Å; R10-D13 PolarHBondContact O-N 3.39Å; R10-C20 WeakPolarHBondContact O-CB 3.37Å
11	H	88.8	Confident	73.5	Confident	22 Å²	22	87 Å²	87	10%	0.102	52%	0.519	C	S	.	.	G	3₁₀ helix	trans	-60.1	-24.6	179.4	-57	-47.3	0	0	0	114.2	D13 C14 C20 D38 G46 C47 K48	H11-D13 VanDerWaalsContact C-N 3.25Å; H11-D13 PolarHBondContact O-N 2.88Å; H11-C14 PolarHBondContact O-N 3.13Å; H11-C20 PolarHBondContact CE1-O 3.1Å; H11-C20 PolarHBondContact ND1-N 3.29Å; H11-C20 PolarHBondContact ND1-O 2.78Å; H11-D38 IonicContact CD2-OD1 3.04Å; H11-D38 PolarHBondContact CD2-OD1 2.96Å; H11-D38 VanDerWaalsContact CD2-OD1 3.29Å; H11-D38 IonicContact CD2-OD2 3.02Å; H11-D38 IonicContact NE2-OD1 2.67Å; H11-D38 PolarHBondContact NE2-OD1 3.11Å; H11-D38 VanDerWaalsContact NE2-OD1 3.13Å; H11-D38 IonicContact NE2-OD2 3.07Å; H11-D38 PolarHBondContact NE2-OD2 3.26Å; H11-G46 WeakPolarHBondContact NE2-CA 3.45Å; H11-C47 PolarHBondContact CD2-O 2.63Å; H11-K48 HydrophobicContact CB-CB 4.23Å; H11-K48 HydrophobicContact CB-CD 4.31Å; H11-K48 HydrophobicContact CB-CG 4.24Å; H11-K48 VanDerWaalsContact O-CE 3.31Å; H11-K48 WeakPolarHBondContact O-CE 3.44Å
12	G	83.7	Confident	75.8	Confident	68 Å²	68	87.1 Å²	87.1	70%	0.701	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-72.7	-12.2	174.5	0	0	0	0	0	114.8	R10 C14	R10-G12 PolarHBondContact O-N 3.49Å; R10-G12 VanDerWaalsContact O-N 3.11Å; G12-C14 VanDerWaalsContact C-N 3.27Å
13	D	86.5	Confident	78.6	Confident	75 Å²	75	83.1 Å²	83.1	40%	0.401	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-81.2	-13	175	-50.9	-26.2	0	0	0	111.4	C8 K9 R10 H11	C8-D13 HydrophobicContact CB-CB 3.99Å; K9-D13 WeakPolarHBondContact CA-OD2 2.96Å; K9-D13 PolarHBondContact N-OD2 2.04Å; R10-D13 PolarHBondContact N-OD2 3.09Å; R10-D13 WeakPolarHBondContact O-CB 3.44Å; R10-D13 PolarHBondContact O-N 3.39Å; H11-D13 VanDerWaalsContact C-N 3.25Å; H11-D13 PolarHBondContact O-N 2.88Å
14	C	86.7	Confident	81.1	Confident	5 Å²	5	86.7 Å²	86.7	3%	0.034	47%	0.473	C	S	.	.	S	Bend	trans	-98.7	132.1	179.1	-56	0	0	0	0	111	H11 G12 E18 C20 C25 K48	H11-C14 PolarHBondContact O-N 3.13Å; G12-C14 VanDerWaalsContact C-N 3.27Å; C14-E18 HydrophobicContact CB-CB 3.62Å; C14-C20 PolarHBondContact SG-N 2.84Å; C14-C25 WeakPolarHBondContact CA-SG 3.18Å; C14-C25 HydrophobicContact CB-CB 3.67Å; C14-C25 WeakPolarHBondContact CB-SG 3.11Å; C14-C25 WeakPolarHBondContact SG-CA 3.32Å; C14-C25 WeakPolarHBondContact SG-CB 3.05Å; C14-C25 CovalentContact SG-SG 2.04Å; C14-C25 PolarHBondContact SG-SG 3.19Å; C14-K48 PolarHBondContact O-NZ 2.04Å
15	I	80	Confident	83.4	Confident	141 Å²	141	79.8 Å²	79.8	72%	0.723	44%	0.442	S	S	*	.			trans	-79.8	149.4	-174.2	57.7	171.9	0	0	0	111.1	Q17 E18	I15-Q17 PolarHBondContact O-N 3.17Å; I15-E18 PolarHBondContact O-N 2.69Å
16	G	80.1	Confident	84.9	Confident	65 Å²	65	75.6 Å²	75.6	67%	0.67	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	-127.2	175.1	0	0	0	0	0	114.3	E18 K48	G16-E18 VanDerWaalsContact C-N 3.29Å; G16-E18 PolarHBondContact O-N 2.97Å; G16-K48 PolarHBondContact O-NZ 3.45Å
17	Q	82.9	Confident	85.6	Confident	131 Å²	131	76.1 Å²	76.1	61%	0.612	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	19.5	-172.6	-65.9	-172	86.4	0	0	113.9	I15 A28 W53	I15-Q17 PolarHBondContact O-N 3.17Å; Q17-A28 CarbonylContact O-C 3.56Å; Q17-A28 PolarHBondContact O-N 2.73Å; Q17-W53 HydrophobicContact CB-CH2 4.36Å; Q17-W53 HydrophobicContact CB-CZ3 3.84Å; Q17-W53 HydrophobicContact CG-CH2 4.15Å; Q17-W53 HydrophobicContact CG-CZ3 4.07Å
18	E	87.4	Confident	85.7	Confident	44 Å²	44	71.8 Å²	71.8	21%	0.206	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	153.1	179.9	-64.6	175.2	149.8	0	0	112.5	C14 I15 G16 C25 A26 K48	C14-E18 HydrophobicContact CB-CB 3.62Å; I15-E18 PolarHBondContact O-N 2.69Å; G16-E18 VanDerWaalsContact C-N 3.29Å; G16-E18 PolarHBondContact O-N 2.97Å; E18-C25 HydrophobicContact CB-CB 4.21Å; E18-C25 WeakPolarHBondContact OE2-CB 3.35Å; E18-A26 CarbonylContact C-O 3.55Å; E18-A26 WeakPolarHBondContact CA-O 3.5Å; E18-K48 WeakPolarHBondContact O-CD 3.36Å; E18-K48 PolarHBondContact O-NZ 3.36Å
19	I	87.7	Confident	85.5	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	145	167.8	58.2	179.2	0	0	0	111.3	L21 A26 A28 K48 W53	I19-L21 HydrophobicContact CD1-CD1 3.76Å; I19-L21 HydrophobicContact CD1-CD2 4.23Å; I19-L21 HydrophobicContact CD1-CG 3.98Å; I19-L21 HydrophobicContact CG1-CD1 3.86Å; I19-L21 HydrophobicContact CG1-CG 3.9Å; I19-L21 PolarHBondContact O-N 3.31Å; I19-A26 PolarHBondContact N-O 2.75Å; I19-A26 PolarHBondContact O-N 3.29Å; I19-A28 HydrophobicContact CB-CB 4.31Å; I19-A28 HydrophobicContact CD1-CB 3.63Å; I19-A28 HydrophobicContact CG1-CB 3.52Å; I19-A28 HydrophobicContact CG2-CB 4.1Å; I19-K48 HydrophobicContact CG2-CB 4.39Å; I19-K48 HydrophobicContact CG2-CD 4.27Å; I19-W53 HydrophobicContact CD1-CB 4.17Å; I19-W53 WeakPolarHBondContact CD1-O 3.3Å; I19-W53 HydrophobicContact CG2-CB 3.59Å; I19-W53 HydrophobicContact CG2-CG 4.04Å
20	C	89.9	Confident	85.5	Confident	15 Å²	15	70.1 Å²	70.1	10%	0.101	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	107.8	172.4	-168.7	0	0	0	0	112.1	C8 R10 H11 C14 K24	C8-C20 HydrophobicContact CB-CB 3.71Å; C8-C20 WeakPolarHBondContact CB-SG 2.98Å; C8-C20 PolarHBondContact O-SG 2.89Å; C8-C20 WeakPolarHBondContact SG-CA 3.1Å; C8-C20 WeakPolarHBondContact SG-CB 2.98Å; C8-C20 CovalentContact SG-SG 2.02Å; C8-C20 PolarHBondContact SG-SG 3.37Å; R10-C20 WeakPolarHBondContact O-CB 3.37Å; H11-C20 PolarHBondContact CE1-O 3.1Å; H11-C20 PolarHBondContact ND1-N 3.29Å; H11-C20 PolarHBondContact ND1-O 2.78Å; C14-C20 PolarHBondContact SG-N 2.84Å; C20-K24 WeakPolarHBondContact CA-O 3.4Å
21	L	83.9	Confident	85.3	Confident	37 Å²	37	62.1 Å²	62.1	19%	0.194	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.1	174.6	-70.1	170.1	0	0	0	109.5	I19 G23 K24 A26 E55	I19-L21 HydrophobicContact CD1-CD1 3.76Å; I19-L21 HydrophobicContact CD1-CD2 4.23Å; I19-L21 HydrophobicContact CD1-CG 3.98Å; I19-L21 HydrophobicContact CG1-CD1 3.86Å; I19-L21 HydrophobicContact CG1-CG 3.9Å; I19-L21 PolarHBondContact O-N 3.31Å; L21-G23 PolarHBondContact O-N 3.49Å; L21-G23 VanDerWaalsContact O-N 3.09Å; L21-K24 PolarHBondContact N-O 2.89Å; L21-K24 PolarHBondContact O-N 3.47Å; L21-K24 VanDerWaalsContact O-O 3.06Å; L21-A26 HydrophobicContact CD1-CB 4.28Å; L21-E55 HydrophobicContact CD1-CB 3.56Å; L21-E55 HydrophobicContact CD1-CG 3.75Å
22	Q	83.1	Confident	85.1	Confident	203 Å²	203	70.9 Å²	70.9	95%	0.949	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	34.5	179.3	-55.1	-178.6	5.8	0	0	113.7
23	G	86.2	Confident	85.3	Confident	30 Å²	30	70.6 Å²	70.6	31%	0.309	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	10.7	179.4	0	0	0	0	0	115.1	T7 C8 L21	T7-G23 CarbonylContact C-O 3.52Å; T7-G23 WeakPolarHBondContact CA-O 3.36Å; C8-G23 PolarHBondContact N-O 3.29Å; C8-G23 WeakPolarHBondContact O-CA 3.27Å; L21-G23 PolarHBondContact O-N 3.49Å; L21-G23 VanDerWaalsContact O-N 3.09Å
24	K	86.9	Confident	85.5	Confident	141 Å²	141	75.1 Å²	75.1	61%	0.613	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	145.8	174.5	-63.6	-178.6	-178.9	178	0	111	C8 C20 L21	C8-K24 PolarHBondContact SG-N 3.1Å; C8-K24 PolarHBondContact SG-O 3.27Å; C8-K24 VanDerWaalsContact SG-O 3.36Å; C20-K24 WeakPolarHBondContact CA-O 3.4Å; L21-K24 PolarHBondContact N-O 2.89Å; L21-K24 PolarHBondContact O-N 3.47Å; L21-K24 VanDerWaalsContact O-O 3.06Å
25	C	88.4	Confident	85.8	Confident	17 Å²	17	75.2 Å²	75.2	12%	0.115	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	127.4	171	-63.4	0	0	0	0	109.2	C14 E18	C14-C25 WeakPolarHBondContact CA-SG 3.18Å; C14-C25 HydrophobicContact CB-CB 3.67Å; C14-C25 WeakPolarHBondContact CB-SG 3.11Å; C14-C25 WeakPolarHBondContact SG-CA 3.32Å; C14-C25 WeakPolarHBondContact SG-CB 3.05Å; C14-C25 CovalentContact SG-SG 2.04Å; C14-C25 PolarHBondContact SG-SG 3.19Å; E18-C25 HydrophobicContact CB-CB 4.21Å; E18-C25 WeakPolarHBondContact OE2-CB 3.35Å
26	A	83.5	Confident	86.2	Confident	19 Å²	19	76.5 Å²	76.5	16%	0.157	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140	177.6	0	0	0	0	0	109.4	E18 I19 L21 A28 E55	E18-A26 CarbonylContact C-O 3.55Å; E18-A26 WeakPolarHBondContact CA-O 3.5Å; I19-A26 PolarHBondContact N-O 2.75Å; I19-A26 PolarHBondContact O-N 3.29Å; L21-A26 HydrophobicContact CD1-CB 4.28Å; A26-A28 PolarHBondContact O-N 2.03Å; A26-E55 HydrophobicContact CB-CG 4.16Å
27	D	84.3	Confident	86.7	Confident	104 Å²	104	76.1 Å²	76.1	56%	0.556	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.8	133.4	174.4	-68	-45.3	0	0	0	110.2	E56	D27-E56 HydrophobicContact CB-CB 4.5Å; D27-E56 PolarHBondContact O-N 3.31Å
28	A	85.5	Confident	86.9	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.008	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	157.5	-179.7	0	0	0	0	0	111.7	Q17 I19 A26 W53 E54	Q17-A28 CarbonylContact O-C 3.56Å; Q17-A28 PolarHBondContact O-N 2.73Å; I19-A28 HydrophobicContact CB-CB 4.31Å; I19-A28 HydrophobicContact CD1-CB 3.63Å; I19-A28 HydrophobicContact CG1-CB 3.52Å; I19-A28 HydrophobicContact CG2-CB 4.1Å; A26-A28 PolarHBondContact O-N 2.03Å; A28-W53 HydrophobicContact CB-CB 4.1Å; A28-W53 HydrophobicContact CB-CE3 4.06Å; A28-W53 VanDerWaalsContact O-CE3 3.26Å; A28-W53 VanDerWaalsContact O-CZ3 3.26Å; A28-W53 WeakPolarHBondContact O-CZ3 3.2Å; A28-E54 CarbonylContact C-O 3.56Å; A28-E54 WeakPolarHBondContact CA-O 2.93Å; A28-E54 WeakPolarHBondContact CB-O 3.47Å
29	R	84.6	Confident	87	Confident	125 Å²	125	80.7 Å²	80.7	47%	0.472	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	144.3	175.8	68.9	-177	-170.6	-176.6	-1.9	110.8	T31 W53 E54	R29-T31 PolarHBondContact O-N 3.28Å; R29-W53 VanDerWaalsContact O-CA 3.3Å; R29-W53 WeakPolarHBondContact O-CA 3.41Å; R29-E54 HydrophobicContact CG-CG 3.77Å; R29-E54 IonicContact CZ-OE1 3.88Å; R29-E54 PolarHBondContact N-O 3.43Å; R29-E54 IonicContact NE-OE1 2.88Å; R29-E54 PolarHBondContact NE-OE1 3.08Å; R29-E54 IonicContact NH2-OE1 3.77Å; R29-E54 PolarHBondContact NH2-OE1 2.92Å; R29-E54 PolarHBondContact O-N 2.81Å
30	P	86.8	Confident	87	Confident	45 Å²	45	82.8 Å²	82.8	29%	0.292	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	129.7	-179.4	33.2	-35.7	0	0	0	110.1	R51 W53	P30-R51 PolarHBondContact O-NH2 3.41Å; P30-W53 HydrophobicContact CB-CD2 3.87Å; P30-W53 HydrophobicContact CB-CE3 4.24Å; P30-W53 HydrophobicContact CB-CG 4.38Å; P30-W53 HydrophobicContact CB-CH2 4.18Å; P30-W53 HydrophobicContact CB-CZ2 3.83Å; P30-W53 HydrophobicContact CB-CZ3 4.37Å; P30-W53 HydrophobicContact CG-CH2 4.11Å; P30-W53 HydrophobicContact CG-CZ2 4.21Å; P30-W53 HydrophobicContact CG-CZ3 4.3Å
31	T	85.2	Confident	87	Confident	16 Å²	16	83 Å²	83	10%	0.098	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	171.8	175.5	73	0	0	0	0	111.7	R29 T33 R51 C52 E54	R29-T31 PolarHBondContact O-N 3.28Å; T31-T33 PolarHBondContact O-N 3.09Å; T31-T33 PolarHBondContact OG1-N 3.3Å; T31-R51 WeakPolarHBondContact O-CD 3.21Å; T31-R51 WeakPolarHBondContact O-CG 2.91Å; T31-R51 PolarHBondContact O-NE 3.46Å; T31-R51 PolarHBondContact O-NH2 3.14Å; T31-C52 WeakPolarHBondContact CB-O 3.49Å; T31-C52 WeakPolarHBondContact CG2-O 3.02Å; T31-C52 PolarHBondContact N-O 3.31Å; T31-C52 WeakPolarHBondContact OG1-CB 3.26Å; T31-C52 PolarHBondContact OG1-O 2.88Å; T31-E54 HydrophobicContact CG2-CB 4Å; T31-E54 HydrophobicContact CG2-CG 3.78Å
32	K	84.5	Confident	87.1	Confident	206 Å²	206	84.2 Å²	84.2	90%	0.896	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	-6.4	176.2	-65.8	-177	-178.7	179.8	0	114.1
33	T	87.5	Confident	87	Confident	62 Å²	62	84 Å²	84	38%	0.38	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	125.8	-173.7	-51.6	0	0	0	0	110.6	T31 R51 C52	T31-T33 PolarHBondContact O-N 3.09Å; T31-T33 PolarHBondContact OG1-N 3.3Å; T33-R51 WeakPolarHBondContact O-CA 3.02Å; T33-R51 WeakPolarHBondContact O-CG 3.25Å; T33-C52 PolarHBondContact O-N 2.88Å
34	Q	90.1	Very high	86.6	Confident	170 Å²	170	89 Å²	89	79%	0.794	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	148.7	170.8	-67.9	-179	-2.4	0	0	110.5	N50	Q34-N50 VanDerWaalsContact CA-O 3.31Å; Q34-N50 WeakPolarHBondContact CA-O 3.47Å
35	C	92.8	Very high	86.6	Confident	8 Å²	8	83.9 Å²	83.9	5%	0.054	44%	0.436	C	S	.	.			trans	-146.2	156.1	179.5	58	0	0	0	0	110.9	C41 C47 N50 R51 C52	C35-C41 VanDerWaalsContact CB-SG 3.55Å; C35-C47 HydrophobicContact CB-CB 3.91Å; C35-C47 WeakPolarHBondContact CB-SG 3.3Å; C35-C47 PolarHBondContact O-SG 3.29Å; C35-C47 WeakPolarHBondContact SG-CA 3.24Å; C35-C47 WeakPolarHBondContact SG-CB 3.44Å; C35-C47 CovalentContact SG-SG 2.03Å; C35-C47 PolarHBondContact SG-SG 2.95Å; C35-N50 PolarHBondContact N-O 2.99Å; C35-N50 VanDerWaalsContact N-O 3.09Å; C35-N50 CarbonylContact O-C 3.48Å; C35-N50 VanDerWaalsContact O-CA 3.29Å; C35-N50 WeakPolarHBondContact O-CA 3.46Å; C35-R51 PolarHBondContact SG-O 2.79Å; C35-C52 VanDerWaalsContact CB-SG 3.53Å; C35-C52 PolarHBondContact SG-N 2.84Å
36	L	89.1	Confident	86.7	Confident	168 Å²	168	83.1 Å²	83.1	88%	0.88	43%	0.431	S	S	*	.	S	Bend	trans	-104.9	-19.7	170.1	-65.3	172.1	0	0	0	112.1
37	S	89.7	Confident	87.1	Confident	57 Å²	57	83.1 Å²	83.1	40%	0.399	43%	0.429	S	S	.	.	S	Bend	trans	-158.2	169.5	176.9	66.3	0	0	0	0	109.3	Q39 G40 C47	S37-Q39 PolarHBondContact O-N 2.77Å; S37-Q39 VanDerWaalsContact O-N 3.1Å; S37-G40 PolarHBondContact O-N 3.03Å; S37-C47 WeakPolarHBondContact O-CB 3.38Å
38	D	88.6	Confident	87.3	Confident	84 Å²	84	79.4 Å²	79.4	45%	0.449	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-57.9	-26	179.6	-56	-18.5	0	0	0	112.6	H11 G40 C41 C47	H11-D38 IonicContact CD2-OD1 3.04Å; H11-D38 PolarHBondContact CD2-OD1 2.96Å; H11-D38 VanDerWaalsContact CD2-OD1 3.29Å; H11-D38 IonicContact CD2-OD2 3.02Å; H11-D38 IonicContact NE2-OD1 2.67Å; H11-D38 PolarHBondContact NE2-OD1 3.11Å; H11-D38 VanDerWaalsContact NE2-OD1 3.13Å; H11-D38 IonicContact NE2-OD2 3.07Å; H11-D38 PolarHBondContact NE2-OD2 3.26Å; D38-G40 PolarHBondContact O-N 3.48Å; D38-C41 WeakPolarHBondContact O-CB 3.4Å; D38-C41 PolarHBondContact O-N 2.77Å; D38-C47 WeakPolarHBondContact OD1-CA 3.45Å; D38-C47 VanDerWaalsContact OD1-CB 3.32Å; D38-C47 WeakPolarHBondContact OD1-CB 3.49Å; D38-C47 PolarHBondContact OD1-N 3.07Å
39	Q	88.4	Confident	87.4	Confident	187 Å²	187	86.5 Å²	86.5	87%	0.874	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-65.8	-22.6	175	-64.1	-174.7	-4.9	0	0	113.3	S37 C41	S37-Q39 PolarHBondContact O-N 2.77Å; S37-Q39 VanDerWaalsContact O-N 3.1Å; Q39-C41 PolarHBondContact O-N 2.73Å
40	G	88.5	Confident	87.7	Confident	44 Å²	44	85.9 Å²	85.9	45%	0.454	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-77.9	-6.1	173.8	0	0	0	0	0	113.4	S37 D38	S37-G40 PolarHBondContact O-N 3.03Å; D38-G40 PolarHBondContact O-N 3.48Å
41	C	90.1	Very high	87.9	Confident	18 Å²	18	88.7 Å²	88.7	12%	0.122	46%	0.456	C	S	.	.	S	Bend	trans	-103.1	147.6	-176.5	-61.2	0	0	0	0	112.7	C35 D38 Q39 Q45 C52	C35-C41 VanDerWaalsContact CB-SG 3.55Å; D38-C41 WeakPolarHBondContact O-CB 3.4Å; D38-C41 PolarHBondContact O-N 2.77Å; Q39-C41 PolarHBondContact O-N 2.73Å; C41-Q45 HydrophobicContact CB-CB 3.88Å; C41-C52 WeakPolarHBondContact CA-SG 3.29Å; C41-C52 HydrophobicContact CB-CB 3.74Å; C41-C52 WeakPolarHBondContact CB-SG 3.4Å; C41-C52 WeakPolarHBondContact SG-CA 3.44Å; C41-C52 WeakPolarHBondContact SG-CB 3.31Å; C41-C52 CovalentContact SG-SG 2.04Å; C41-C52 PolarHBondContact SG-SG 3.33Å
42	P	86.1	Confident	88.2	Confident	64 Å²	64	87.9 Å²	87.9	42%	0.416	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-51.8	160.7	167	-24.9	32.5	0	0	0	112.8	N44 Q45	P42-N44 PolarHBondContact O-N 3.49Å; P42-Q45 HydrophobicContact CB-CG 4.4Å; P42-Q45 WeakPolarHBondContact O-CB 3.45Å; P42-Q45 PolarHBondContact O-N 3.28Å
43	K	81.4	Confident	88.6	Confident	199 Å²	199	79.1 Å²	79.1	87%	0.865	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	141.9	177.1	-73	-175.1	177.1	-178.5	0	111.4	Q45	K43-Q45 VanDerWaalsContact C-N 3.3Å
44	N	76.4	Confident	88.6	Confident	134 Å²	134	78.6 Å²	78.6	72%	0.717	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	26.2	-177.9	-53.1	-22.7	0	0	0	114.9	P42	P42-N44 PolarHBondContact O-N 3.49Å
45	Q	88.1	Confident	88.2	Confident	34 Å²	34	74.4 Å²	74.4	16%	0.159	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	156.8	174.1	-58.3	-169.1	3.5	0	0	110.4	C41 P42 K43 W53 E54	C41-Q45 HydrophobicContact CB-CB 3.88Å; P42-Q45 HydrophobicContact CB-CG 4.4Å; P42-Q45 WeakPolarHBondContact O-CB 3.45Å; P42-Q45 PolarHBondContact O-N 3.28Å; K43-Q45 VanDerWaalsContact C-N 3.3Å; Q45-W53 CarbonylContact C-O 3.59Å; Q45-W53 WeakPolarHBondContact CA-O 3.21Å; Q45-W53 WeakPolarHBondContact CB-O 3.21Å; Q45-E54 HydrophobicContact CG-CB 3.75Å; Q45-E54 PolarHBondContact NE2-OE2 3.48Å
46	G	88.7	Confident	87.2	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.7	180	0	0	0	0	0	112.2	H11 K48 C52 W53	H11-G46 WeakPolarHBondContact NE2-CA 3.45Å; G46-K48 PolarHBondContact O-N 2.02Å; G46-C52 CarbonylContact O-C 3.53Å; G46-C52 WeakPolarHBondContact O-CA 3.42Å; G46-W53 PolarHBondContact N-O 3.23Å; G46-W53 PolarHBondContact O-N 3.03Å
47	C	92	Very high	85.7	Confident	20 Å²	20	76.4 Å²	76.4	14%	0.135	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	109	177.1	-168.5	0	0	0	0	110.5	H11 C35 S37 D38	H11-C47 PolarHBondContact CD2-O 2.63Å; C35-C47 HydrophobicContact CB-CB 3.91Å; C35-C47 WeakPolarHBondContact CB-SG 3.3Å; C35-C47 PolarHBondContact O-SG 3.29Å; C35-C47 WeakPolarHBondContact SG-CA 3.24Å; C35-C47 WeakPolarHBondContact SG-CB 3.44Å; C35-C47 CovalentContact SG-SG 2.03Å; C35-C47 PolarHBondContact SG-SG 2.95Å; S37-C47 WeakPolarHBondContact O-CB 3.38Å; D38-C47 WeakPolarHBondContact OD1-CA 3.45Å; D38-C47 VanDerWaalsContact OD1-CB 3.32Å; D38-C47 WeakPolarHBondContact OD1-CB 3.49Å; D38-C47 PolarHBondContact OD1-N 3.07Å
48	K	89.5	Confident	83.9	Confident	25 Å²	25	77.7 Å²	77.7	11%	0.109	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	127.9	177	-166.2	-177.1	-172.2	-178.3	0	108.7	H11 C14 G16 E18 I19 G46 N50 R51 W53	H11-K48 HydrophobicContact CB-CB 4.23Å; H11-K48 HydrophobicContact CB-CD 4.31Å; H11-K48 HydrophobicContact CB-CG 4.24Å; H11-K48 VanDerWaalsContact O-CE 3.31Å; H11-K48 WeakPolarHBondContact O-CE 3.44Å; C14-K48 PolarHBondContact O-NZ 2.04Å; G16-K48 PolarHBondContact O-NZ 3.45Å; E18-K48 WeakPolarHBondContact O-CD 3.36Å; E18-K48 PolarHBondContact O-NZ 3.36Å; I19-K48 HydrophobicContact CG2-CB 4.39Å; I19-K48 HydrophobicContact CG2-CD 4.27Å; G46-K48 PolarHBondContact O-N 2.02Å; K48-N50 PolarHBondContact O-N 3.34Å; K48-R51 PolarHBondContact N-O 2.92Å; K48-R51 PolarHBondContact O-N 2.87Å; K48-R51 VanDerWaalsContact O-O 3.06Å; K48-W53 HydrophobicContact CB-CG 4.27Å; K48-W53 PolarHBondContact O-NE1 2.03Å
49	L	87.8	Confident	82.4	Confident	150 Å²	150	82.4 Å²	82.4	79%	0.785	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	45.7	-177.9	-56.9	171.9	0	0	0	113.8	R51	L49-R51 PolarHBondContact O-N 2.95Å; L49-R51 VanDerWaalsContact O-N 3.14Å
50	N	90	Very high	81.4	Confident	112 Å²	112	78.3 Å²	78.3	60%	0.599	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	17.7	179.2	-55.1	-48.5	0	0	0	115.6	Q34 C35 K48	Q34-N50 VanDerWaalsContact CA-O 3.31Å; Q34-N50 WeakPolarHBondContact CA-O 3.47Å; C35-N50 PolarHBondContact N-O 2.99Å; C35-N50 VanDerWaalsContact N-O 3.09Å; C35-N50 CarbonylContact O-C 3.48Å; C35-N50 VanDerWaalsContact O-CA 3.29Å; C35-N50 WeakPolarHBondContact O-CA 3.46Å; K48-N50 PolarHBondContact O-N 3.34Å
51	R	91.4	Very high	80.7	Confident	104 Å²	104	84 Å²	84	39%	0.392	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.4	174.8	-122.3	168.5	91.4	166.7	3.1	109.7	P30 T31 T33 C35 K48 L49	P30-R51 PolarHBondContact O-NH2 3.41Å; T31-R51 WeakPolarHBondContact O-CD 3.21Å; T31-R51 WeakPolarHBondContact O-CG 2.91Å; T31-R51 PolarHBondContact O-NE 3.46Å; T31-R51 PolarHBondContact O-NH2 3.14Å; T33-R51 WeakPolarHBondContact O-CA 3.02Å; T33-R51 WeakPolarHBondContact O-CG 3.25Å; C35-R51 PolarHBondContact SG-O 2.79Å; K48-R51 PolarHBondContact N-O 2.92Å; K48-R51 PolarHBondContact O-N 2.87Å; K48-R51 VanDerWaalsContact O-O 3.06Å; L49-R51 PolarHBondContact O-N 2.95Å; L49-R51 VanDerWaalsContact O-N 3.14Å
52	C	92.7	Very high	80.3	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	131.6	171.3	-64.4	0	0	0	0	109.1	T31 T33 C35 C41 G46	T31-C52 WeakPolarHBondContact CB-O 3.49Å; T31-C52 WeakPolarHBondContact CG2-O 3.02Å; T31-C52 PolarHBondContact N-O 3.31Å; T31-C52 WeakPolarHBondContact OG1-CB 3.26Å; T31-C52 PolarHBondContact OG1-O 2.88Å; T33-C52 PolarHBondContact O-N 2.88Å; C35-C52 VanDerWaalsContact CB-SG 3.53Å; C35-C52 PolarHBondContact SG-N 2.84Å; C41-C52 WeakPolarHBondContact CA-SG 3.29Å; C41-C52 HydrophobicContact CB-CB 3.74Å; C41-C52 WeakPolarHBondContact CB-SG 3.4Å; C41-C52 WeakPolarHBondContact SG-CA 3.44Å; C41-C52 WeakPolarHBondContact SG-CB 3.31Å; C41-C52 CovalentContact SG-SG 2.04Å; C41-C52 PolarHBondContact SG-SG 3.33Å; G46-C52 CarbonylContact O-C 3.53Å; G46-C52 WeakPolarHBondContact O-CA 3.42Å
53	W	91	Very high	80.1	Confident	22 Å²	22	89.1 Å²	89.1	8%	0.083	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.6	176.1	-70.7	67.5	0	0	0	108.5	Q17 I19 A28 R29 P30 Q45 G46 K48	Q17-W53 HydrophobicContact CB-CH2 4.36Å; Q17-W53 HydrophobicContact CB-CZ3 3.84Å; Q17-W53 HydrophobicContact CG-CH2 4.15Å; Q17-W53 HydrophobicContact CG-CZ3 4.07Å; I19-W53 HydrophobicContact CD1-CB 4.17Å; I19-W53 WeakPolarHBondContact CD1-O 3.3Å; I19-W53 HydrophobicContact CG2-CB 3.59Å; I19-W53 HydrophobicContact CG2-CG 4.04Å; A28-W53 HydrophobicContact CB-CB 4.1Å; A28-W53 HydrophobicContact CB-CE3 4.06Å; A28-W53 VanDerWaalsContact O-CE3 3.26Å; A28-W53 VanDerWaalsContact O-CZ3 3.26Å; A28-W53 WeakPolarHBondContact O-CZ3 3.2Å; R29-W53 VanDerWaalsContact O-CA 3.3Å; R29-W53 WeakPolarHBondContact O-CA 3.41Å; P30-W53 HydrophobicContact CB-CD2 3.87Å; P30-W53 HydrophobicContact CB-CE3 4.24Å; P30-W53 HydrophobicContact CB-CG 4.38Å; P30-W53 HydrophobicContact CB-CH2 4.18Å; P30-W53 HydrophobicContact CB-CZ2 3.83Å; P30-W53 HydrophobicContact CB-CZ3 4.37Å; P30-W53 HydrophobicContact CG-CH2 4.11Å; P30-W53 HydrophobicContact CG-CZ2 4.21Å; P30-W53 HydrophobicContact CG-CZ3 4.3Å; Q45-W53 CarbonylContact C-O 3.59Å; Q45-W53 WeakPolarHBondContact CA-O 3.21Å; Q45-W53 WeakPolarHBondContact CB-O 3.21Å; G46-W53 PolarHBondContact N-O 3.23Å; G46-W53 PolarHBondContact O-N 3.03Å; K48-W53 HydrophobicContact CB-CG 4.27Å; K48-W53 PolarHBondContact O-NE1 2.03Å
54	E	87.5	Confident	80.2	Confident	51 Å²	51	81.4 Å²	81.4	24%	0.238	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.7	174.9	65.3	-172.9	-175.8	0	0	109.8	A28 R29 T31 Q45 E56	A28-E54 CarbonylContact C-O 3.56Å; A28-E54 WeakPolarHBondContact CA-O 2.93Å; A28-E54 WeakPolarHBondContact CB-O 3.47Å; R29-E54 HydrophobicContact CG-CG 3.77Å; R29-E54 IonicContact CZ-OE1 3.88Å; R29-E54 PolarHBondContact N-O 3.43Å; R29-E54 IonicContact NE-OE1 2.88Å; R29-E54 PolarHBondContact NE-OE1 3.08Å; R29-E54 IonicContact NH2-OE1 3.77Å; R29-E54 PolarHBondContact NH2-OE1 2.92Å; R29-E54 PolarHBondContact O-N 2.81Å; T31-E54 HydrophobicContact CG2-CB 4Å; T31-E54 HydrophobicContact CG2-CG 3.78Å; Q45-E54 HydrophobicContact CG-CB 3.75Å; Q45-E54 PolarHBondContact NE2-OE2 3.48Å; E54-E56 PolarHBondContact O-N 2.02Å
55	E	82.5	Confident	80.5	Confident	82 Å²	82	77.5 Å²	77.5	38%	0.383	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	129.3	174.2	-168.2	-177	-166.7	0	0	109.2	L21 A26 T57	L21-E55 HydrophobicContact CD1-CB 3.56Å; L21-E55 HydrophobicContact CD1-CG 3.75Å; A26-E55 HydrophobicContact CB-CG 4.16Å; E55-T57 HydrophobicContact CB-CG2 3.76Å; E55-T57 HydrophobicContact CG-CG2 3.49Å; E55-T57 VanDerWaalsContact CG-CG2 3.49Å; E55-T57 PolarHBondContact O-N 2.81Å; E55-T57 PolarHBondContact O-OG1 3.46Å; E55-T57 WeakPolarHBondContact OE2-CG2 3.3Å
56	E	72.2	Confident	80.2	Confident	120 Å²	120	83.7 Å²	83.7	56%	0.561	39%	0.394	S	S	*	.			trans	-74.8	68.8	179.7	-169.1	151.5	-138.3	0	0	109.8	D27 E54 S58	D27-E56 HydrophobicContact CB-CB 4.5Å; D27-E56 PolarHBondContact O-N 3.31Å; E54-E56 PolarHBondContact O-N 2.02Å; E56-S58 VanDerWaalsContact C-N 3.29Å; E56-S58 PolarHBondContact O-N 2.84Å
57	T	58.2	Low	79.9	Confident	97 Å²	97	87.3 Å²	87.3	60%	0.595	41%	0.414	S	S	*	.			trans	-85.8	7.1	-171.8	44.8	0	0	0	0	114.1	E55	E55-T57 HydrophobicContact CB-CG2 3.76Å; E55-T57 HydrophobicContact CG-CG2 3.49Å; E55-T57 VanDerWaalsContact CG-CG2 3.49Å; E55-T57 PolarHBondContact O-N 2.81Å; E55-T57 PolarHBondContact O-OG1 3.46Å; E55-T57 WeakPolarHBondContact OE2-CG2 3.3Å
58	S	51.3	Low	79.4	Confident	85 Å²	85	86.7 Å²	86.7	59%	0.594	41%	0.41	S	S	*	.			trans	-129.5	88.5	-165.1	-62.7	0	0	0	0	111.8	E56 R60	E56-S58 VanDerWaalsContact C-N 3.29Å; E56-S58 PolarHBondContact O-N 2.84Å; S58-R60 PolarHBondContact O-N 2.76Å
59	R	56.5	Low	78.9	Confident	183 Å²	183	90.9 Å²	90.9	69%	0.691	43%	0.43	S	S	*	.			trans	-52.7	113.9	151.4	-71.1	-176	-179.2	178	-0.1	107	Y61 Y78	R59-Y61 PolarHBondContact O-N 2.97Å; R59-Y78 HydrophobicContact CB-CD1 3.61Å; R59-Y78 HydrophobicContact CB-CE1 4.45Å; R59-Y78 HydrophobicContact CB-CG 4.17Å
60	R	67.4	Low	78.1	Confident	100 Å²	100	87.9 Å²	87.9	38%	0.377	41%	0.414	S	S	.	.			trans	-59.2	128.6	-177.7	-91.8	-180	-71.4	-141.8	-4.5	110.1	S58 E72 Y78 C79	S58-R60 PolarHBondContact O-N 2.76Å; R60-E72 IonicContact CZ-OE1 3.13Å; R60-E72 IonicContact CZ-OE2 3.91Å; R60-E72 IonicContact NE-OE2 3.39Å; R60-E72 IonicContact NH2-OE1 2.73Å; R60-E72 PolarHBondContact NH2-OE1 3.41Å; R60-E72 IonicContact NH2-OE2 3.29Å; R60-E72 PolarHBondContact NH2-OE2 3.43Å; R60-Y78 CarbonylContact O-C 3.55Å; R60-Y78 WeakPolarHBondContact O-CA 3.34Å; R60-C79 HydrophobicContact CB-CB 4.07Å; R60-C79 PolarHBondContact O-N 3.19Å
61	Y	73.5	Confident	77.5	Confident	164 Å²	164	88.7 Å²	88.7	64%	0.643	41%	0.414	S	S	*	.	B	Isolated β-bridge	trans	-69.3	138.1	174	-169.5	-87.6	0	0	0	110.3	R59 K63 G77	R59-Y61 PolarHBondContact O-N 2.97Å; Y61-K63 HydrophobicContact CE1-CG 4.14Å; Y61-G77 CarbonylContact C-O 3.5Å; Y61-G77 VanDerWaalsContact CA-O 3.25Å; Y61-G77 WeakPolarHBondContact CA-O 3.35Å; Y61-G77 VanDerWaalsContact CD2-O 3.24Å; Y61-G77 WeakPolarHBondContact CD2-O 3.44Å
62	C	81.5	Confident	77.2	Confident	3 Å²	3	84.9 Å²	84.9	2%	0.02	40%	0.401	C	S	.	.			trans	-136.6	151.2	178.8	60.7	0	0	0	0	111.1	D67 C68 C74 G77 Y78	C62-D67 HydrophobicContact CB-CB 3.91Å; C62-C68 VanDerWaalsContact CB-SG 3.54Å; C62-C74 VanDerWaalsContact C-SG 3.5Å; C62-C74 HydrophobicContact CB-CB 3.68Å; C62-C74 WeakPolarHBondContact CB-SG 3.37Å; C62-C74 PolarHBondContact O-SG 3.36Å; C62-C74 WeakPolarHBondContact SG-CA 3.01Å; C62-C74 WeakPolarHBondContact SG-CB 2.91Å; C62-C74 CovalentContact SG-SG 2.02Å; C62-C74 PolarHBondContact SG-SG 2.72Å; C62-G77 PolarHBondContact N-O 2.9Å; C62-G77 WeakPolarHBondContact O-CA 2.99Å; C62-Y78 PolarHBondContact SG-N 3.19Å; C62-Y78 PolarHBondContact SG-O 3.13Å
63	K	82.1	Confident	76.9	Confident	186 Å²	186	85.1 Å²	85.1	81%	0.809	40%	0.402	S	S	*	.	S	Bend	trans	-105.2	-28.5	169.3	-66.8	-177.6	178.6	178.9	0	111.6	Y61 D67	Y61-K63 HydrophobicContact CE1-CG 4.14Å; K63-D67 WeakPolarHBondContact CA-OD2 3.49Å; K63-D67 WeakPolarHBondContact CB-OD2 3.23Å; K63-D67 PolarHBondContact N-OD2 2.86Å
64	A	83.6	Confident	76.5	Confident	38 Å²	38	85 Å²	85	31%	0.314	40%	0.404	S	S	.	.	S	Bend	trans	-143.9	161.5	178.4	0	0	0	0	0	110.2	K66 D67	A64-K66 HydrophobicContact CB-CG 3.93Å; A64-K66 PolarHBondContact O-N 2.84Å; A64-D67 PolarHBondContact N-OD2 2.84Å; A64-D67 WeakPolarHBondContact O-CB 3.31Å; A64-D67 PolarHBondContact O-N 2.73Å
65	H	83.6	Confident	76.2	Confident	51 Å²	51	85.1 Å²	85.1	24%	0.236	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-54.8	-40.3	179.6	-55.4	-52.4	0	0	0	111.7	D67 C68 L73 C74 A100 R102	H65-D67 PolarHBondContact O-N 2.74Å; H65-C68 WeakPolarHBondContact O-CB 2.97Å; H65-C68 PolarHBondContact O-N 3.38Å; H65-L73 HydrophobicContact CB-CD2 4.41Å; H65-C74 PolarHBondContact CE1-O 2.78Å; H65-C74 PolarHBondContact ND1-N 3.43Å; H65-C74 VanDerWaalsContact ND1-N 3.13Å; H65-C74 PolarHBondContact ND1-O 2.82Å; H65-A100 WeakPolarHBondContact NE2-CB 3.37Å; H65-R102 HydrophobicContact CB-CB 4.5Å; H65-R102 HydrophobicContact CB-CG 4.32Å; H65-R102 VanDerWaalsContact O-CZ 3.25Å; H65-R102 PolarHBondContact O-NH1 2.82Å; H65-R102 PolarHBondContact O-NH2 3Å
66	K	81.2	Confident	75.9	Confident	165 Å²	165	89.4 Å²	89.4	72%	0.717	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-52.9	-19.2	176	67.3	176.7	-176	177	0	115.7	A64 C68	A64-K66 HydrophobicContact CB-CG 3.93Å; A64-K66 PolarHBondContact O-N 2.84Å; K66-C68 VanDerWaalsContact C-N 3.31Å
67	D	82.1	Confident	76.2	Confident	75 Å²	75	84.4 Å²	84.4	40%	0.401	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-81.7	-11.5	178.6	-52.2	-30.5	0	0	0	112.7	C62 K63 A64 H65	C62-D67 HydrophobicContact CB-CB 3.91Å; K63-D67 WeakPolarHBondContact CA-OD2 3.49Å; K63-D67 WeakPolarHBondContact CB-OD2 3.23Å; K63-D67 PolarHBondContact N-OD2 2.86Å; A64-D67 PolarHBondContact N-OD2 2.84Å; A64-D67 WeakPolarHBondContact O-CB 3.31Å; A64-D67 PolarHBondContact O-N 2.73Å; H65-D67 PolarHBondContact O-N 2.74Å
68	C	82.1	Confident	77.2	Confident	8 Å²	8	85 Å²	85	5%	0.054	40%	0.399	C	S	.	.	S	Bend	trans	-96.6	160.4	178.1	-54.4	0	0	0	0	112	C62 H65 K66 E72 C79 R102	C62-C68 VanDerWaalsContact CB-SG 3.54Å; H65-C68 WeakPolarHBondContact O-CB 2.97Å; H65-C68 PolarHBondContact O-N 3.38Å; K66-C68 VanDerWaalsContact C-N 3.31Å; C68-E72 HydrophobicContact CB-CB 3.61Å; C68-E72 WeakPolarHBondContact CB-OE2 3.44Å; C68-C79 WeakPolarHBondContact CA-SG 3.41Å; C68-C79 HydrophobicContact CB-CB 3.59Å; C68-C79 WeakPolarHBondContact CB-SG 3.29Å; C68-C79 WeakPolarHBondContact SG-CA 3.42Å; C68-C79 WeakPolarHBondContact SG-CB 3.5Å; C68-C79 CovalentContact SG-SG 2.03Å; C68-C79 PolarHBondContact SG-SG 2.9Å; C68-R102 PolarHBondContact O-NH2 3.37Å
69	Q	79.9	Confident	78.7	Confident	113 Å²	113	81.3 Å²	81.3	53%	0.528	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-69.7	173.5	177.3	-77.2	-175	-21.2	0	0	112.6	E72 R102	Q69-E72 PolarHBondContact N-OE2 3.23Å; Q69-E72 PolarHBondContact O-N 3.35Å; Q69-R102 PolarHBondContact O-NH2 2.86Å
70	L	69.5	Low	79.9	Confident	86 Å²	86	73.7 Å²	73.7	45%	0.45	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	137.6	169.2	-76.8	153.9	0	0	0	108.9	E72 Q359	L70-E72 VanDerWaalsContact C-N 3.35Å; L70-Q359 HydrophobicContact CD2-CG 3.73Å; L70-Q359 HydrophobicContact CG-CG 4.47Å
71	Q	78.4	Confident	80.7	Confident	130 Å²	130	74 Å²	74	61%	0.607	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	20.5	-173.3	-50.4	178.5	1.4	0	0	116.6	A82 W107	Q71-A82 PolarHBondContact O-N 2.93Å; Q71-A82 VanDerWaalsContact O-O 3.1Å; Q71-W107 VanDerWaalsContact CA-CZ3 3.49Å; Q71-W107 HydrophobicContact CB-CH2 4.43Å; Q71-W107 HydrophobicContact CB-CZ3 4.01Å; Q71-W107 HydrophobicContact CG-CH2 4.03Å; Q71-W107 HydrophobicContact CG-CZ3 3.99Å
72	E	84.7	Confident	81.3	Confident	23 Å²	23	66.3 Å²	66.3	11%	0.107	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	153.9	171.9	-67.1	175.7	160	0	0	112	R60 C68 Q69 L70 C79 I80 R102	R60-E72 IonicContact CZ-OE1 3.13Å; R60-E72 IonicContact CZ-OE2 3.91Å; R60-E72 IonicContact NE-OE2 3.39Å; R60-E72 IonicContact NH2-OE1 2.73Å; R60-E72 PolarHBondContact NH2-OE1 3.41Å; R60-E72 IonicContact NH2-OE2 3.29Å; R60-E72 PolarHBondContact NH2-OE2 3.43Å; C68-E72 HydrophobicContact CB-CB 3.61Å; C68-E72 WeakPolarHBondContact CB-OE2 3.44Å; Q69-E72 PolarHBondContact N-OE2 3.23Å; Q69-E72 PolarHBondContact O-N 3.35Å; L70-E72 VanDerWaalsContact C-N 3.35Å; E72-C79 HydrophobicContact CB-CB 4.35Å; E72-C79 WeakPolarHBondContact OE2-CB 3.38Å; E72-I80 CarbonylContact C-O 3.54Å; E72-I80 WeakPolarHBondContact CA-O 3.39Å; E72-I80 WeakPolarHBondContact CB-O 3.22Å; E72-R102 WeakPolarHBondContact O-CD 3.26Å; E72-R102 PolarHBondContact O-NH1 2.81Å
73	L	85.6	Confident	81.3	Confident	6 Å²	6	70.5 Å²	70.5	3%	0.031	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139.3	167.5	-77	176	0	0	0	110.7	H65 D75 C79 I80 A82 A100 R102 W107 P109	H65-L73 HydrophobicContact CB-CD2 4.41Å; L73-D75 PolarHBondContact O-N 2.9Å; L73-C79 WeakPolarHBondContact O-CA 3.47Å; L73-I80 HydrophobicContact CB-CG1 4.47Å; L73-I80 PolarHBondContact N-O 3.31Å; L73-I80 WeakPolarHBondContact O-CG1 3.39Å; L73-I80 PolarHBondContact O-N 3.15Å; L73-A82 HydrophobicContact CB-CB 4.06Å; L73-A82 HydrophobicContact CD1-CB 3.74Å; L73-A82 HydrophobicContact CG-CB 3.53Å; L73-A100 HydrophobicContact CD1-CB 3.84Å; L73-A100 HydrophobicContact CD2-CB 3.51Å; L73-A100 HydrophobicContact CG-CB 4.28Å; L73-R102 HydrophobicContact CD2-CB 4.24Å; L73-W107 HydrophobicContact CD1-CB 3.67Å; L73-W107 HydrophobicContact CD2-CB 3.89Å; L73-W107 HydrophobicContact CD2-CG 4.44Å; L73-W107 HydrophobicContact CG-CB 3.85Å; L73-P109 HydrophobicContact CD1-CG 4.43Å
74	C	83.7	Confident	81.5	Confident	19 Å²	19	64 Å²	64	13%	0.128	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	106.6	163.6	-170.3	0	0	0	0	111	C62 H65	C62-C74 VanDerWaalsContact C-SG 3.5Å; C62-C74 HydrophobicContact CB-CB 3.68Å; C62-C74 WeakPolarHBondContact CB-SG 3.37Å; C62-C74 PolarHBondContact O-SG 3.36Å; C62-C74 WeakPolarHBondContact SG-CA 3.01Å; C62-C74 WeakPolarHBondContact SG-CB 2.91Å; C62-C74 CovalentContact SG-SG 2.02Å; C62-C74 PolarHBondContact SG-SG 2.72Å; H65-C74 PolarHBondContact CE1-O 2.78Å; H65-C74 PolarHBondContact ND1-N 3.43Å; H65-C74 VanDerWaalsContact ND1-N 3.13Å; H65-C74 PolarHBondContact ND1-O 2.82Å
75	D	81	Confident	81.3	Confident	53 Å²	53	63.1 Å²	63.1	28%	0.283	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.7	174	-172.2	27.9	0	0	0	110	L73 G77 Y78 I80	L73-D75 PolarHBondContact O-N 2.9Å; D75-G77 PolarHBondContact O-N 3.47Å; D75-G77 VanDerWaalsContact O-N 3.08Å; D75-Y78 PolarHBondContact N-O 2.6Å; D75-Y78 PolarHBondContact O-N 2.78Å; D75-Y78 VanDerWaalsContact O-O 3.05Å; D75-I80 HydrophobicContact CB-CD1 3.38Å; D75-I80 HydrophobicContact CB-CG1 3.81Å
76	H	75	Confident	81	Confident	172 Å²	172	68.7 Å²	68.7	80%	0.796	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	33.8	175.7	-65	23.5	0	0	0	113.8	Y78	H76-Y78 VanDerWaalsContact O-CD2 3.3Å; H76-Y78 WeakPolarHBondContact O-CD2 3.37Å
77	G	80	Confident	81.1	Confident	16 Å²	16	64 Å²	64	17%	0.165	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	5.4	179.9	0	0	0	0	0	114.7	Y61 C62 D75	Y61-G77 CarbonylContact C-O 3.5Å; Y61-G77 VanDerWaalsContact CA-O 3.25Å; Y61-G77 WeakPolarHBondContact CA-O 3.35Å; Y61-G77 VanDerWaalsContact CD2-O 3.24Å; Y61-G77 WeakPolarHBondContact CD2-O 3.44Å; C62-G77 PolarHBondContact N-O 2.9Å; C62-G77 WeakPolarHBondContact O-CA 2.99Å; D75-G77 PolarHBondContact O-N 3.47Å; D75-G77 VanDerWaalsContact O-N 3.08Å
78	Y	79.6	Confident	81.1	Confident	108 Å²	108	66.1 Å²	66.1	42%	0.424	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	141	-179.8	-61.7	-81.9	0	0	0	112	R59 R60 C62 D75 H76 I80	R59-Y78 HydrophobicContact CB-CD1 3.61Å; R59-Y78 HydrophobicContact CB-CE1 4.45Å; R59-Y78 HydrophobicContact CB-CG 4.17Å; R60-Y78 CarbonylContact O-C 3.55Å; R60-Y78 WeakPolarHBondContact O-CA 3.34Å; C62-Y78 PolarHBondContact SG-N 3.19Å; C62-Y78 PolarHBondContact SG-O 3.13Å; D75-Y78 PolarHBondContact N-O 2.6Å; D75-Y78 PolarHBondContact O-N 2.78Å; D75-Y78 VanDerWaalsContact O-O 3.05Å; H76-Y78 VanDerWaalsContact O-CD2 3.3Å; H76-Y78 WeakPolarHBondContact O-CD2 3.37Å; Y78-I80 PolarHBondContact O-N 2.73Å
79	C	82.8	Confident	81.4	Confident	8 Å²	8	65.8 Å²	65.8	5%	0.054	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	124.3	169.3	-60	0	0	0	0	109.6	R60 C68 E72 L73	R60-C79 HydrophobicContact CB-CB 4.07Å; R60-C79 PolarHBondContact O-N 3.19Å; C68-C79 WeakPolarHBondContact CA-SG 3.41Å; C68-C79 HydrophobicContact CB-CB 3.59Å; C68-C79 WeakPolarHBondContact CB-SG 3.29Å; C68-C79 WeakPolarHBondContact SG-CA 3.42Å; C68-C79 WeakPolarHBondContact SG-CB 3.5Å; C68-C79 CovalentContact SG-SG 2.03Å; C68-C79 PolarHBondContact SG-SG 2.9Å; E72-C79 HydrophobicContact CB-CB 4.35Å; E72-C79 WeakPolarHBondContact OE2-CB 3.38Å; L73-C79 WeakPolarHBondContact O-CA 3.47Å
80	I	81	Confident	81.7	Confident	24 Å²	24	65.6 Å²	65.6	12%	0.123	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	147	176.4	62.5	171.3	0	0	0	109.6	E72 L73 D75 Y78 A82 P109	E72-I80 CarbonylContact C-O 3.54Å; E72-I80 WeakPolarHBondContact CA-O 3.39Å; E72-I80 WeakPolarHBondContact CB-O 3.22Å; L73-I80 HydrophobicContact CB-CG1 4.47Å; L73-I80 PolarHBondContact N-O 3.31Å; L73-I80 WeakPolarHBondContact O-CG1 3.39Å; L73-I80 PolarHBondContact O-N 3.15Å; D75-I80 HydrophobicContact CB-CD1 3.38Å; D75-I80 HydrophobicContact CB-CG1 3.81Å; Y78-I80 PolarHBondContact O-N 2.73Å; I80-A82 PolarHBondContact O-N 3.31Å; I80-P109 HydrophobicContact CD1-CB 3.63Å; I80-P109 HydrophobicContact CD1-CG 3.74Å
81	D	83.5	Confident	82.5	Confident	107 Å²	107	63.4 Å²	63.4	57%	0.572	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56	139.5	175.2	-56.4	-31	0	0	0	110.8	P109 S110	D81-P109 CarbonylContact O-C 3.53Å; D81-P109 WeakPolarHBondContact O-CA 2.93Å; D81-S110 PolarHBondContact O-N 3.09Å; D81-S110 PolarHBondContact O-OG 2.79Å
82	A	85.5	Confident	82.7	Confident	2 Å²	2	61.5 Å²	61.5	2%	0.017	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	146	179.4	0	0	0	0	0	111.7	Q71 L73 I80 W107 V108 S110	Q71-A82 PolarHBondContact O-N 2.93Å; Q71-A82 VanDerWaalsContact O-O 3.1Å; L73-A82 HydrophobicContact CB-CB 4.06Å; L73-A82 HydrophobicContact CD1-CB 3.74Å; L73-A82 HydrophobicContact CG-CB 3.53Å; I80-A82 PolarHBondContact O-N 3.31Å; A82-W107 HydrophobicContact CB-CB 4.18Å; A82-W107 HydrophobicContact CB-CE3 3.97Å; A82-W107 WeakPolarHBondContact O-CZ3 3.07Å; A82-V108 CarbonylContact C-O 3.55Å; A82-V108 WeakPolarHBondContact CA-O 3.07Å; A82-V108 WeakPolarHBondContact CB-O 3.17Å; A82-S110 WeakPolarHBondContact CA-OG 3.37Å; A82-S110 PolarHBondContact N-OG 3.49Å; A82-S110 VanDerWaalsContact N-OG 3.1Å
83	E	83.4	Confident	82.8	Confident	90 Å²	90	69 Å²	69	42%	0.421	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140.7	175.7	-75.7	166.6	-161.7	0	0	109.7	W107 V108 S110	E83-W107 WeakPolarHBondContact O-CA 3.35Å; E83-V108 HydrophobicContact CB-CG1 4.49Å; E83-V108 PolarHBondContact N-O 3.17Å; E83-V108 PolarHBondContact O-N 2.91Å; E83-S110 PolarHBondContact N-OG 2.89Å
84	P	84.5	Confident	82.8	Confident	49 Å²	49	72.1 Å²	72.1	32%	0.318	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	140.2	176.7	29.9	-33	0	0	0	110.4	H86 I105 W107	P84-H86 VanDerWaalsContact C-N 3.33Å; P84-I105 HydrophobicContact CB-CG2 3.86Å; P84-W107 HydrophobicContact CB-CD2 4.38Å; P84-W107 HydrophobicContact CB-CE3 4.29Å; P84-W107 HydrophobicContact CB-CH2 4.3Å; P84-W107 HydrophobicContact CB-CZ2 4.4Å; P84-W107 HydrophobicContact CB-CZ3 4.23Å; P84-W107 HydrophobicContact CG-CH2 4.46Å; P84-W107 HydrophobicContact CG-CZ3 4.3Å
85	T	81.1	Confident	82.9	Confident	21 Å²	21	71.8 Å²	71.8	13%	0.129	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	4.7	178	77.8	0	0	0	0	113.4	R87 E99 C106 V108 K118	T85-R87 PolarHBondContact O-N 3.18Å; T85-R87 VanDerWaalsContact O-N 3.14Å; T85-E99 HydrophobicContact CG2-CG 4.15Å; T85-E99 WeakPolarHBondContact CG2-OE1 3.29Å; T85-E99 PolarHBondContact OG1-OE1 3.41Å; T85-C106 WeakPolarHBondContact CG2-O 3.4Å; T85-C106 PolarHBondContact N-O 2.84Å; T85-C106 WeakPolarHBondContact OG1-CB 3.15Å; T85-C106 PolarHBondContact OG1-O 3.34Å; T85-C106 VanDerWaalsContact OG1-O 3.11Å; T85-V108 HydrophobicContact CG2-CB 3.98Å; T85-V108 HydrophobicContact CG2-CG1 3.84Å; T85-K118 PolarHBondContact O-NZ 2.69Å; T85-K118 VanDerWaalsContact O-NZ 3.1Å
86	H	76.5	Confident	83.2	Confident	168 Å²	168	73 Å²	73	78%	0.778	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58.1	14.9	-175.8	-56.9	-88.6	0	0	0	115	P84	P84-H86 VanDerWaalsContact C-N 3.33Å
87	R	82.5	Confident	83.3	Confident	65 Å²	65	70.3 Å²	70.3	25%	0.245	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.6	171.3	-79.9	167	53.3	179.3	7.7	110.4	T85 D94 D96 E99 I105 C106	T85-R87 PolarHBondContact O-N 3.18Å; T85-R87 VanDerWaalsContact O-N 3.14Å; R87-D94 PolarHBondContact NH2-O 3.41Å; R87-D96 IonicContact CZ-OD1 3.41Å; R87-D96 VanDerWaalsContact CZ-OD1 3.3Å; R87-D96 IonicContact CZ-OD2 3.8Å; R87-D96 IonicContact NH1-OD1 3.31Å; R87-D96 PolarHBondContact NH1-OD1 3.26Å; R87-D96 IonicContact NH1-OD2 2.91Å; R87-D96 PolarHBondContact NH1-OD2 3.14Å; R87-D96 IonicContact NH2-OD1 3.56Å; R87-D96 PolarHBondContact NH2-OD1 3.22Å; R87-E99 IonicContact CZ-OE2 3.65Å; R87-E99 VanDerWaalsContact CZ-OE2 3.31Å; R87-E99 IonicContact NE-OE2 3.59Å; R87-E99 IonicContact NH1-OE1 3.5Å; R87-E99 PolarHBondContact NH1-OE1 3.47Å; R87-E99 IonicContact NH1-OE2 3.74Å; R87-E99 PolarHBondContact NH1-OE2 3.21Å; R87-E99 IonicContact NH2-OE2 3.8Å; R87-I105 CarbonylContact O-C 3.54Å; R87-I105 VanDerWaalsContact O-CA 3.26Å; R87-I105 WeakPolarHBondContact O-CA 3.44Å; R87-C106 HydrophobicContact CB-CB 4.14Å; R87-C106 PolarHBondContact O-N 2.76Å
88	I	83.5	Confident	83.2	Confident	120 Å²	120	76.8 Å²	76.8	62%	0.615	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	138.8	176.6	-54.1	173.3	0	0	0	109.2	K104	I88-K104 CarbonylContact C-O 3.54Å; I88-K104 WeakPolarHBondContact CA-O 3.45Å; I88-K104 WeakPolarHBondContact CG2-O 3.44Å
89	C	88.4	Confident	83.5	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.007	39%	0.391	C	S	.	.			trans	-136.2	143.4	177.2	60.2	0	0	0	0	110.6	D94 C95 C101 K104 I105	C89-D94 HydrophobicContact CB-CB 3.69Å; C89-C95 VanDerWaalsContact CB-SG 3.51Å; C89-C95 VanDerWaalsContact SG-SG 3.62Å; C89-C101 HydrophobicContact CB-CB 3.83Å; C89-C101 WeakPolarHBondContact CB-SG 3.2Å; C89-C101 WeakPolarHBondContact SG-CA 3.14Å; C89-C101 WeakPolarHBondContact SG-CB 3.18Å; C89-C101 CovalentContact SG-SG 2.03Å; C89-C101 PolarHBondContact SG-SG 2.75Å; C89-K104 PolarHBondContact N-O 2.94Å; C89-K104 WeakPolarHBondContact O-CA 3.39Å; C89-K104 WeakPolarHBondContact O-CB 3.15Å; C89-I105 PolarHBondContact SG-O 2.79Å
90	S	85.1	Confident	83.7	Confident	110 Å²	110	72.4 Å²	72.4	77%	0.769	39%	0.391	S	S	*	.	S	Bend	trans	-97.5	-26.4	167.3	-62.3	0	0	0	0	111.5	D94	S90-D94 WeakPolarHBondContact CA-OD2 3.41Å; S90-D94 PolarHBondContact N-OD2 2.92Å
91	A	85.8	Confident	84.1	Confident	40 Å²	40	72.5 Å²	72.5	33%	0.331	39%	0.394	S	S	.	.	S	Bend	trans	-143.8	165.3	178.7	0	0	0	0	0	111.4	Q93 D94	A91-Q93 PolarHBondContact O-N 3.17Å; A91-D94 PolarHBondContact N-OD2 3.29Å; A91-D94 WeakPolarHBondContact O-CB 2.98Å; A91-D94 PolarHBondContact O-N 2.67Å
92	Q	83.9	Confident	84.1	Confident	90 Å²	90	68.1 Å²	68.1	42%	0.421	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-53.3	-28.2	175.6	-176.4	58.5	28.1	0	0	113.5	D94 C95 E99 A100	Q92-D94 VanDerWaalsContact C-N 3.26Å; Q92-D94 PolarHBondContact O-N 3.07Å; Q92-C95 PolarHBondContact O-N 3.24Å; Q92-E99 PolarHBondContact NE2-O 3.36Å; Q92-A100 VanDerWaalsContact OE1-CA 3.28Å
93	Q	86.1	Confident	83.8	Confident	179 Å²	179	69.8 Å²	69.8	84%	0.836	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-72.6	-17.6	-178.5	-65.4	157.7	12.3	0	0	113.2	A91 C95	A91-Q93 PolarHBondContact O-N 3.17Å; Q93-C95 VanDerWaalsContact C-N 3.27Å
94	D	85.6	Confident	83.9	Confident	72 Å²	72	70.2 Å²	70.2	39%	0.385	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-82.8	-11.1	177.9	-52.1	-37	0	0	0	111.9	R87 C89 S90 A91 Q92	R87-D94 PolarHBondContact NH2-O 3.41Å; C89-D94 HydrophobicContact CB-CB 3.69Å; S90-D94 WeakPolarHBondContact CA-OD2 3.41Å; S90-D94 PolarHBondContact N-OD2 2.92Å; A91-D94 PolarHBondContact N-OD2 3.29Å; A91-D94 WeakPolarHBondContact O-CB 2.98Å; A91-D94 PolarHBondContact O-N 2.67Å; Q92-D94 VanDerWaalsContact C-N 3.26Å; Q92-D94 PolarHBondContact O-N 3.07Å
95	C	86.8	Confident	83.9	Confident	12 Å²	12	69.3 Å²	69.3	8%	0.081	38%	0.379	C	S	.	.	S	Bend	trans	-100.5	155.7	178	-58.5	0	0	0	0	111.3	C89 Q92 Q93 E99 C106	C89-C95 VanDerWaalsContact CB-SG 3.51Å; C89-C95 VanDerWaalsContact SG-SG 3.62Å; Q92-C95 PolarHBondContact O-N 3.24Å; Q93-C95 VanDerWaalsContact C-N 3.27Å; C95-E99 HydrophobicContact CB-CB 3.71Å; C95-C106 WeakPolarHBondContact CA-SG 3.37Å; C95-C106 HydrophobicContact CB-CB 3.8Å; C95-C106 WeakPolarHBondContact CB-SG 3.23Å; C95-C106 WeakPolarHBondContact SG-CA 3.31Å; C95-C106 WeakPolarHBondContact SG-CB 3.35Å; C95-C106 CovalentContact SG-SG 2.04Å; C95-C106 PolarHBondContact SG-SG 3.42Å
96	D	86.6	Confident	84.2	Confident	80 Å²	80	68.3 Å²	68.3	43%	0.428	37%	0.373	S	S	.	.			trans	-65.9	160	176.4	-65.6	-12	0	0	0	111	R87 K98 E99	R87-D96 IonicContact CZ-OD1 3.41Å; R87-D96 VanDerWaalsContact CZ-OD1 3.3Å; R87-D96 IonicContact CZ-OD2 3.8Å; R87-D96 IonicContact NH1-OD1 3.31Å; R87-D96 PolarHBondContact NH1-OD1 3.26Å; R87-D96 IonicContact NH1-OD2 2.91Å; R87-D96 PolarHBondContact NH1-OD2 3.14Å; R87-D96 IonicContact NH2-OD1 3.56Å; R87-D96 PolarHBondContact NH2-OD1 3.22Å; D96-K98 PolarHBondContact O-N 2.76Å; D96-E99 HydrophobicContact CB-CG 4.07Å; D96-E99 PolarHBondContact N-OE2 3.41Å; D96-E99 WeakPolarHBondContact O-CB 3.47Å; D96-E99 PolarHBondContact O-N 3.41Å
97	A	77.9	Confident	84.8	Confident	114 Å²	114	61.6 Å²	61.6	94%	0.942	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-9.3	-176.8	0	0	0	0	0	115.7
98	K	76.6	Confident	85.1	Confident	152 Å²	152	60.5 Å²	60.5	66%	0.661	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	1.2	178.8	-66.5	-178.8	177.3	179.7	0	113.4	D96	D96-K98 PolarHBondContact O-N 2.76Å
99	E	87.7	Confident	85	Confident	18 Å²	18	55.2 Å²	55.2	8%	0.084	32%	0.315	C	S	.	.			trans	-106.8	165.7	-179.2	-65.8	175.3	164.2	0	0	109.4	T85 R87 Q92 C95 D96 C106 W107	T85-E99 HydrophobicContact CG2-CG 4.15Å; T85-E99 WeakPolarHBondContact CG2-OE1 3.29Å; T85-E99 PolarHBondContact OG1-OE1 3.41Å; R87-E99 IonicContact CZ-OE2 3.65Å; R87-E99 VanDerWaalsContact CZ-OE2 3.31Å; R87-E99 IonicContact NE-OE2 3.59Å; R87-E99 IonicContact NH1-OE1 3.5Å; R87-E99 PolarHBondContact NH1-OE1 3.47Å; R87-E99 IonicContact NH1-OE2 3.74Å; R87-E99 PolarHBondContact NH1-OE2 3.21Å; R87-E99 IonicContact NH2-OE2 3.8Å; Q92-E99 PolarHBondContact NE2-O 3.36Å; C95-E99 HydrophobicContact CB-CB 3.71Å; D96-E99 HydrophobicContact CB-CG 4.07Å; D96-E99 PolarHBondContact N-OE2 3.41Å; D96-E99 WeakPolarHBondContact O-CB 3.47Å; D96-E99 PolarHBondContact O-N 3.41Å; E99-C106 HydrophobicContact CB-CB 4.22Å; E99-C106 WeakPolarHBondContact OE2-CB 3.46Å; E99-W107 CarbonylContact C-O 3.42Å; E99-W107 WeakPolarHBondContact CA-O 3.01Å; E99-W107 WeakPolarHBondContact CB-O 3.1Å
100	A	86.9	Confident	84.3	Confident	6 Å²	6	56.5 Å²	56.5	5%	0.05	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136	172.7	0	0	0	0	0	111.5	H65 L73 Q92 R102 W107	H65-A100 WeakPolarHBondContact NE2-CB 3.37Å; L73-A100 HydrophobicContact CD1-CB 3.84Å; L73-A100 HydrophobicContact CD2-CB 3.51Å; L73-A100 HydrophobicContact CG-CB 4.28Å; Q92-A100 VanDerWaalsContact OE1-CA 3.28Å; A100-R102 PolarHBondContact O-N 3.1Å; A100-W107 PolarHBondContact N-O 3.01Å; A100-W107 PolarHBondContact O-N 3.15Å
101	C	87.9	Confident	83	Confident	27 Å²	27	56 Å²	56	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	112.7	178.6	-172.6	0	0	0	0	109.8	C89	C89-C101 HydrophobicContact CB-CB 3.83Å; C89-C101 WeakPolarHBondContact CB-SG 3.2Å; C89-C101 WeakPolarHBondContact SG-CA 3.14Å; C89-C101 WeakPolarHBondContact SG-CB 3.18Å; C89-C101 CovalentContact SG-SG 2.03Å; C89-C101 PolarHBondContact SG-SG 2.75Å
102	R	84.4	Confident	81.4	Confident	15 Å²	15	60 Å²	60	6%	0.057	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	128.6	178.9	-179.5	-164.1	178.3	112.8	20.7	109.7	H65 C68 Q69 E72 L73 A100 K104 I105 W107	H65-R102 HydrophobicContact CB-CB 4.5Å; H65-R102 HydrophobicContact CB-CG 4.32Å; H65-R102 VanDerWaalsContact O-CZ 3.25Å; H65-R102 PolarHBondContact O-NH1 2.82Å; H65-R102 PolarHBondContact O-NH2 3Å; C68-R102 PolarHBondContact O-NH2 3.37Å; Q69-R102 PolarHBondContact O-NH2 2.86Å; E72-R102 WeakPolarHBondContact O-CD 3.26Å; E72-R102 PolarHBondContact O-NH1 2.81Å; L73-R102 HydrophobicContact CD2-CB 4.24Å; A100-R102 PolarHBondContact O-N 3.1Å; R102-K104 PolarHBondContact O-N 3.41Å; R102-I105 PolarHBondContact N-O 3.38Å; R102-I105 PolarHBondContact O-N 3.28Å; R102-I105 VanDerWaalsContact O-N 3.14Å; R102-W107 HydrophobicContact CB-CG 4.38Å; R102-W107 VanDerWaalsContact O-CD1 3.32Å; R102-W107 PolarHBondContact O-NE1 3.04Å
103	G	79.7	Confident	79.2	Confident	37 Å²	37	64 Å²	64	38%	0.381	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	35.3	-177	0	0	0	0	0	112.2	I105	G103-I105 PolarHBondContact O-N 3.32Å
104	K	85.2	Confident	76.8	Confident	99 Å²	99	63 Å²	63	43%	0.43	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	16.6	-176.1	-59.5	-153.6	-130.1	166.1	0	116.1	I88 C89 R102 E361	I88-K104 CarbonylContact C-O 3.54Å; I88-K104 WeakPolarHBondContact CA-O 3.45Å; I88-K104 WeakPolarHBondContact CG2-O 3.44Å; C89-K104 PolarHBondContact N-O 2.94Å; C89-K104 WeakPolarHBondContact O-CA 3.39Å; C89-K104 WeakPolarHBondContact O-CB 3.15Å; R102-K104 PolarHBondContact O-N 3.41Å; K104-E361 VanDerWaalsContact CB-CD 3.49Å; K104-E361 HydrophobicContact CB-CG 4.06Å; K104-E361 WeakPolarHBondContact CB-OE1 3.38Å; K104-E361 HydrophobicContact CD-CG 4.01Å; K104-E361 WeakPolarHBondContact CD-OE1 3.08Å; K104-E361 WeakPolarHBondContact CD-OE2 3.34Å; K104-E361 WeakPolarHBondContact CE-OE2 3.47Å; K104-E361 HydrophobicContact CG-CG 4.13Å; K104-E361 IonicContact NZ-OE2 2.82Å; K104-E361 PolarHBondContact NZ-OE2 2.84Å
105	I	83.5	Confident	74.4	Confident	30 Å²	30	66.1 Å²	66.1	15%	0.154	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	143.4	170.8	-60.5	168.6	0	0	0	107.3	P84 R87 C89 R102 G103 W107 I377	P84-I105 HydrophobicContact CB-CG2 3.86Å; R87-I105 CarbonylContact O-C 3.54Å; R87-I105 VanDerWaalsContact O-CA 3.26Å; R87-I105 WeakPolarHBondContact O-CA 3.44Å; C89-I105 PolarHBondContact SG-O 2.79Å; R102-I105 PolarHBondContact N-O 3.38Å; R102-I105 PolarHBondContact O-N 3.28Å; R102-I105 VanDerWaalsContact O-N 3.14Å; G103-I105 PolarHBondContact O-N 3.32Å; I105-W107 PolarHBondContact O-NE1 2.92Å; I105-I377 HydrophobicContact CD1-CD1 3.93Å
106	C	88.7	Confident	71.9	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	130.3	169.2	-62.9	0	0	0	0	109.2	T85 R87 C95 E99	T85-C106 WeakPolarHBondContact CG2-O 3.4Å; T85-C106 PolarHBondContact N-O 2.84Å; T85-C106 WeakPolarHBondContact OG1-CB 3.15Å; T85-C106 PolarHBondContact OG1-O 3.34Å; T85-C106 VanDerWaalsContact OG1-O 3.11Å; R87-C106 HydrophobicContact CB-CB 4.14Å; R87-C106 PolarHBondContact O-N 2.76Å; C95-C106 WeakPolarHBondContact CA-SG 3.37Å; C95-C106 HydrophobicContact CB-CB 3.8Å; C95-C106 WeakPolarHBondContact CB-SG 3.23Å; C95-C106 WeakPolarHBondContact SG-CA 3.31Å; C95-C106 WeakPolarHBondContact SG-CB 3.35Å; C95-C106 CovalentContact SG-SG 2.04Å; C95-C106 PolarHBondContact SG-SG 3.42Å; E99-C106 HydrophobicContact CB-CB 4.22Å; E99-C106 WeakPolarHBondContact OE2-CB 3.46Å
107	W	88.9	Confident	69.8	Low	27 Å²	27	69.3 Å²	69.3	10%	0.102	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.2	179.9	-67.5	75.4	0	0	0	110.4	Q71 L73 A82 E83 P84 E99 A100 R102 I105	Q71-W107 VanDerWaalsContact CA-CZ3 3.49Å; Q71-W107 HydrophobicContact CB-CH2 4.43Å; Q71-W107 HydrophobicContact CB-CZ3 4.01Å; Q71-W107 HydrophobicContact CG-CH2 4.03Å; Q71-W107 HydrophobicContact CG-CZ3 3.99Å; L73-W107 HydrophobicContact CD1-CB 3.67Å; L73-W107 HydrophobicContact CD2-CB 3.89Å; L73-W107 HydrophobicContact CD2-CG 4.44Å; L73-W107 HydrophobicContact CG-CB 3.85Å; A82-W107 HydrophobicContact CB-CB 4.18Å; A82-W107 HydrophobicContact CB-CE3 3.97Å; A82-W107 WeakPolarHBondContact O-CZ3 3.07Å; E83-W107 WeakPolarHBondContact O-CA 3.35Å; P84-W107 HydrophobicContact CB-CD2 4.38Å; P84-W107 HydrophobicContact CB-CE3 4.29Å; P84-W107 HydrophobicContact CB-CH2 4.3Å; P84-W107 HydrophobicContact CB-CZ2 4.4Å; P84-W107 HydrophobicContact CB-CZ3 4.23Å; P84-W107 HydrophobicContact CG-CH2 4.46Å; P84-W107 HydrophobicContact CG-CZ3 4.3Å; E99-W107 CarbonylContact C-O 3.42Å; E99-W107 WeakPolarHBondContact CA-O 3.01Å; E99-W107 WeakPolarHBondContact CB-O 3.1Å; A100-W107 PolarHBondContact N-O 3.01Å; A100-W107 PolarHBondContact O-N 3.15Å; R102-W107 HydrophobicContact CB-CG 4.38Å; R102-W107 VanDerWaalsContact O-CD1 3.32Å; R102-W107 PolarHBondContact O-NE1 3.04Å; I105-W107 PolarHBondContact O-NE1 2.92Å
108	V	87.4	Confident	68.4	Low	42 Å²	42	68.4 Å²	68.4	26%	0.255	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	139.6	174.9	65.1	0	0	0	0	109.6	A82 E83 T85 S110	A82-V108 CarbonylContact C-O 3.55Å; A82-V108 WeakPolarHBondContact CA-O 3.07Å; A82-V108 WeakPolarHBondContact CB-O 3.17Å; E83-V108 HydrophobicContact CB-CG1 4.49Å; E83-V108 PolarHBondContact N-O 3.17Å; E83-V108 PolarHBondContact O-N 2.91Å; T85-V108 HydrophobicContact CG2-CB 3.98Å; T85-V108 HydrophobicContact CG2-CG1 3.84Å; V108-S110 PolarHBondContact O-N 2.91Å
109	P	82.9	Confident	67.7	Low	9 Å²	9	65.7 Å²	65.7	6%	0.058	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	124.9	175.2	-30.6	38.3	0	0	0	113.4	L73 I80 D81 S111 R112	L73-P109 HydrophobicContact CD1-CG 4.43Å; I80-P109 HydrophobicContact CD1-CB 3.63Å; I80-P109 HydrophobicContact CD1-CG 3.74Å; D81-P109 CarbonylContact O-C 3.53Å; D81-P109 WeakPolarHBondContact O-CA 2.93Å; P109-S111 PolarHBondContact O-N 3.15Å; P109-R112 HydrophobicContact CB-CG 4.46Å; P109-R112 PolarHBondContact O-N 3.47Å
110	S	73.3	Confident	67.1	Low	27 Å²	27	65 Å²	65	19%	0.189	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-62.5	-27.8	-179.6	-48.1	0	0	0	0	112	D81 A82 E83 V108 R112 K113	D81-S110 PolarHBondContact O-N 3.09Å; D81-S110 PolarHBondContact O-OG 2.79Å; A82-S110 WeakPolarHBondContact CA-OG 3.37Å; A82-S110 PolarHBondContact N-OG 3.49Å; A82-S110 VanDerWaalsContact N-OG 3.1Å; E83-S110 PolarHBondContact N-OG 2.89Å; V108-S110 PolarHBondContact O-N 2.91Å; S110-R112 PolarHBondContact O-N 2.97Å; S110-R112 VanDerWaalsContact O-N 3.15Å; S110-K113 PolarHBondContact O-N 3.34Å
111	S	58.2	Low	66.6	Low	100 Å²	100	69.7 Å²	69.7	70%	0.699	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-68.2	-5.5	175.3	52.5	0	0	0	0	114	P109 K113	P109-S111 PolarHBondContact O-N 3.15Å; S111-K113 VanDerWaalsContact C-N 3.34Å; S111-K113 PolarHBondContact O-N 3.12Å
112	R	52.2	Low	66	Low	124 Å²	124	70 Å²	70	47%	0.468	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-94.5	42.1	169.1	-68.8	-174.4	-170.2	-178.1	5	112.9	P109 S110 Q114	P109-R112 HydrophobicContact CB-CG 4.46Å; P109-R112 PolarHBondContact O-N 3.47Å; S110-R112 PolarHBondContact O-N 2.97Å; S110-R112 VanDerWaalsContact O-N 3.15Å; R112-Q114 PolarHBondContact O-N 3.45Å
113	K	36.6	Very low	65.5	Low	173 Å²	173	71.8 Å²	71.8	75%	0.752	40%	0.396	S	S	*	.			trans	-66.6	65.6	158.4	-81	-174.9	-179.5	173	0	111.2	S110 S111	S110-K113 PolarHBondContact O-N 3.34Å; S111-K113 VanDerWaalsContact C-N 3.34Å; S111-K113 PolarHBondContact O-N 3.12Å
114	Q	36.7	Very low	65.4	Low	160 Å²	160	79.3 Å²	79.3	75%	0.748	41%	0.413	S	S	*	.	S	Bend		-90.9	128.1	127.6	-75.9	-175.9	-6.3	0	0	105.1	R112 T116	R112-Q114 PolarHBondContact O-N 3.45Å; Q114-T116 HydrophobicContact CB-CG2 4.38Å; Q114-T116 PolarHBondContact O-N 3.42Å
115	V	33.6	Very low	65	Low	137 Å²	137	78.2 Å²	78.2	83%	0.83	41%	0.411	S	S	*	.			trans	-58.5	81.6	170.4	179.6	0	0	0	0	108.3	V117	V115-V117 HydrophobicContact CG1-CG2 4.12Å; V115-V117 PolarHBondContact O-N 3.35Å
116	T	36	Very low	64.6	Low	110 Å²	110	77.5 Å²	77.5	68%	0.675	41%	0.409	S	S	*	.			trans	-91.2	87.4	169.4	54.6	0	0	0	0	105.8	Q114 K118	Q114-T116 HydrophobicContact CB-CG2 4.38Å; Q114-T116 PolarHBondContact O-N 3.42Å; T116-K118 PolarHBondContact O-N 3.2Å; T116-K118 VanDerWaalsContact O-N 3.12Å
117	V	42.2	Very low	64	Low	49 Å²	49	83.4 Å²	83.4	30%	0.297	45%	0.445	S	S	.	.			trans	-47.7	122.1	163.9	-171.6	0	0	0	0	107.2	V115 S119 R136	V115-V117 HydrophobicContact CG1-CG2 4.12Å; V115-V117 PolarHBondContact O-N 3.35Å; V117-S119 PolarHBondContact O-N 2.01Å; V117-S119 PolarHBondContact O-OG 3.02Å; V117-R136 HydrophobicContact CB-CG 3.94Å; V117-R136 HydrophobicContact CG1-CB 3.7Å; V117-R136 HydrophobicContact CG1-CG 3.41Å; V117-R136 VanDerWaalsContact CG1-CG 3.41Å
118	K	48.8	Very low	63.1	Low	94 Å²	94	85.6 Å²	85.6	41%	0.409	48%	0.476	S	S	.	.			trans	-47.2	113.1	-179.2	-128.9	176.9	-171.4	167.8	0	107.9	T85 T116 C120	T85-K118 PolarHBondContact O-NZ 2.69Å; T85-K118 VanDerWaalsContact O-NZ 3.1Å; T116-K118 PolarHBondContact O-N 3.2Å; T116-K118 VanDerWaalsContact O-N 3.12Å; K118-C120 PolarHBondContact O-N 2.86Å
119	S	60.4	Low	62.4	Low	96 Å²	96	88.8 Å²	88.8	67%	0.671	49%	0.491	S	S	*	.			trans	-78.5	107.9	-174	-61.7	0	0	0	0	108.4	V117 S135	V117-S119 PolarHBondContact O-N 2.01Å; V117-S119 PolarHBondContact O-OG 3.02Å; S119-S135 VanDerWaalsContact CA-O 3.25Å; S119-S135 WeakPolarHBondContact CA-O 2.9Å
120	C	76.8	Confident	61.9	Low	3 Å²	3	89.6 Å²	89.6	2%	0.02	50%	0.497	C	S	.	.			trans	-83.9	150.8	172	64.1	0	0	0	0	110	K118 D125 C132 S135 R136	K118-C120 PolarHBondContact O-N 2.86Å; C120-D125 HydrophobicContact CB-CB 3.78Å; C120-C132 VanDerWaalsContact CA-SG 3.58Å; C120-C132 HydrophobicContact CB-CB 3.6Å; C120-C132 WeakPolarHBondContact CB-SG 3.31Å; C120-C132 PolarHBondContact O-SG 3.39Å; C120-C132 WeakPolarHBondContact SG-CA 3.48Å; C120-C132 WeakPolarHBondContact SG-CB 2.92Å; C120-C132 CovalentContact SG-SG 2.01Å; C120-C132 PolarHBondContact SG-SG 2.72Å; C120-S135 VanDerWaalsContact O-CA 3.23Å; C120-S135 WeakPolarHBondContact O-CA 3.44Å; C120-S135 WeakPolarHBondContact O-CB 3.25Å; C120-S135 PolarHBondContact O-OG 2.71Å; C120-S135 VanDerWaalsContact SG-C 3.55Å; C120-R136 PolarHBondContact SG-N 2.67Å; C120-R136 PolarHBondContact SG-O 3.05Å
121	S	75.1	Confident	62.1	Low	105 Å²	105	88.3 Å²	88.3	73%	0.734	49%	0.488	S	S	*	.	S	Bend	trans	-107.7	-24.9	170.1	65.1	0	0	0	0	111.7	D125	S121-D125 WeakPolarHBondContact CA-OD2 3.44Å; S121-D125 WeakPolarHBondContact CB-OD2 3.31Å; S121-D125 PolarHBondContact N-OD2 3.33Å; S121-D125 PolarHBondContact OG-OD2 2.8Å
122	S	76.6	Confident	62.9	Low	32 Å²	32	84.4 Å²	84.4	22%	0.224	46%	0.461	C	S	.	.	S	Bend	trans	-152.6	167.7	172.4	71.5	0	0	0	0	110.7	R124 D125 C132	S122-R124 PolarHBondContact O-N 3.38Å; S122-R124 WeakPolarHBondContact OG-CB 2.87Å; S122-R124 PolarHBondContact OG-N 2.99Å; S122-D125 PolarHBondContact N-OD2 3.12Å; S122-D125 WeakPolarHBondContact O-CB 3.32Å; S122-D125 PolarHBondContact O-N 2.7Å; S122-C132 WeakPolarHBondContact O-CB 3.41Å
123	Y	73	Confident	63.6	Low	54 Å²	54	79.8 Å²	79.8	21%	0.212	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-51.2	-23.3	172.9	73.7	-92.3	0	0	0	114.3	D125 C126 E158 C159 V160	Y123-D125 PolarHBondContact O-N 2.9Å; Y123-C126 WeakPolarHBondContact O-CB 3.07Å; Y123-C126 PolarHBondContact O-N 3.27Å; Y123-C126 VanDerWaalsContact O-N 3.07Å; Y123-E158 PolarHBondContact N-OE1 3.04Å; Y123-C159 WeakPolarHBondContact CD1-O 3.26Å; Y123-C159 VanDerWaalsContact CE1-O 3.29Å; Y123-C159 WeakPolarHBondContact CE1-O 3.1Å; Y123-V160 HydrophobicContact CD1-CG2 4.04Å; Y123-V160 HydrophobicContact CD2-CB 4.28Å; Y123-V160 HydrophobicContact CD2-CG1 3.64Å; Y123-V160 HydrophobicContact CD2-CG2 4.16Å; Y123-V160 HydrophobicContact CE2-CG1 4.05Å; Y123-V160 HydrophobicContact CG-CB 4.21Å; Y123-V160 HydrophobicContact CG-CG1 4.04Å; Y123-V160 HydrophobicContact CG-CG2 3.65Å
124	R	77	Confident	65	Low	195 Å²	195	79.3 Å²	79.3	74%	0.736	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-68	-20.3	179.2	-60.3	-176.2	178.4	-158.3	1.7	113	S122 C126	S122-R124 PolarHBondContact O-N 3.38Å; S122-R124 WeakPolarHBondContact OG-CB 2.87Å; S122-R124 PolarHBondContact OG-N 2.99Å; R124-C126 PolarHBondContact O-N 2.77Å
125	D	77.7	Confident	66.6	Low	75 Å²	75	74.7 Å²	74.7	40%	0.401	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-83.5	-1.5	176.5	-51.3	-41.6	0	0	0	111.7	C120 S121 S122 Y123 C137	C120-D125 HydrophobicContact CB-CB 3.78Å; S121-D125 WeakPolarHBondContact CA-OD2 3.44Å; S121-D125 WeakPolarHBondContact CB-OD2 3.31Å; S121-D125 PolarHBondContact N-OD2 3.33Å; S121-D125 PolarHBondContact OG-OD2 2.8Å; S122-D125 PolarHBondContact N-OD2 3.12Å; S122-D125 WeakPolarHBondContact O-CB 3.32Å; S122-D125 PolarHBondContact O-N 2.7Å; Y123-D125 PolarHBondContact O-N 2.9Å; D125-C137 PolarHBondContact O-SG 3.07Å
126	C	75.5	Confident	68.3	Low	15 Å²	15	74 Å²	74	10%	0.101	41%	0.407	C	S	.	.	S	Bend	trans	-112.6	138.1	-176.7	-56.1	0	0	0	0	111.1	Y123 R124 C137	Y123-C126 WeakPolarHBondContact O-CB 3.07Å; Y123-C126 PolarHBondContact O-N 3.27Å; Y123-C126 VanDerWaalsContact O-N 3.07Å; R124-C126 PolarHBondContact O-N 2.77Å; C126-C137 WeakPolarHBondContact CA-SG 3.48Å; C126-C137 HydrophobicContact CB-CB 3.66Å; C126-C137 WeakPolarHBondContact CB-SG 3.34Å; C126-C137 WeakPolarHBondContact SG-CA 3.22Å; C126-C137 WeakPolarHBondContact SG-CB 3.3Å; C126-C137 CovalentContact SG-SG 2.04Å; C126-C137 PolarHBondContact SG-SG 2.65Å
127	T	74.9	Confident	70.2	Confident	125 Å²	125	71 Å²	71	77%	0.767	39%	0.389	S	S	*	.			trans	-90.1	142.5	-180	51	0	0	0	0	111.5	S130	T127-S130 WeakPolarHBondContact O-CB 3.25Å; T127-S130 PolarHBondContact O-OG 3.45Å
128	G	70.8	Confident	71.6	Confident	72 Å²	72	69 Å²	69	74%	0.742	38%	0.377	S	S	*	.	S	Bend	trans	69.1	-140.9	177.2	0	0	0	0	0	113.3	S130	G128-S130 PolarHBondContact O-N 2Å
129	N	71.5	Confident	72.9	Confident	109 Å²	109	70 Å²	70	58%	0.583	38%	0.383	S	S	*	.	S	Bend	trans	-83.2	41.1	-178.3	-69.3	-14	0	0	0	112.3	G140 W165	N129-G140 PolarHBondContact O-N 3.25Å; N129-W165 HydrophobicContact CB-CH2 4.24Å; N129-W165 HydrophobicContact CB-CZ3 3.9Å
130	S	72.7	Confident	73.6	Confident	27 Å²	27	65.7 Å²	65.7	19%	0.189	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141.3	-173.5	-60	0	0	0	0	111	T127 G128 V138	T127-S130 WeakPolarHBondContact O-CB 3.25Å; T127-S130 PolarHBondContact O-OG 3.45Å; G128-S130 PolarHBondContact O-N 2Å; S130-V138 CarbonylContact C-O 3.54Å; S130-V138 VanDerWaalsContact CA-O 3.26Å; S130-V138 WeakPolarHBondContact CA-O 3.42Å
131	I	77.8	Confident	73.8	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	155.4	173.4	66.2	170.2	0	0	0	110.7	L133 C137 V138 E158 V160 W165	I131-L133 HydrophobicContact CD1-CD1 4.45Å; I131-L133 PolarHBondContact O-N 3.12Å; I131-C137 WeakPolarHBondContact O-CA 3.3Å; I131-V138 HydrophobicContact CD1-CG2 4.27Å; I131-V138 HydrophobicContact CG1-CG2 3.55Å; I131-V138 PolarHBondContact N-O 3.48Å; I131-V138 PolarHBondContact O-N 2.91Å; I131-E158 HydrophobicContact CB-CB 4.45Å; I131-V160 HydrophobicContact CG2-CG2 3.92Å; I131-W165 HydrophobicContact CG2-CB 3.46Å; I131-W165 VanDerWaalsContact CG2-CB 3.46Å; I131-W165 HydrophobicContact CG2-CG 4.29Å
132	C	74.9	Confident	74.1	Confident	17 Å²	17	65.4 Å²	65.4	12%	0.115	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	97.6	176.4	179.9	0	0	0	0	111.5	C120 S122 E158	C120-C132 VanDerWaalsContact CA-SG 3.58Å; C120-C132 HydrophobicContact CB-CB 3.6Å; C120-C132 WeakPolarHBondContact CB-SG 3.31Å; C120-C132 PolarHBondContact O-SG 3.39Å; C120-C132 WeakPolarHBondContact SG-CA 3.48Å; C120-C132 WeakPolarHBondContact SG-CB 2.92Å; C120-C132 CovalentContact SG-SG 2.01Å; C120-C132 PolarHBondContact SG-SG 2.72Å; S122-C132 WeakPolarHBondContact O-CB 3.41Å; C132-E158 WeakPolarHBondContact CA-OE2 3.15Å; C132-E158 WeakPolarHBondContact CB-OE2 3.43Å; C132-E158 PolarHBondContact N-OE2 3.18Å
133	L	66.2	Low	74.3	Confident	27 Å²	27	66.3 Å²	66.3	14%	0.141	36%	0.357	C	S	.	.			trans	-112.5	118	180	-157.5	81.6	0	0	0	110.8	I131 S135 R136 V138 I170	I131-L133 HydrophobicContact CD1-CD1 4.45Å; I131-L133 PolarHBondContact O-N 3.12Å; L133-S135 VanDerWaalsContact C-N 3.3Å; L133-S135 PolarHBondContact O-N 2.87Å; L133-R136 PolarHBondContact N-O 2.79Å; L133-R136 WeakPolarHBondContact O-CB 3.49Å; L133-R136 PolarHBondContact O-N 3.44Å; L133-V138 HydrophobicContact CB-CG2 3.61Å; L133-V138 HydrophobicContact CD2-CG2 4.49Å; L133-I170 HydrophobicContact CD2-CB 3.93Å; L133-I170 HydrophobicContact CD2-CG2 4.28Å
134	R	66.5	Low	74.6	Confident	164 Å²	164	67.2 Å²	67.2	62%	0.619	38%	0.383	S	S	*	.	S	Bend	trans	52.7	46	179.1	-59.8	179.5	178.2	161.1	1.9	112.9	R136	R134-R136 VanDerWaalsContact C-N 3.27Å; R134-R136 PolarHBondContact O-N 2.59Å
135	S	69.6	Low	75	Confident	62 Å²	62	63.1 Å²	63.1	43%	0.434	37%	0.367	S	S	.	.	S	Bend	trans	57.9	39.7	-176.3	-54.1	0	0	0	0	113.1	S119 C120 L133	S119-S135 VanDerWaalsContact CA-O 3.25Å; S119-S135 WeakPolarHBondContact CA-O 2.9Å; C120-S135 VanDerWaalsContact O-CA 3.23Å; C120-S135 WeakPolarHBondContact O-CA 3.44Å; C120-S135 WeakPolarHBondContact O-CB 3.25Å; C120-S135 PolarHBondContact O-OG 2.71Å; C120-S135 VanDerWaalsContact SG-C 3.55Å; L133-S135 VanDerWaalsContact C-N 3.3Å; L133-S135 PolarHBondContact O-N 2.87Å
136	R	69.6	Low	75.6	Confident	124 Å²	124	70.1 Å²	70.1	47%	0.468	39%	0.388	S	S	.	.	S	Bend	trans	-142.7	132.5	171.6	-57.9	-175	170.4	-169.4	-1.1	109.3	V117 C120 L133 R134 V138	V117-R136 HydrophobicContact CB-CG 3.94Å; V117-R136 HydrophobicContact CG1-CB 3.7Å; V117-R136 HydrophobicContact CG1-CG 3.41Å; V117-R136 VanDerWaalsContact CG1-CG 3.41Å; C120-R136 PolarHBondContact SG-N 2.67Å; C120-R136 PolarHBondContact SG-O 3.05Å; L133-R136 PolarHBondContact N-O 2.79Å; L133-R136 WeakPolarHBondContact O-CB 3.49Å; L133-R136 PolarHBondContact O-N 3.44Å; R134-R136 VanDerWaalsContact C-N 3.27Å; R134-R136 PolarHBondContact O-N 2.59Å; R136-V138 HydrophobicContact CB-CG1 4.45Å; R136-V138 PolarHBondContact O-N 2.78Å
137	C	75.8	Confident	76.2	Confident	45 Å²	45	70 Å²	70	30%	0.304	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	121	169.7	-65.6	0	0	0	0	109.5	D125 C126 I131	D125-C137 PolarHBondContact O-SG 3.07Å; C126-C137 WeakPolarHBondContact CA-SG 3.48Å; C126-C137 HydrophobicContact CB-CB 3.66Å; C126-C137 WeakPolarHBondContact CB-SG 3.34Å; C126-C137 WeakPolarHBondContact SG-CA 3.22Å; C126-C137 WeakPolarHBondContact SG-CB 3.3Å; C126-C137 CovalentContact SG-SG 2.04Å; C126-C137 PolarHBondContact SG-SG 2.65Å; I131-C137 WeakPolarHBondContact O-CA 3.3Å
138	V	72.3	Confident	76.7	Confident	9 Å²	9	71 Å²	71	6%	0.055	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	141.4	179.3	-64.2	0	0	0	0	108.7	S130 I131 L133 R136 G140 S167 I170	S130-V138 CarbonylContact C-O 3.54Å; S130-V138 VanDerWaalsContact CA-O 3.26Å; S130-V138 WeakPolarHBondContact CA-O 3.42Å; I131-V138 HydrophobicContact CD1-CG2 4.27Å; I131-V138 HydrophobicContact CG1-CG2 3.55Å; I131-V138 PolarHBondContact N-O 3.48Å; I131-V138 PolarHBondContact O-N 2.91Å; L133-V138 HydrophobicContact CB-CG2 3.61Å; L133-V138 HydrophobicContact CD2-CG2 4.49Å; R136-V138 HydrophobicContact CB-CG1 4.45Å; R136-V138 PolarHBondContact O-N 2.78Å; V138-G140 PolarHBondContact O-N 3.14Å; V138-S167 WeakPolarHBondContact CG2-OG 3.47Å; V138-I170 HydrophobicContact CG1-CD1 3.53Å; V138-I170 HydrophobicContact CG1-CG1 3.97Å
139	Q	76.3	Confident	77.4	Confident	115 Å²	115	71.5 Å²	71.5	54%	0.537	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	134	176.8	-157.4	-179.3	36.4	0	0	109.3	S167 K168	Q139-S167 CarbonylContact O-C 3.47Å; Q139-K168 HydrophobicContact CB-CB 4.45Å; Q139-K168 HydrophobicContact CG-CD 4.41Å; Q139-K168 PolarHBondContact O-N 2.02Å
140	G	74.9	Confident	77.7	Confident	5 Å²	5	70.5 Å²	70.5	5%	0.052	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	166	-177.7	0	0	0	0	0	112.8	N129 V138 W165 R166	N129-G140 PolarHBondContact O-N 3.25Å; V138-G140 PolarHBondContact O-N 3.14Å; G140-W165 WeakPolarHBondContact O-CZ3 3.36Å; G140-R166 CarbonylContact C-O 3.58Å; G140-R166 WeakPolarHBondContact CA-O 3.37Å
141	E	81.6	Confident	78.1	Confident	57 Å²	57	75.5 Å²	75.5	27%	0.266	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	143.5	169.2	64.2	-178.2	-177.3	0	0	111.3	W165 R166 K168	E141-W165 CarbonylContact O-C 3.59Å; E141-W165 VanDerWaalsContact O-CA 3.27Å; E141-W165 WeakPolarHBondContact O-CA 3.06Å; E141-R166 HydrophobicContact CG-CG 3.68Å; E141-R166 PolarHBondContact N-O 3.05Å; E141-R166 PolarHBondContact O-N 3.02Å; E141-R166 IonicContact OE1-CZ 3.51Å; E141-R166 IonicContact OE1-NE 3.56Å; E141-R166 PolarHBondContact OE1-NE 2.67Å; E141-R166 IonicContact OE1-NH2 2.78Å; E141-R166 PolarHBondContact OE1-NH2 3.4Å; E141-K168 HydrophobicContact CB-CG 4.42Å; E141-K168 HydrophobicContact CG-CG 4.38Å
142	G	81.4	Confident	78.2	Confident	45 Å²	45	77.1 Å²	77.1	46%	0.464	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	133.1	178.8	0	0	0	0	0	112
143	T	79.7	Confident	78.4	Confident	50 Å²	50	77 Å²	77	31%	0.307	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-6.9	179.7	63.1	0	0	0	0	113.6	R145 E157 C164 R166	T143-R145 PolarHBondContact O-N 2.8Å; T143-R145 PolarHBondContact OG1-N 3.11Å; T143-E157 HydrophobicContact CG2-CG 4.35Å; T143-C164 WeakPolarHBondContact CB-O 3.02Å; T143-C164 WeakPolarHBondContact CG2-O 3.4Å; T143-C164 PolarHBondContact N-O 2.75Å; T143-C164 WeakPolarHBondContact OG1-CB 3.38Å; T143-C164 PolarHBondContact OG1-O 3.23Å; T143-R166 HydrophobicContact CG2-CB 4.24Å; T143-R166 HydrophobicContact CG2-CG 4.1Å
144	G	79.2	Confident	79	Confident	74 Å²	74	80.8 Å²	80.8	76%	0.763	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	75.8	-6.3	-172.4	0	0	0	0	0	114.8
145	R	85.7	Confident	78.8	Confident	108 Å²	108	79.8 Å²	79.8	41%	0.408	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	133.8	173.4	179.6	179.1	-86.5	-169.2	-3.4	110.2	T143 H154 S163 C164	T143-R145 PolarHBondContact O-N 2.8Å; T143-R145 PolarHBondContact OG1-N 3.11Å; R145-H154 PolarHBondContact NH1-CD2 2.04Å; R145-H154 PolarHBondContact NH1-CE1 2.71Å; R145-H154 PolarHBondContact NH1-ND1 2.79Å; R145-H154 PolarHBondContact NH1-NE2 2.9Å; R145-H154 PolarHBondContact NH2-CE1 2.91Å; R145-H154 PolarHBondContact NH2-NE2 3.27Å; R145-H154 VanDerWaalsContact NH2-NE2 3.13Å; R145-S163 CarbonylContact O-C 3.57Å; R145-S163 VanDerWaalsContact O-CA 3.31Å; R145-S163 WeakPolarHBondContact O-CA 3.02Å; R145-C164 HydrophobicContact CB-CB 4.26Å; R145-C164 PolarHBondContact O-N 3.17Å
146	R	90	Very high	78.5	Confident	222 Å²	222	79 Å²	79	84%	0.838	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	146.8	173.9	-72.9	-170.6	-73.7	-156.5	-3.3	111.7	G162	R146-G162 WeakPolarHBondContact CA-O 3.34Å
147	C	89.7	Confident	78.9	Confident	14 Å²	14	75.1 Å²	75.1	10%	0.095	44%	0.436	C	S	.	.			trans	-144.7	158	179.3	56.9	0	0	0	0	111.1	C153 C159 G162 S163 C164	C147-C153 VanDerWaalsContact CB-SG 3.51Å; C147-C153 VanDerWaalsContact SG-SG 3.63Å; C147-C159 HydrophobicContact CB-CB 3.83Å; C147-C159 WeakPolarHBondContact CB-SG 2.95Å; C147-C159 WeakPolarHBondContact SG-CA 3.34Å; C147-C159 WeakPolarHBondContact SG-CB 2.84Å; C147-C159 CovalentContact SG-SG 2.03Å; C147-C159 PolarHBondContact SG-SG 2.66Å; C147-G162 PolarHBondContact N-O 2.84Å; C147-G162 CarbonylContact O-C 3.48Å; C147-G162 WeakPolarHBondContact O-CA 3.11Å; C147-S163 PolarHBondContact SG-O 3.36Å; C147-S163 VanDerWaalsContact SG-O 3.33Å; C147-C164 VanDerWaalsContact CB-SG 3.56Å
148	V	85.5	Confident	78.9	Confident	145 Å²	145	73.7 Å²	73.7	88%	0.879	43%	0.425	S	S	*	.	S	Bend	trans	-105.5	-33.4	171.2	180	0	0	0	0	110.2
149	D	84.6	Confident	79.5	Confident	83 Å²	83	73.8 Å²	73.8	44%	0.444	43%	0.426	S	S	.	.	S	Bend	trans	-145	-179	177.5	58.9	28.6	0	0	0	109.6	V151 G152 C159	D149-V151 PolarHBondContact O-N 3.43Å; D149-V151 WeakPolarHBondContact OD1-CA 3.04Å; D149-V151 WeakPolarHBondContact OD1-CB 3.39Å; D149-V151 PolarHBondContact OD1-N 3.07Å; D149-G152 PolarHBondContact O-N 2.03Å; D149-G152 PolarHBondContact OD1-N 2.8Å; D149-G152 VanDerWaalsContact OD1-N 3.11Å; D149-C159 VanDerWaalsContact C-CB 3.48Å; D149-C159 WeakPolarHBondContact O-CB 3.18Å
150	N	77	Confident	79.9	Confident	88 Å²	88	69 Å²	69	47%	0.471	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-68.4	-15.9	178.3	-67.2	-16.6	0	0	0	113.5	G152 C153 E158 C159	N150-G152 VanDerWaalsContact C-N 3.26Å; N150-G152 PolarHBondContact O-N 2.59Å; N150-C153 PolarHBondContact O-N 2.86Å; N150-E158 WeakPolarHBondContact OD1-CG 3.18Å; N150-C159 WeakPolarHBondContact OD1-CB 3.02Å; N150-C159 PolarHBondContact OD1-N 3.34Å
151	V	80.9	Confident	80.2	Confident	132 Å²	132	76.7 Å²	76.7	80%	0.8	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-72	-26.6	177.1	-171.9	0	0	0	0	110.5	D149 C153	D149-V151 PolarHBondContact O-N 3.43Å; D149-V151 WeakPolarHBondContact OD1-CA 3.04Å; D149-V151 WeakPolarHBondContact OD1-CB 3.39Å; D149-V151 PolarHBondContact OD1-N 3.07Å; V151-C153 VanDerWaalsContact C-N 3.25Å; V151-C153 PolarHBondContact O-N 3.3Å
152	G	80.6	Confident	80.3	Confident	33 Å²	33	75.5 Å²	75.5	34%	0.34	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-73.8	-8	173.4	0	0	0	0	0	115.4	D149 N150	D149-G152 PolarHBondContact O-N 2.03Å; D149-G152 PolarHBondContact OD1-N 2.8Å; D149-G152 VanDerWaalsContact OD1-N 3.11Å; N150-G152 VanDerWaalsContact C-N 3.26Å; N150-G152 PolarHBondContact O-N 2.59Å
153	C	80.3	Confident	80.6	Confident	15 Å²	15	75.4 Å²	75.4	10%	0.101	43%	0.434	C	S	.	.	S	Bend	trans	-107.2	157.8	-177.5	-59.1	0	0	0	0	112.1	C147 N150 V151 E157 C164	C147-C153 VanDerWaalsContact CB-SG 3.51Å; C147-C153 VanDerWaalsContact SG-SG 3.63Å; N150-C153 PolarHBondContact O-N 2.86Å; V151-C153 VanDerWaalsContact C-N 3.25Å; V151-C153 PolarHBondContact O-N 3.3Å; C153-E157 HydrophobicContact CB-CB 3.73Å; C153-C164 WeakPolarHBondContact CA-SG 3.46Å; C153-C164 HydrophobicContact CB-CB 3.79Å; C153-C164 WeakPolarHBondContact CB-SG 3.26Å; C153-C164 WeakPolarHBondContact SG-CA 3.34Å; C153-C164 WeakPolarHBondContact SG-CB 3.48Å; C153-C164 CovalentContact SG-SG 2.04Å; C153-C164 PolarHBondContact SG-SG 2.73Å
154	H	77.1	Confident	81	Confident	106 Å²	106	73 Å²	73	49%	0.491	42%	0.42	S	S	.	.			trans	-72.1	161.8	175.8	-69.8	-62	0	0	0	111.3	R145 G156 E157	R145-H154 PolarHBondContact NH1-CD2 2.04Å; R145-H154 PolarHBondContact NH1-CE1 2.71Å; R145-H154 PolarHBondContact NH1-ND1 2.79Å; R145-H154 PolarHBondContact NH1-NE2 2.9Å; R145-H154 PolarHBondContact NH2-CE1 2.91Å; R145-H154 PolarHBondContact NH2-NE2 3.27Å; R145-H154 VanDerWaalsContact NH2-NE2 3.13Å; H154-G156 PolarHBondContact O-N 3.39Å; H154-G156 VanDerWaalsContact O-N 3.14Å; H154-E157 HydrophobicContact CB-CG 4.42Å; H154-E157 IonicContact CD2-OE1 2.9Å; H154-E157 PolarHBondContact N-OE2 3.17Å; H154-E157 WeakPolarHBondContact O-CB 3.45Å; H154-E157 PolarHBondContact O-N 3.44Å
155	V	63.5	Low	81.3	Confident	143 Å²	143	71.7 Å²	71.7	87%	0.867	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	119.7	178.7	179.9	0	0	0	0	110.3
156	G	62.9	Low	80.9	Confident	47 Å²	47	72.2 Å²	72.2	49%	0.485	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.6	2.9	-177.6	0	0	0	0	0	114.7	H154	H154-G156 PolarHBondContact O-N 3.39Å; H154-G156 VanDerWaalsContact O-N 3.14Å
157	E	77.1	Confident	79.9	Confident	41 Å²	41	61.9 Å²	61.9	19%	0.192	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	157.7	171.4	-63.1	170.7	178.7	0	0	110.8	T143 C153 H154 C164 W165 R166	T143-E157 HydrophobicContact CG2-CG 4.35Å; C153-E157 HydrophobicContact CB-CB 3.73Å; H154-E157 HydrophobicContact CB-CG 4.42Å; H154-E157 IonicContact CD2-OE1 2.9Å; H154-E157 PolarHBondContact N-OE2 3.17Å; H154-E157 WeakPolarHBondContact O-CB 3.45Å; H154-E157 PolarHBondContact O-N 3.44Å; E157-C164 HydrophobicContact CB-CB 4.43Å; E157-W165 CarbonylContact C-O 3.58Å; E157-W165 WeakPolarHBondContact CA-O 2.98Å; E157-W165 WeakPolarHBondContact CB-O 3.5Å; E157-R166 HydrophobicContact CG-CB 4.1Å
158	E	77.5	Confident	78.6	Confident	15 Å²	15	64.9 Å²	64.9	7%	0.07	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	142.2	174.3	-160.9	179.4	179.7	0	0	110.3	Y123 I131 C132 N150 V160 W165	Y123-E158 PolarHBondContact N-OE1 3.04Å; I131-E158 HydrophobicContact CB-CB 4.45Å; C132-E158 WeakPolarHBondContact CA-OE2 3.15Å; C132-E158 WeakPolarHBondContact CB-OE2 3.43Å; C132-E158 PolarHBondContact N-OE2 3.18Å; N150-E158 WeakPolarHBondContact OD1-CG 3.18Å; E158-V160 HydrophobicContact CB-CG2 4.45Å; E158-V160 PolarHBondContact O-N 2.03Å; E158-W165 PolarHBondContact N-O 3.48Å; E158-W165 PolarHBondContact O-N 3.1Å
159	C	84.5	Confident	77.2	Confident	11 Å²	11	59.9 Å²	59.9	7%	0.074	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	101.6	177.6	-170.4	0	0	0	0	110.4	Y123 C147 D149 N150	Y123-C159 WeakPolarHBondContact CD1-O 3.26Å; Y123-C159 VanDerWaalsContact CE1-O 3.29Å; Y123-C159 WeakPolarHBondContact CE1-O 3.1Å; C147-C159 HydrophobicContact CB-CB 3.83Å; C147-C159 WeakPolarHBondContact CB-SG 2.95Å; C147-C159 WeakPolarHBondContact SG-CA 3.34Å; C147-C159 WeakPolarHBondContact SG-CB 2.84Å; C147-C159 CovalentContact SG-SG 2.03Å; C147-C159 PolarHBondContact SG-SG 2.66Å; D149-C159 VanDerWaalsContact C-CB 3.48Å; D149-C159 WeakPolarHBondContact O-CB 3.18Å; N150-C159 WeakPolarHBondContact OD1-CB 3.02Å; N150-C159 PolarHBondContact OD1-N 3.34Å
160	V	84.4	Confident	75.7	Confident	14 Å²	14	58.1 Å²	58.1	9%	0.085	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117.5	179.9	-178.2	0	0	0	0	109	Y123 I131 E158 G162 S163 W165	Y123-V160 HydrophobicContact CD1-CG2 4.04Å; Y123-V160 HydrophobicContact CD2-CB 4.28Å; Y123-V160 HydrophobicContact CD2-CG1 3.64Å; Y123-V160 HydrophobicContact CD2-CG2 4.16Å; Y123-V160 HydrophobicContact CE2-CG1 4.05Å; Y123-V160 HydrophobicContact CG-CB 4.21Å; Y123-V160 HydrophobicContact CG-CG1 4.04Å; Y123-V160 HydrophobicContact CG-CG2 3.65Å; I131-V160 HydrophobicContact CG2-CG2 3.92Å; E158-V160 HydrophobicContact CB-CG2 4.45Å; E158-V160 PolarHBondContact O-N 2.03Å; V160-G162 PolarHBondContact O-N 3.08Å; V160-G162 VanDerWaalsContact O-N 3.17Å; V160-S163 PolarHBondContact N-O 3.16Å; V160-S163 PolarHBondContact O-N 2.94Å; V160-S163 VanDerWaalsContact O-N 3.11Å; V160-S163 VanDerWaalsContact O-O 3.06Å; V160-W165 HydrophobicContact CB-CB 4.48Å; V160-W165 HydrophobicContact CB-CD2 4.46Å; V160-W165 HydrophobicContact CB-CG 3.95Å; V160-W165 HydrophobicContact CG2-CB 4.19Å; V160-W165 HydrophobicContact CG2-CG 4.16Å; V160-W165 PolarHBondContact O-NE1 3.46Å
161	Q	81.1	Confident	74.9	Confident	167 Å²	167	55.2 Å²	55.2	78%	0.78	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	39.4	178.3	-60.9	-178.5	-17.9	0	0	113.9	S163	Q161-S163 VanDerWaalsContact C-N 3.35Å; Q161-S163 PolarHBondContact O-N 3.3Å
162	G	84.6	Confident	74.6	Confident	32 Å²	32	57.1 Å²	57.1	33%	0.33	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	6.4	175.9	0	0	0	0	0	115.4	R146 C147 V160	R146-G162 WeakPolarHBondContact CA-O 3.34Å; C147-G162 PolarHBondContact N-O 2.84Å; C147-G162 CarbonylContact O-C 3.48Å; C147-G162 WeakPolarHBondContact O-CA 3.11Å; V160-G162 PolarHBondContact O-N 3.08Å; V160-G162 VanDerWaalsContact O-N 3.17Å
163	S	87.5	Confident	74.7	Confident	43 Å²	43	56 Å²	56	30%	0.301	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.8	171.9	-60.2	0	0	0	0	110.4	R145 C147 V160 Q161 W165	R145-S163 CarbonylContact O-C 3.57Å; R145-S163 VanDerWaalsContact O-CA 3.31Å; R145-S163 WeakPolarHBondContact O-CA 3.02Å; C147-S163 PolarHBondContact SG-O 3.36Å; C147-S163 VanDerWaalsContact SG-O 3.33Å; V160-S163 PolarHBondContact N-O 3.16Å; V160-S163 PolarHBondContact O-N 2.94Å; V160-S163 VanDerWaalsContact O-N 3.11Å; V160-S163 VanDerWaalsContact O-O 3.06Å; Q161-S163 VanDerWaalsContact C-N 3.35Å; Q161-S163 PolarHBondContact O-N 3.3Å; S163-W165 VanDerWaalsContact O-CD1 3.24Å
164	C	86.9	Confident	74.9	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	130.2	174	-63.8	0	0	0	0	109.5	T143 R145 C147 C153 E157	T143-C164 WeakPolarHBondContact CB-O 3.02Å; T143-C164 WeakPolarHBondContact CG2-O 3.4Å; T143-C164 PolarHBondContact N-O 2.75Å; T143-C164 WeakPolarHBondContact OG1-CB 3.38Å; T143-C164 PolarHBondContact OG1-O 3.23Å; R145-C164 HydrophobicContact CB-CB 4.26Å; R145-C164 PolarHBondContact O-N 3.17Å; C147-C164 VanDerWaalsContact CB-SG 3.56Å; C153-C164 WeakPolarHBondContact CA-SG 3.46Å; C153-C164 HydrophobicContact CB-CB 3.79Å; C153-C164 WeakPolarHBondContact CB-SG 3.26Å; C153-C164 WeakPolarHBondContact SG-CA 3.34Å; C153-C164 WeakPolarHBondContact SG-CB 3.48Å; C153-C164 CovalentContact SG-SG 2.04Å; C153-C164 PolarHBondContact SG-SG 2.73Å; E157-C164 HydrophobicContact CB-CB 4.43Å
165	W	85.3	Confident	75.4	Confident	46 Å²	46	60.1 Å²	60.1	17%	0.174	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.1	178.8	-73.7	63.7	0	0	0	110.4	N129 I131 G140 E141 E157 E158 V160 S163	N129-W165 HydrophobicContact CB-CH2 4.24Å; N129-W165 HydrophobicContact CB-CZ3 3.9Å; I131-W165 HydrophobicContact CG2-CB 3.46Å; I131-W165 VanDerWaalsContact CG2-CB 3.46Å; I131-W165 HydrophobicContact CG2-CG 4.29Å; G140-W165 WeakPolarHBondContact O-CZ3 3.36Å; E141-W165 CarbonylContact O-C 3.59Å; E141-W165 VanDerWaalsContact O-CA 3.27Å; E141-W165 WeakPolarHBondContact O-CA 3.06Å; E157-W165 CarbonylContact C-O 3.58Å; E157-W165 WeakPolarHBondContact CA-O 2.98Å; E157-W165 WeakPolarHBondContact CB-O 3.5Å; E158-W165 PolarHBondContact N-O 3.48Å; E158-W165 PolarHBondContact O-N 3.1Å; V160-W165 HydrophobicContact CB-CB 4.48Å; V160-W165 HydrophobicContact CB-CD2 4.46Å; V160-W165 HydrophobicContact CB-CG 3.95Å; V160-W165 HydrophobicContact CG2-CB 4.19Å; V160-W165 HydrophobicContact CG2-CG 4.16Å; V160-W165 PolarHBondContact O-NE1 3.46Å; S163-W165 VanDerWaalsContact O-CD1 3.24Å
166	R	78	Confident	76.4	Confident	120 Å²	120	54.9 Å²	54.9	45%	0.453	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	150.9	176.2	65.7	-178.1	-173.4	169.5	5.2	110.8	G140 E141 T143 E157	G140-R166 CarbonylContact C-O 3.58Å; G140-R166 WeakPolarHBondContact CA-O 3.37Å; E141-R166 HydrophobicContact CG-CG 3.68Å; E141-R166 PolarHBondContact N-O 3.05Å; E141-R166 PolarHBondContact O-N 3.02Å; E141-R166 IonicContact OE1-CZ 3.51Å; E141-R166 IonicContact OE1-NE 3.56Å; E141-R166 PolarHBondContact OE1-NE 2.67Å; E141-R166 IonicContact OE1-NH2 2.78Å; E141-R166 PolarHBondContact OE1-NH2 3.4Å; T143-R166 HydrophobicContact CG2-CB 4.24Å; T143-R166 HydrophobicContact CG2-CG 4.1Å; E157-R166 HydrophobicContact CG-CB 4.1Å
167	S	69.5	Low	77.4	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.028	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	130.2	178.6	177.8	0	0	0	0	110.6	V138 Q139 S169 I170	V138-S167 WeakPolarHBondContact CG2-OG 3.47Å; Q139-S167 CarbonylContact O-C 3.47Å; S167-S169 PolarHBondContact OG-N 2.99Å; S167-I170 PolarHBondContact OG-N 3.08Å
168	K	62.7	Low	77.5	Confident	77 Å²	77	59.4 Å²	59.4	34%	0.335	31%	0.31	S	S	.	.	S	Bend	trans	-67.5	-35.9	167.9	-90.5	-175	169.6	-176.9	0	112.2	Q139 E141	Q139-K168 HydrophobicContact CB-CB 4.45Å; Q139-K168 HydrophobicContact CG-CD 4.41Å; Q139-K168 PolarHBondContact O-N 2.02Å; E141-K168 HydrophobicContact CB-CG 4.42Å; E141-K168 HydrophobicContact CG-CG 4.38Å
169	S	54.7	Low	77.4	Confident	41 Å²	41	59.3 Å²	59.3	29%	0.287	31%	0.311	S	S	.	.	S	Bend	trans	-105.3	-13	-166.6	53.6	0	0	0	0	116	S167	S167-S169 PolarHBondContact OG-N 2.99Å
170	I	54.1	Low	76.7	Confident	45 Å²	45	63 Å²	63	23%	0.231	33%	0.327	C	S	.	.	S	Bend	trans	-137.9	35.3	-179.5	-40.3	-175.9	0	0	0	110.9	L133 V138 S167 R172 T189	L133-I170 HydrophobicContact CD2-CB 3.93Å; L133-I170 HydrophobicContact CD2-CG2 4.28Å; V138-I170 HydrophobicContact CG1-CD1 3.53Å; V138-I170 HydrophobicContact CG1-CG1 3.97Å; S167-I170 PolarHBondContact OG-N 3.08Å; I170-R172 PolarHBondContact O-N 3.32Å; I170-T189 HydrophobicContact CG2-CG2 3.85Å
171	A	59.2	Low	76.1	Confident	27 Å²	27	66.9 Å²	66.9	22%	0.223	35%	0.352	C	S	.	.			trans	-63.3	131.1	168.4	0	0	0	0	0	109.1	C190	A171-C190 PolarHBondContact O-N 3.36Å
172	R	74.5	Confident	75.3	Confident	172 Å²	172	62 Å²	62	65%	0.649	34%	0.337	S	S	*	.	B	Isolated β-bridge	trans	-63.2	139.2	164.1	-80.5	-178.4	170.7	153	-1.9	108.1	I170 E188	I170-R172 PolarHBondContact O-N 3.32Å; R172-E188 VanDerWaalsContact CA-O 3.26Å; R172-E188 WeakPolarHBondContact CA-O 3.3Å
173	C	82.9	Confident	74.9	Confident	9 Å²	9	61 Å²	61	6%	0.061	32%	0.323	C	S	.	.			trans	-131.2	141	178.9	58.1	0	0	0	0	110	D178 C185 E188 T189	C173-D178 HydrophobicContact CB-CB 3.82Å; C173-C185 VanDerWaalsContact C-SG 3.56Å; C173-C185 HydrophobicContact CB-CB 3.68Å; C173-C185 WeakPolarHBondContact CB-SG 3.49Å; C173-C185 PolarHBondContact O-SG 3.23Å; C173-C185 VanDerWaalsContact O-SG 3.34Å; C173-C185 WeakPolarHBondContact SG-CA 3.23Å; C173-C185 WeakPolarHBondContact SG-CB 3.5Å; C173-C185 CovalentContact SG-SG 2.03Å; C173-C185 PolarHBondContact SG-SG 2.97Å; C173-E188 PolarHBondContact N-O 2.81Å; C173-E188 WeakPolarHBondContact O-CA 3.02Å; C173-E188 VanDerWaalsContact SG-C 3.5Å; C173-T189 PolarHBondContact SG-N 3.14Å
174	A	84.8	Confident	74.7	Confident	99 Å²	99	58.9 Å²	58.9	82%	0.818	31%	0.309	S	S	*	.	S	Bend	trans	-96.5	-29.4	164.4	0	0	0	0	0	110.5	D178	A174-D178 PolarHBondContact N-OD2 3.41Å
175	K	87.9	Confident	74.8	Confident	109 Å²	109	59.6 Å²	59.6	47%	0.474	31%	0.314	S	S	.	.	S	Bend	trans	-142.6	166.3	-178.4	56.8	173.9	-175	150.2	0	111.4	D177 D178	K175-D177 VanDerWaalsContact C-N 3.28Å; K175-D177 HydrophobicContact CD-CB 4.24Å; K175-D177 HydrophobicContact CG-CB 4.41Å; K175-D177 IonicContact NZ-OD2 2.87Å; K175-D177 PolarHBondContact NZ-OD2 2.89Å; K175-D177 PolarHBondContact O-N 3.43Å; K175-D178 WeakPolarHBondContact CE-OD1 3.45Å; K175-D178 WeakPolarHBondContact CG-OD1 3.19Å; K175-D178 WeakPolarHBondContact CG-OD2 3.32Å; K175-D178 PolarHBondContact N-OD2 2.73Å; K175-D178 WeakPolarHBondContact O-CB 3.43Å; K175-D178 PolarHBondContact O-N 2.81Å; K175-D178 VanDerWaalsContact O-N 3.15Å
176	H	85	Confident	74.9	Confident	34 Å²	34	59 Å²	59	16%	0.157	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-63.1	-31.3	-177.2	-63.9	-66.2	0	0	0	113.7	D178 C179 C185 C212 K213	H176-D178 PolarHBondContact O-N 3.1Å; H176-C179 WeakPolarHBondContact O-CB 2.99Å; H176-C179 PolarHBondContact O-N 3.04Å; H176-C185 PolarHBondContact CE1-O 2.95Å; H176-C185 VanDerWaalsContact CE1-O 3.3Å; H176-C185 PolarHBondContact ND1-N 3.44Å; H176-C185 VanDerWaalsContact ND1-N 3.1Å; H176-C212 PolarHBondContact CD2-O 3.06Å; H176-C212 VanDerWaalsContact CD2-O 3.24Å; H176-C212 PolarHBondContact NE2-O 3.13Å; H176-C212 VanDerWaalsContact NE2-O 3.08Å; H176-K213 HydrophobicContact CB-CB 4.23Å; H176-K213 HydrophobicContact CB-CD 4.05Å; H176-K213 HydrophobicContact CB-CG 3.8Å
177	D	82.6	Confident	75.2	Confident	121 Å²	121	59.1 Å²	59.1	65%	0.647	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-64	-17.4	176.9	-50.3	-18.9	0	0	0	113.6	K175 C179	K175-D177 VanDerWaalsContact C-N 3.28Å; K175-D177 HydrophobicContact CD-CB 4.24Å; K175-D177 HydrophobicContact CG-CB 4.41Å; K175-D177 IonicContact NZ-OD2 2.87Å; K175-D177 PolarHBondContact NZ-OD2 2.89Å; K175-D177 PolarHBondContact O-N 3.43Å; D177-C179 PolarHBondContact O-N 3.4Å
178	D	79.8	Confident	75.9	Confident	61 Å²	61	65.8 Å²	65.8	33%	0.326	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-77.2	-10.1	177.1	-51.6	-29.6	0	0	0	111.5	C173 A174 K175 H176	C173-D178 HydrophobicContact CB-CB 3.82Å; A174-D178 PolarHBondContact N-OD2 3.41Å; K175-D178 WeakPolarHBondContact CE-OD1 3.45Å; K175-D178 WeakPolarHBondContact CG-OD1 3.19Å; K175-D178 WeakPolarHBondContact CG-OD2 3.32Å; K175-D178 PolarHBondContact N-OD2 2.73Å; K175-D178 WeakPolarHBondContact O-CB 3.43Å; K175-D178 PolarHBondContact O-N 2.81Å; K175-D178 VanDerWaalsContact O-N 3.15Å; H176-D178 PolarHBondContact O-N 3.1Å
179	C	74.5	Confident	76.7	Confident	14 Å²	14	63.2 Å²	63.2	10%	0.095	34%	0.343	C	S	.	.	S	Bend	trans	-104.8	154.6	-178.3	-57.2	0	0	0	0	111.9	H176 D177 M183 C190	H176-C179 WeakPolarHBondContact O-CB 2.99Å; H176-C179 PolarHBondContact O-N 3.04Å; D177-C179 PolarHBondContact O-N 3.4Å; C179-M183 HydrophobicContact CB-CB 4.03Å; C179-C190 WeakPolarHBondContact CA-SG 3.36Å; C179-C190 HydrophobicContact CB-CB 3.75Å; C179-C190 WeakPolarHBondContact CB-SG 3.24Å; C179-C190 WeakPolarHBondContact SG-CA 3.02Å; C179-C190 WeakPolarHBondContact SG-CB 3.4Å; C179-C190 CovalentContact SG-SG 2.04Å; C179-C190 PolarHBondContact SG-SG 3.11Å
180	H	71.2	Confident	78	Confident	88 Å²	88	61.3 Å²	61.3	41%	0.407	33%	0.329	S	S	.	.			trans	-54.6	148.4	169.8	-171.1	-97.4	0	0	0	110.7	S182 M183	H180-S182 PolarHBondContact ND1-N 2.75Å; H180-S182 PolarHBondContact ND1-OG 2.86Å; H180-S182 PolarHBondContact O-N 2.87Å; H180-M183 HydrophobicContact CB-CB 4.47Å; H180-M183 HydrophobicContact CB-CG 4.25Å; H180-M183 HydrophobicContact CB-SD 4.18Å; H180-M183 WeakPolarHBondContact O-CA 2.93Å; H180-M183 WeakPolarHBondContact O-CB 3.28Å; H180-M183 PolarHBondContact O-N 2.04Å
181	P	71.1	Confident	79.2	Confident	96 Å²	96	64.8 Å²	64.8	62%	0.623	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-28.3	-178.1	-30.7	36.8	0	0	0	115.4	M183 K213	P181-M183 VanDerWaalsContact C-N 3.3Å; P181-M183 PolarHBondContact O-N 3.45Å; P181-K213 PolarHBondContact O-NZ 3.1Å
182	S	64	Low	80	Confident	65 Å²	65	69.1 Å²	69.1	46%	0.455	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	1.8	174.7	61.9	0	0	0	0	114.8	H180	H180-S182 PolarHBondContact ND1-N 2.75Å; H180-S182 PolarHBondContact ND1-OG 2.86Å; H180-S182 PolarHBondContact O-N 2.87Å
183	M	76	Confident	80.1	Confident	9 Å²	9	61.2 Å²	61.2	4%	0.044	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	165.8	-176.4	-63.1	-177.6	82.8	0	0	110.9	C179 H180 P181 C190 R191 E192 K213	C179-M183 HydrophobicContact CB-CB 4.03Å; H180-M183 HydrophobicContact CB-CB 4.47Å; H180-M183 HydrophobicContact CB-CG 4.25Å; H180-M183 HydrophobicContact CB-SD 4.18Å; H180-M183 WeakPolarHBondContact O-CA 2.93Å; H180-M183 WeakPolarHBondContact O-CB 3.28Å; H180-M183 PolarHBondContact O-N 2.04Å; P181-M183 VanDerWaalsContact C-N 3.3Å; P181-M183 PolarHBondContact O-N 3.45Å; M183-C190 VanDerWaalsContact CE-C 3.45Å; M183-C190 HydrophobicContact CE-CB 3.89Å; M183-C190 VanDerWaalsContact CE-O 3.26Å; M183-C190 WeakPolarHBondContact CE-O 3.07Å; M183-C190 HydrophobicContact SD-CB 4.38Å; M183-R191 CarbonylContact C-O 3.57Å; M183-R191 VanDerWaalsContact CA-O 3.26Å; M183-R191 WeakPolarHBondContact CA-O 3.27Å; M183-R191 WeakPolarHBondContact CB-O 3.29Å; M183-E192 HydrophobicContact CE-CG 4.13Å; M183-E192 HydrophobicContact CG-CG 4.12Å; M183-K213 PolarHBondContact O-NZ 3.31Å
184	F	84.3	Confident	79.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	148.9	176	74.4	-72.4	0	0	0	110.8	Y186 R191 R211 K213 W218 L220	F184-Y186 AromaticContact CE2-CD2 3.8Å; F184-Y186 HydrophobicContact CE2-CD2 3.8Å; F184-Y186 HydrophobicContact CE2-CG 4.15Å; F184-Y186 HydrophobicContact CZ-CD2 4.12Å; F184-Y186 HydrophobicContact CZ-CG 4.29Å; F184-Y186 PolarHBondContact O-N 3.49Å; F184-Y186 VanDerWaalsContact O-N 3.17Å; F184-R191 WeakPolarHBondContact CD1-O 3.49Å; F184-R191 HydrophobicContact CE1-CB 4.39Å; F184-R191 PolarHBondContact N-O 2.86Å; F184-R191 PolarHBondContact O-N 3.38Å; F184-R211 HydrophobicContact CD2-CB 3.74Å; F184-R211 HydrophobicContact CD2-CG 4.05Å; F184-R211 HydrophobicContact CE2-CB 3.83Å; F184-R211 HydrophobicContact CE2-CG 3.8Å; F184-K213 HydrophobicContact CB-CD 3.92Å; F184-W218 HydrophobicContact CB-CB 4.28Å; F184-W218 HydrophobicContact CB-CE3 4.47Å; F184-W218 HydrophobicContact CB-CG 4.49Å; F184-W218 HydrophobicContact CD1-CB 4.13Å; F184-W218 HydrophobicContact CD1-CE3 4.41Å; F184-W218 HydrophobicContact CD2-CB 4.05Å; F184-W218 HydrophobicContact CE1-CB 4.49Å; F184-W218 HydrophobicContact CE2-CB 4.35Å; F184-W218 HydrophobicContact CG-CB 3.9Å; F184-L220 HydrophobicContact CE1-CD2 3.88Å; F184-L220 HydrophobicContact CE1-CG 4.44Å; F184-L220 HydrophobicContact CZ-CD2 3.77Å; F184-L220 HydrophobicContact CZ-CG 4.04Å
185	C	87.6	Confident	79.8	Confident	15 Å²	15	61.2 Å²	61.2	10%	0.101	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	112.5	175.2	-167.8	0	0	0	0	110.9	C173 H176	C173-C185 VanDerWaalsContact C-SG 3.56Å; C173-C185 HydrophobicContact CB-CB 3.68Å; C173-C185 WeakPolarHBondContact CB-SG 3.49Å; C173-C185 PolarHBondContact O-SG 3.23Å; C173-C185 VanDerWaalsContact O-SG 3.34Å; C173-C185 WeakPolarHBondContact SG-CA 3.23Å; C173-C185 WeakPolarHBondContact SG-CB 3.5Å; C173-C185 CovalentContact SG-SG 2.03Å; C173-C185 PolarHBondContact SG-SG 2.97Å; H176-C185 PolarHBondContact CE1-O 2.95Å; H176-C185 VanDerWaalsContact CE1-O 3.3Å; H176-C185 PolarHBondContact ND1-N 3.44Å; H176-C185 VanDerWaalsContact ND1-N 3.1Å
186	Y	87.5	Confident	79.3	Confident	34 Å²	34	56.3 Å²	56.3	13%	0.133	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	114.2	177.1	-176.7	-89.3	0	0	0	109.2	F184 T189 R191 K209 R211 L220	F184-Y186 AromaticContact CE2-CD2 3.8Å; F184-Y186 HydrophobicContact CE2-CD2 3.8Å; F184-Y186 HydrophobicContact CE2-CG 4.15Å; F184-Y186 HydrophobicContact CZ-CD2 4.12Å; F184-Y186 HydrophobicContact CZ-CG 4.29Å; F184-Y186 PolarHBondContact O-N 3.49Å; F184-Y186 VanDerWaalsContact O-N 3.17Å; Y186-T189 CarbonylContact C-O 3.59Å; Y186-T189 PolarHBondContact N-O 3.1Å; Y186-T189 PolarHBondContact O-N 3.38Å; Y186-R191 HydrophobicContact CD1-CG 4.31Å; Y186-R191 HydrophobicContact CG-CG 4.49Å; Y186-K209 WeakPolarHBondContact CD2-O 3.04Å; Y186-K209 HydrophobicContact CE2-CB 3.92Å; Y186-K209 WeakPolarHBondContact CE2-O 3.44Å; Y186-K209 WeakPolarHBondContact OH-CB 3.42Å; Y186-K209 VanDerWaalsContact OH-CG 3.27Å; Y186-K209 WeakPolarHBondContact OH-CG 3.05Å; Y186-R211 HydrophobicContact CD2-CG 3.81Å; Y186-L220 HydrophobicContact CD1-CD1 4.28Å; Y186-L220 HydrophobicContact CD1-CD2 4.33Å; Y186-L220 HydrophobicContact CE1-CD1 4.1Å; Y186-L220 HydrophobicContact CG-CD2 4.26Å
187	D	84.6	Confident	79	Confident	121 Å²	121	56.6 Å²	56.6	65%	0.647	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	55.7	178.1	-154.3	33	0	0	0	112	T189	D187-T189 PolarHBondContact O-N 3.37Å; D187-T189 PolarHBondContact O-OG1 2.87Å
188	E	84.8	Confident	78.9	Confident	144 Å²	144	53 Å²	53	67%	0.673	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	11.8	-179.3	-54.7	-175.7	169.2	0	0	115.5	R172 C173	R172-E188 VanDerWaalsContact CA-O 3.26Å; R172-E188 WeakPolarHBondContact CA-O 3.3Å; C173-E188 PolarHBondContact N-O 2.81Å; C173-E188 WeakPolarHBondContact O-CA 3.02Å; C173-E188 VanDerWaalsContact SG-C 3.5Å
189	T	80.2	Confident	79.3	Confident	24 Å²	24	55.3 Å²	55.3	15%	0.147	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.1	-177.8	-46.1	0	0	0	0	109.7	I170 C173 Y186 D187 R191	I170-T189 HydrophobicContact CG2-CG2 3.85Å; C173-T189 PolarHBondContact SG-N 3.14Å; Y186-T189 CarbonylContact C-O 3.59Å; Y186-T189 PolarHBondContact N-O 3.1Å; Y186-T189 PolarHBondContact O-N 3.38Å; D187-T189 PolarHBondContact O-N 3.37Å; D187-T189 PolarHBondContact O-OG1 2.87Å; T189-R191 PolarHBondContact O-N 2.77Å
190	C	80.4	Confident	80.2	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.007	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	124.4	169.8	-64.9	0	0	0	0	109.5	A171 C179 M183	A171-C190 PolarHBondContact O-N 3.36Å; C179-C190 WeakPolarHBondContact CA-SG 3.36Å; C179-C190 HydrophobicContact CB-CB 3.75Å; C179-C190 WeakPolarHBondContact CB-SG 3.24Å; C179-C190 WeakPolarHBondContact SG-CA 3.02Å; C179-C190 WeakPolarHBondContact SG-CB 3.4Å; C179-C190 CovalentContact SG-SG 2.04Å; C179-C190 PolarHBondContact SG-SG 3.11Å; M183-C190 VanDerWaalsContact CE-C 3.45Å; M183-C190 HydrophobicContact CE-CB 3.89Å; M183-C190 VanDerWaalsContact CE-O 3.26Å; M183-C190 WeakPolarHBondContact CE-O 3.07Å; M183-C190 HydrophobicContact SD-CB 4.38Å
191	R	81.1	Confident	81.1	Confident	118 Å²	118	59.8 Å²	59.8	45%	0.445	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	147.4	176.4	-61	-64.9	-171	163	4.4	110.3	M183 F184 Y186 T189 L220	M183-R191 CarbonylContact C-O 3.57Å; M183-R191 VanDerWaalsContact CA-O 3.26Å; M183-R191 WeakPolarHBondContact CA-O 3.27Å; M183-R191 WeakPolarHBondContact CB-O 3.29Å; F184-R191 WeakPolarHBondContact CD1-O 3.49Å; F184-R191 HydrophobicContact CE1-CB 4.39Å; F184-R191 PolarHBondContact N-O 2.86Å; F184-R191 PolarHBondContact O-N 3.38Å; Y186-R191 HydrophobicContact CD1-CG 4.31Å; Y186-R191 HydrophobicContact CG-CG 4.49Å; T189-R191 PolarHBondContact O-N 2.77Å; R191-L220 HydrophobicContact CB-CD2 3.39Å; R191-L220 HydrophobicContact CG-CD2 3.83Å
192	E	75.8	Confident	82.1	Confident	117 Å²	117	61 Å²	61	55%	0.547	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	134.8	169.7	-69.6	-178.5	-168.9	0	0	109.8	M183 L221	M183-E192 HydrophobicContact CE-CG 4.13Å; M183-E192 HydrophobicContact CG-CG 4.12Å; E192-L221 HydrophobicContact CB-CB 4.46Å; E192-L221 HydrophobicContact CB-CD1 3.95Å; E192-L221 PolarHBondContact O-N 2.88Å
193	G	75.8	Confident	83.3	Confident	7 Å²	7	61.4 Å²	61.4	7%	0.072	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	169.6	178.5	0	0	0	0	0	112.6	W218 S219	G193-W218 VanDerWaalsContact O-CZ3 3.32Å; G193-W218 WeakPolarHBondContact O-CZ3 3.28Å; G193-S219 CarbonylContact C-O 3.58Å; G193-S219 WeakPolarHBondContact CA-O 3.38Å
194	K	77.1	Confident	83.8	Confident	64 Å²	64	70 Å²	70	28%	0.278	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	142	176.2	64.6	-172.6	-175.7	-170.9	0	109.9	W218 S219 L221 E236	K194-W218 CarbonylContact O-C 3.53Å; K194-W218 WeakPolarHBondContact O-CA 3.23Å; K194-S219 WeakPolarHBondContact CG-OG 3.37Å; K194-S219 PolarHBondContact N-O 2.04Å; K194-S219 PolarHBondContact O-N 2.94Å; K194-L221 HydrophobicContact CD-CD2 4.46Å; K194-E236 IonicContact NZ-OE1 3.03Å; K194-E236 PolarHBondContact NZ-OE1 3.48Å; K194-E236 IonicContact NZ-OE2 3.73Å; K194-E236 PolarHBondContact NZ-OE2 2.74Å
195	A	83.7	Confident	84.1	Confident	44 Å²	44	73.5 Å²	73.5	36%	0.364	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	134.3	171.5	0	0	0	0	0	109.2	E216 W218	A195-E216 HydrophobicContact CB-CG 4.49Å; A195-E216 VanDerWaalsContact CB-OE1 3.27Å; A195-E216 WeakPolarHBondContact CB-OE1 3.48Å; A195-W218 HydrophobicContact CB-CD2 4.29Å; A195-W218 HydrophobicContact CB-CZ2 4.12Å
196	T	78.6	Confident	84	Confident	5 Å²	5	73.5 Å²	73.5	3%	0.031	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-11.9	-170.7	61.5	0	0	0	0	113.3	Y198 Q210 C217 I234	T196-Y198 VanDerWaalsContact C-N 3.33Å; T196-Y198 WeakPolarHBondContact OG1-CD2 3.05Å; T196-Y198 PolarHBondContact OG1-N 2.75Å; T196-Q210 HydrophobicContact CG2-CG 4.48Å; T196-C217 VanDerWaalsContact CB-O 3.3Å; T196-C217 WeakPolarHBondContact CB-O 3.32Å; T196-C217 VanDerWaalsContact CG2-O 3.31Å; T196-C217 WeakPolarHBondContact CG2-O 3.34Å; T196-C217 PolarHBondContact N-O 3.26Å; T196-C217 VanDerWaalsContact OG1-CB 3.29Å; T196-C217 WeakPolarHBondContact OG1-CB 3.31Å; T196-C217 PolarHBondContact OG1-O 3Å; T196-I234 WeakPolarHBondContact O-CB 3.24Å; T196-I234 WeakPolarHBondContact O-CD1 3.03Å; T196-I234 WeakPolarHBondContact O-CG1 3.47Å
197	G	79	Confident	83.7	Confident	41 Å²	41	77.9 Å²	77.9	42%	0.423	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	82.4	-2.1	-171	0	0	0	0	0	115	E216 I234	G197-E216 WeakPolarHBondContact CA-OE1 3.42Å; G197-E216 PolarHBondContact N-OE1 3.48Å; G197-I234 WeakPolarHBondContact O-CD1 3.48Å
198	Y	79.6	Confident	83.4	Confident	44 Å²	44	75.6 Å²	75.6	17%	0.173	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	124.3	179.3	-67.1	-61.4	0	0	0	111.8	T196 E216 C217 I234 R267	T196-Y198 VanDerWaalsContact C-N 3.33Å; T196-Y198 WeakPolarHBondContact OG1-CD2 3.05Å; T196-Y198 PolarHBondContact OG1-N 2.75Å; Y198-E216 CarbonylContact O-C 3.34Å; Y198-E216 VanDerWaalsContact O-CA 3.28Å; Y198-E216 WeakPolarHBondContact O-CA 3.47Å; Y198-C217 PolarHBondContact O-N 2.82Å; Y198-I234 HydrophobicContact CD1-CD1 3.58Å; Y198-I234 HydrophobicContact CD1-CG1 4.03Å; Y198-I234 HydrophobicContact CD2-CD1 4.19Å; Y198-I234 HydrophobicContact CD2-CG1 4.09Å; Y198-I234 HydrophobicContact CE1-CD1 3.36Å; Y198-I234 HydrophobicContact CE1-CG1 3.35Å; Y198-I234 HydrophobicContact CE2-CD1 4.07Å; Y198-I234 HydrophobicContact CE2-CG1 3.51Å; Y198-I234 HydrophobicContact CG-CD1 3.95Å; Y198-I234 HydrophobicContact CG-CG1 4.32Å; Y198-I234 WeakPolarHBondContact OH-CG1 3.23Å; Y198-R267 VanDerWaalsContact CE1-CZ 3.48Å; Y198-R267 VanDerWaalsContact CE1-NH1 3.28Å; Y198-R267 PolarHBondContact OH-NH1 3.23Å; Y198-R267 PolarHBondContact OH-NH2 3.08Å
199	P	88.2	Confident	82.9	Confident	111 Å²	111	74.7 Å²	74.7	72%	0.721	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	143.8	174.9	29.9	-34.3	0	0	0	110.8	K215	P199-K215 CarbonylContact C-O 3.5Å; P199-K215 VanDerWaalsContact CA-O 3.28Å; P199-K215 WeakPolarHBondContact CA-O 3.25Å
200	C	92.8	Very high	83.3	Confident	9 Å²	9	74.9 Å²	74.9	6%	0.061	39%	0.391	C	S	.	.			trans	-147.3	157.4	177.5	60.8	0	0	0	0	111.2	D205 C212 K215 E216 C217	C200-D205 HydrophobicContact CB-CB 3.89Å; C200-C212 HydrophobicContact CB-CB 3.79Å; C200-C212 WeakPolarHBondContact CB-SG 3.38Å; C200-C212 PolarHBondContact O-SG 2.9Å; C200-C212 WeakPolarHBondContact SG-CA 3.06Å; C200-C212 WeakPolarHBondContact SG-CB 3.46Å; C200-C212 CovalentContact SG-SG 2.02Å; C200-C212 PolarHBondContact SG-SG 3.14Å; C200-K215 PolarHBondContact N-O 3.02Å; C200-K215 CarbonylContact O-C 3.58Å; C200-K215 VanDerWaalsContact O-CA 3.32Å; C200-K215 WeakPolarHBondContact O-CA 3.28Å; C200-K215 VanDerWaalsContact SG-C 3.56Å; C200-E216 PolarHBondContact SG-N 3.12Å; C200-E216 VanDerWaalsContact SG-N 3.43Å; C200-E216 PolarHBondContact SG-O 3.36Å; C200-E216 VanDerWaalsContact SG-O 3.34Å; C200-C217 VanDerWaalsContact CB-SG 3.57Å
201	Q	91.9	Very high	83.7	Confident	187 Å²	187	77.6 Å²	77.6	87%	0.874	40%	0.401	S	S	*	.	S	Bend	trans	-109.2	-27.7	167.7	-65.7	-168.5	-20	0	0	111.8	D205	Q201-D205 WeakPolarHBondContact CA-OD2 3.21Å; Q201-D205 PolarHBondContact N-OD2 3.38Å
202	K	91.2	Very high	84.3	Confident	120 Å²	120	72.8 Å²	72.8	52%	0.522	39%	0.385	S	S	.	.	S	Bend	trans	-146.2	161	-178.3	55	-174.7	174.5	-163.9	0	110.3	K204 D205 C212	K202-K204 HydrophobicContact CD-CB 4.36Å; K202-K204 HydrophobicContact CG-CB 4.3Å; K202-K204 PolarHBondContact O-N 3.22Å; K202-D205 WeakPolarHBondContact CE-OD1 3.39Å; K202-D205 WeakPolarHBondContact CG-OD1 3.37Å; K202-D205 VanDerWaalsContact CG-OD2 3.29Å; K202-D205 WeakPolarHBondContact CG-OD2 3.25Å; K202-D205 PolarHBondContact N-OD2 2.88Å; K202-D205 WeakPolarHBondContact O-CB 3.37Å; K202-D205 PolarHBondContact O-N 2.86Å; K202-C212 VanDerWaalsContact C-CB 3.48Å
203	N	88.5	Confident	84.9	Confident	74 Å²	74	67.5 Å²	67.5	40%	0.396	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-54	-29.6	179.2	-68.9	-21.8	0	0	0	114.1	D205 C206 C212	N203-D205 PolarHBondContact O-N 3.1Å; N203-C206 PolarHBondContact O-N 3.06Å; N203-C212 PolarHBondContact OD1-N 2.05Å
204	K	88	Confident	85.5	Confident	189 Å²	189	74.4 Å²	74.4	82%	0.822	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-68.9	-16.1	178.5	-66.7	-173.7	178	-177.8	0	113.9	K202 C206	K202-K204 HydrophobicContact CD-CB 4.36Å; K202-K204 HydrophobicContact CG-CB 4.3Å; K202-K204 PolarHBondContact O-N 3.22Å; K204-C206 VanDerWaalsContact C-N 3.27Å
205	D	89.8	Confident	86.1	Confident	75 Å²	75	79.7 Å²	79.7	40%	0.401	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-82.4	-12.9	177.3	-48.8	-28.2	0	0	0	111.3	C200 Q201 K202 N203	C200-D205 HydrophobicContact CB-CB 3.89Å; Q201-D205 WeakPolarHBondContact CA-OD2 3.21Å; Q201-D205 PolarHBondContact N-OD2 3.38Å; K202-D205 WeakPolarHBondContact CE-OD1 3.39Å; K202-D205 WeakPolarHBondContact CG-OD1 3.37Å; K202-D205 VanDerWaalsContact CG-OD2 3.29Å; K202-D205 WeakPolarHBondContact CG-OD2 3.25Å; K202-D205 PolarHBondContact N-OD2 2.88Å; K202-D205 WeakPolarHBondContact O-CB 3.37Å; K202-D205 PolarHBondContact O-N 2.86Å; N203-D205 PolarHBondContact O-N 3.1Å
206	C	86.3	Confident	86.5	Confident	14 Å²	14	80.7 Å²	80.7	10%	0.095	41%	0.411	C	S	.	.	S	Bend	trans	-94.9	145.2	-180	-55.5	0	0	0	0	111.7	N203 K204 Q210 C217	N203-C206 PolarHBondContact O-N 3.06Å; K204-C206 VanDerWaalsContact C-N 3.27Å; C206-Q210 HydrophobicContact CB-CB 3.58Å; C206-C217 WeakPolarHBondContact CA-SG 3.49Å; C206-C217 HydrophobicContact CB-CB 3.74Å; C206-C217 WeakPolarHBondContact CB-SG 3.2Å; C206-C217 VanDerWaalsContact SG-CA 3.53Å; C206-C217 WeakPolarHBondContact SG-CB 3.18Å; C206-C217 CovalentContact SG-SG 2.04Å; C206-C217 PolarHBondContact SG-SG 3.28Å
207	K	80.5	Confident	87	Confident	126 Å²	126	80.4 Å²	80.4	55%	0.548	41%	0.41	S	S	.	.			trans	-84.6	141.5	-177.3	-68.9	-172.8	-179.9	-176	0	111.7	K209 Q210 E230	K207-K209 PolarHBondContact O-N 2.79Å; K207-Q210 VanDerWaalsContact O-CB 3.27Å; K207-Q210 WeakPolarHBondContact O-CB 3.28Å; K207-Q210 VanDerWaalsContact O-CD 3.23Å; K207-Q210 WeakPolarHBondContact O-CG 3.02Å; K207-Q210 PolarHBondContact O-N 3.07Å; K207-Q210 PolarHBondContact O-OE1 3.3Å; K207-E230 IonicContact NZ-OE2 2.7Å
208	G	77.7	Confident	87.5	Confident	74 Å²	74	80 Å²	80	76%	0.763	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	-126.1	170.2	0	0	0	0	0	114.2	Q210	G208-Q210 PolarHBondContact O-N 3.34Å
209	K	74.7	Confident	87.6	Confident	125 Å²	125	78.5 Å²	78.5	54%	0.543	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	29.2	-178.5	-64.1	-173.6	-179.6	174.1	0	113.2	Y186 K207	Y186-K209 WeakPolarHBondContact CD2-O 3.04Å; Y186-K209 HydrophobicContact CE2-CB 3.92Å; Y186-K209 WeakPolarHBondContact CE2-O 3.44Å; Y186-K209 WeakPolarHBondContact OH-CB 3.42Å; Y186-K209 VanDerWaalsContact OH-CG 3.27Å; Y186-K209 WeakPolarHBondContact OH-CG 3.05Å; K207-K209 PolarHBondContact O-N 2.79Å
210	Q	88.4	Confident	87.2	Confident	28 Å²	28	73.9 Å²	73.9	13%	0.131	36%	0.36	C	S	.	.			trans	-96	161.2	179.8	-66.4	171.4	-3.2	0	0	112.3	T196 C206 K207 G208 W218	T196-Q210 HydrophobicContact CG2-CG 4.48Å; C206-Q210 HydrophobicContact CB-CB 3.58Å; K207-Q210 VanDerWaalsContact O-CB 3.27Å; K207-Q210 WeakPolarHBondContact O-CB 3.28Å; K207-Q210 VanDerWaalsContact O-CD 3.23Å; K207-Q210 WeakPolarHBondContact O-CG 3.02Å; K207-Q210 PolarHBondContact O-N 3.07Å; K207-Q210 PolarHBondContact O-OE1 3.3Å; G208-Q210 PolarHBondContact O-N 3.34Å; Q210-W218 CarbonylContact C-O 3.54Å; Q210-W218 WeakPolarHBondContact CA-O 3.49Å; Q210-W218 WeakPolarHBondContact CB-O 3.33Å
211	R	89.8	Confident	85.8	Confident	57 Å²	57	78 Å²	78	22%	0.215	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	152.6	174.7	-60.9	-71.3	-179.1	-88.5	-0.4	111	F184 Y186 C217 W218	F184-R211 HydrophobicContact CD2-CB 3.74Å; F184-R211 HydrophobicContact CD2-CG 4.05Å; F184-R211 HydrophobicContact CE2-CB 3.83Å; F184-R211 HydrophobicContact CE2-CG 3.8Å; Y186-R211 HydrophobicContact CD2-CG 3.81Å; R211-C217 CarbonylContact O-C 3.5Å; R211-C217 WeakPolarHBondContact O-CA 3.35Å; R211-W218 PolarHBondContact N-O 3.23Å; R211-W218 PolarHBondContact O-N 3.26Å
212	C	92.4	Very high	84.2	Confident	17 Å²	17	75.1 Å²	75.1	12%	0.115	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	106.8	-176.3	-172.2	0	0	0	0	110.9	H176 C200 K202 N203	H176-C212 PolarHBondContact CD2-O 3.06Å; H176-C212 VanDerWaalsContact CD2-O 3.24Å; H176-C212 PolarHBondContact NE2-O 3.13Å; H176-C212 VanDerWaalsContact NE2-O 3.08Å; C200-C212 HydrophobicContact CB-CB 3.79Å; C200-C212 WeakPolarHBondContact CB-SG 3.38Å; C200-C212 PolarHBondContact O-SG 2.9Å; C200-C212 WeakPolarHBondContact SG-CA 3.06Å; C200-C212 WeakPolarHBondContact SG-CB 3.46Å; C200-C212 CovalentContact SG-SG 2.02Å; C200-C212 PolarHBondContact SG-SG 3.14Å; K202-C212 VanDerWaalsContact C-CB 3.48Å; N203-C212 PolarHBondContact OD1-N 2.05Å
213	K	89.8	Confident	82.3	Confident	7 Å²	7	80.6 Å²	80.6	3%	0.03	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	128.6	176.6	173.9	-175.9	174.1	-163.4	0	108.7	H176 P181 M183 F184 K215 E216 W218	H176-K213 HydrophobicContact CB-CB 4.23Å; H176-K213 HydrophobicContact CB-CD 4.05Å; H176-K213 HydrophobicContact CB-CG 3.8Å; P181-K213 PolarHBondContact O-NZ 3.1Å; M183-K213 PolarHBondContact O-NZ 3.31Å; F184-K213 HydrophobicContact CB-CD 3.92Å; K213-K215 VanDerWaalsContact C-N 3.28Å; K213-K215 PolarHBondContact O-N 3.34Å; K213-E216 PolarHBondContact N-O 2.8Å; K213-E216 PolarHBondContact O-N 3.34Å; K213-W218 HydrophobicContact CB-CG 4.15Å; K213-W218 HydrophobicContact CD-CD2 4.17Å; K213-W218 HydrophobicContact CD-CZ2 4.16Å; K213-W218 PolarHBondContact O-NE1 3.36Å
214	E	87.3	Confident	80.8	Confident	152 Å²	152	80.6 Å²	80.6	71%	0.71	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	38.5	177.6	-65.1	170	-154.2	0	0	114.2	E216	E214-E216 PolarHBondContact O-N 2.91Å
215	K	90.2	Very high	79.8	Confident	174 Å²	174	79.6 Å²	79.6	76%	0.757	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	14.7	-177	-51.3	175.5	-179.7	174.1	0	114.8	P199 C200 K213	P199-K215 CarbonylContact C-O 3.5Å; P199-K215 VanDerWaalsContact CA-O 3.28Å; P199-K215 WeakPolarHBondContact CA-O 3.25Å; C200-K215 PolarHBondContact N-O 3.02Å; C200-K215 CarbonylContact O-C 3.58Å; C200-K215 VanDerWaalsContact O-CA 3.32Å; C200-K215 WeakPolarHBondContact O-CA 3.28Å; C200-K215 VanDerWaalsContact SG-C 3.56Å; K213-K215 VanDerWaalsContact C-N 3.28Å; K213-K215 PolarHBondContact O-N 3.34Å
216	E	90.8	Very high	79.3	Confident	65 Å²	65	76.1 Å²	76.1	30%	0.304	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.5	177.5	-160.2	177.2	156.3	0	0	110.8	A195 G197 Y198 C200 K213 E214	A195-E216 HydrophobicContact CB-CG 4.49Å; A195-E216 VanDerWaalsContact CB-OE1 3.27Å; A195-E216 WeakPolarHBondContact CB-OE1 3.48Å; G197-E216 WeakPolarHBondContact CA-OE1 3.42Å; G197-E216 PolarHBondContact N-OE1 3.48Å; Y198-E216 CarbonylContact O-C 3.34Å; Y198-E216 VanDerWaalsContact O-CA 3.28Å; Y198-E216 WeakPolarHBondContact O-CA 3.47Å; C200-E216 PolarHBondContact SG-N 3.12Å; C200-E216 VanDerWaalsContact SG-N 3.43Å; C200-E216 PolarHBondContact SG-O 3.36Å; C200-E216 VanDerWaalsContact SG-O 3.34Å; K213-E216 PolarHBondContact N-O 2.8Å; K213-E216 PolarHBondContact O-N 3.34Å; E214-E216 PolarHBondContact O-N 2.91Å
217	C	90.8	Very high	78.9	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	134.9	175.2	-65.5	0	0	0	0	110.3	T196 Y198 C200 C206 R211	T196-C217 VanDerWaalsContact CB-O 3.3Å; T196-C217 WeakPolarHBondContact CB-O 3.32Å; T196-C217 VanDerWaalsContact CG2-O 3.31Å; T196-C217 WeakPolarHBondContact CG2-O 3.34Å; T196-C217 PolarHBondContact N-O 3.26Å; T196-C217 VanDerWaalsContact OG1-CB 3.29Å; T196-C217 WeakPolarHBondContact OG1-CB 3.31Å; T196-C217 PolarHBondContact OG1-O 3Å; Y198-C217 PolarHBondContact O-N 2.82Å; C200-C217 VanDerWaalsContact CB-SG 3.57Å; C206-C217 WeakPolarHBondContact CA-SG 3.49Å; C206-C217 HydrophobicContact CB-CB 3.74Å; C206-C217 WeakPolarHBondContact CB-SG 3.2Å; C206-C217 VanDerWaalsContact SG-CA 3.53Å; C206-C217 WeakPolarHBondContact SG-CB 3.18Å; C206-C217 CovalentContact SG-SG 2.04Å; C206-C217 PolarHBondContact SG-SG 3.28Å; R211-C217 CarbonylContact O-C 3.5Å; R211-C217 WeakPolarHBondContact O-CA 3.35Å
218	W	87.9	Confident	79	Confident	31 Å²	31	78 Å²	78	12%	0.117	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.5	176.5	-74.8	59.8	0	0	0	110.5	F184 G193 K194 A195 Q210 R211 K213	F184-W218 HydrophobicContact CB-CB 4.28Å; F184-W218 HydrophobicContact CB-CE3 4.47Å; F184-W218 HydrophobicContact CB-CG 4.49Å; F184-W218 HydrophobicContact CD1-CB 4.13Å; F184-W218 HydrophobicContact CD1-CE3 4.41Å; F184-W218 HydrophobicContact CD2-CB 4.05Å; F184-W218 HydrophobicContact CE1-CB 4.49Å; F184-W218 HydrophobicContact CE2-CB 4.35Å; F184-W218 HydrophobicContact CG-CB 3.9Å; G193-W218 VanDerWaalsContact O-CZ3 3.32Å; G193-W218 WeakPolarHBondContact O-CZ3 3.28Å; K194-W218 CarbonylContact O-C 3.53Å; K194-W218 WeakPolarHBondContact O-CA 3.23Å; A195-W218 HydrophobicContact CB-CD2 4.29Å; A195-W218 HydrophobicContact CB-CZ2 4.12Å; Q210-W218 CarbonylContact C-O 3.54Å; Q210-W218 WeakPolarHBondContact CA-O 3.49Å; Q210-W218 WeakPolarHBondContact CB-O 3.33Å; R211-W218 PolarHBondContact N-O 3.23Å; R211-W218 PolarHBondContact O-N 3.26Å; K213-W218 HydrophobicContact CB-CG 4.15Å; K213-W218 HydrophobicContact CD-CD2 4.17Å; K213-W218 HydrophobicContact CD-CZ2 4.16Å; K213-W218 PolarHBondContact O-NE1 3.36Å
219	S	83.6	Confident	79.4	Confident	13 Å²	13	76.2 Å²	76.2	9%	0.091	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	148.9	176.5	62.5	0	0	0	0	111.3	G193 K194	G193-S219 CarbonylContact C-O 3.58Å; G193-S219 WeakPolarHBondContact CA-O 3.38Å; K194-S219 WeakPolarHBondContact CG-OG 3.37Å; K194-S219 PolarHBondContact N-O 2.04Å; K194-S219 PolarHBondContact O-N 2.94Å
220	L	78.6	Confident	79.6	Confident	14 Å²	14	74.8 Å²	74.8	7%	0.073	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	144.7	172.7	-64.4	168.3	0	0	0	111.5	F184 Y186 R191 E222	F184-L220 HydrophobicContact CE1-CD2 3.88Å; F184-L220 HydrophobicContact CE1-CG 4.44Å; F184-L220 HydrophobicContact CZ-CD2 3.77Å; F184-L220 HydrophobicContact CZ-CG 4.04Å; Y186-L220 HydrophobicContact CD1-CD1 4.28Å; Y186-L220 HydrophobicContact CD1-CD2 4.33Å; Y186-L220 HydrophobicContact CE1-CD1 4.1Å; Y186-L220 HydrophobicContact CG-CD2 4.26Å; R191-L220 HydrophobicContact CB-CD2 3.39Å; R191-L220 HydrophobicContact CG-CD2 3.83Å; L220-E222 PolarHBondContact O-N 2.96Å
221	L	63.2	Low	79.1	Confident	97 Å²	97	77.2 Å²	77.2	51%	0.508	37%	0.365	S	S	.	.			trans	-78.9	7.4	179.2	-96.2	159.1	0	0	0	114.6	E192 K194 R223	E192-L221 HydrophobicContact CB-CB 4.46Å; E192-L221 HydrophobicContact CB-CD1 3.95Å; E192-L221 PolarHBondContact O-N 2.88Å; K194-L221 HydrophobicContact CD-CD2 4.46Å; L221-R223 PolarHBondContact O-N 2.88Å
222	E	57.9	Low	78.4	Confident	126 Å²	126	74.8 Å²	74.8	59%	0.589	36%	0.357	S	S	*	.	S	Bend	trans	-63.2	135.2	175.4	-66.3	173.4	-177.5	0	0	109.6	L220 Q224	L220-E222 PolarHBondContact O-N 2.96Å; E222-Q224 WeakPolarHBondContact O-CG 3.1Å; E222-Q224 PolarHBondContact O-N 2.75Å
223	R	52.8	Low	77.5	Confident	234 Å²	234	74.5 Å²	74.5	88%	0.883	36%	0.355	S	S	*	.			trans	-62	87.3	170.6	-72	-176.3	-178.5	-174.2	0.5	107.9	L221 Q225	L221-R223 PolarHBondContact O-N 2.88Å; R223-Q225 PolarHBondContact O-N 3.43Å
224	Q	56.5	Low	76.7	Confident	74 Å²	74	75.9 Å²	75.9	35%	0.346	36%	0.363	S	S	.	.			trans	-72.1	125.3	-176	-70	-168	-0.9	0	0	108.5	E222 C226	E222-Q224 WeakPolarHBondContact O-CG 3.1Å; E222-Q224 PolarHBondContact O-N 2.75Å; Q224-C226 PolarHBondContact O-N 2.82Å
225	Q	66.8	Low	76.2	Confident	169 Å²	169	75.1 Å²	75.1	79%	0.79	36%	0.357	S	S	*	.	B	Isolated β-bridge	trans	-55.9	126.2	158.3	-77.8	175.6	-19.5	0	0	107.9	R223 D241	R223-Q225 PolarHBondContact O-N 3.43Å; Q225-D241 WeakPolarHBondContact CA-O 3.29Å
226	C	78.4	Confident	75.7	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.007	33%	0.325	C	S	.	.			trans	-111.9	143.3	176.8	57.8	0	0	0	0	108.9	Q224 D231 C238 D241 M242	Q224-C226 PolarHBondContact O-N 2.82Å; C226-D231 HydrophobicContact CB-CB 3.9Å; C226-C238 HydrophobicContact CB-CB 3.7Å; C226-C238 WeakPolarHBondContact CB-SG 3.4Å; C226-C238 PolarHBondContact O-SG 2.78Å; C226-C238 WeakPolarHBondContact SG-CA 3.27Å; C226-C238 WeakPolarHBondContact SG-CB 3.14Å; C226-C238 CovalentContact SG-SG 2.02Å; C226-C238 PolarHBondContact SG-SG 2.82Å; C226-D241 PolarHBondContact N-O 2.78Å; C226-D241 VanDerWaalsContact N-O 3.1Å; C226-M242 PolarHBondContact SG-N 2.8Å; C226-M242 VanDerWaalsContact SG-N 3.41Å
227	N	79.9	Confident	75.3	Confident	154 Å²	154	64.6 Å²	64.6	82%	0.824	31%	0.311	S	S	*	.	S	Bend	trans	-103.5	-11	172.7	-60.5	-74	0	0	0	111.4	D231	N227-D231 WeakPolarHBondContact CA-OD2 3.35Å; N227-D231 PolarHBondContact N-OD2 2.96Å
228	G	82.6	Confident	75	Confident	27 Å²	27	65.4 Å²	65.4	28%	0.278	32%	0.316	S	S	.	.	S	Bend	trans	-165.8	169.3	173.6	0	0	0	0	0	112.2	E230 D231 C238	G228-E230 PolarHBondContact O-N 3.22Å; G228-E230 VanDerWaalsContact O-N 3.16Å; G228-D231 PolarHBondContact N-OD2 3.44Å; G228-D231 WeakPolarHBondContact O-CB 3.4Å; G228-D231 PolarHBondContact O-N 3.02Å; G228-C238 WeakPolarHBondContact O-CB 3.2Å
229	H	84.7	Confident	74.4	Confident	35 Å²	35	66.6 Å²	66.6	16%	0.162	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-63.9	-23	-174.6	-52.4	-45.6	0	0	0	114.1	D231 C232 L237 C238 D256 A264 K266	H229-D231 PolarHBondContact O-N 3.36Å; H229-C232 PolarHBondContact O-N 2.82Å; H229-L237 HydrophobicContact CB-CD2 4.18Å; H229-C238 PolarHBondContact CE1-O 2.78Å; H229-C238 PolarHBondContact ND1-N 2.89Å; H229-C238 VanDerWaalsContact ND1-N 3.17Å; H229-C238 PolarHBondContact ND1-O 3.02Å; H229-D256 IonicContact NE2-OD1 2.84Å; H229-D256 IonicContact NE2-OD2 3.56Å; H229-A264 VanDerWaalsContact NE2-CB 3.3Å; H229-A264 WeakPolarHBondContact NE2-CB 3.16Å; H229-K266 HydrophobicContact CB-CB 4.33Å; H229-K266 HydrophobicContact CB-CD 4.16Å; H229-K266 HydrophobicContact CB-CG 4.16Å; H229-K266 WeakPolarHBondContact O-CE 3.29Å; H229-K266 PolarHBondContact O-NZ 3.07Å
230	E	79.5	Confident	73.8	Confident	96 Å²	96	74.6 Å²	74.6	45%	0.449	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-71.9	-15	175.9	-70.3	-63.4	135.7	0	0	113.7	K207 G228 C232 R267	K207-E230 IonicContact NZ-OE2 2.7Å; G228-E230 PolarHBondContact O-N 3.22Å; G228-E230 VanDerWaalsContact O-N 3.16Å; E230-C232 VanDerWaalsContact C-N 3.3Å; E230-R267 IonicContact OE1-NE 3.58Å
231	D	77.1	Confident	73.9	Confident	79 Å²	79	78.9 Å²	78.9	42%	0.422	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-77.9	-21.1	173.8	-59.9	-30.6	0	0	0	111.7	C226 N227 G228 H229	C226-D231 HydrophobicContact CB-CB 3.9Å; N227-D231 WeakPolarHBondContact CA-OD2 3.35Å; N227-D231 PolarHBondContact N-OD2 2.96Å; G228-D231 PolarHBondContact N-OD2 3.44Å; G228-D231 WeakPolarHBondContact O-CB 3.4Å; G228-D231 PolarHBondContact O-N 3.02Å; H229-D231 PolarHBondContact O-N 3.36Å
232	C	76.2	Confident	74.4	Confident	5 Å²	5	78.8 Å²	78.8	3%	0.034	38%	0.381	C	S	.	.	S	Bend	trans	-92.6	153	-177.1	-58.2	0	0	0	0	112.6	H229 E230 E236 C238 C243 K266	H229-C232 PolarHBondContact O-N 2.82Å; E230-C232 VanDerWaalsContact C-N 3.3Å; C232-E236 HydrophobicContact CB-CB 3.66Å; C232-C238 PolarHBondContact SG-N 2.94Å; C232-C243 WeakPolarHBondContact CA-SG 3.44Å; C232-C243 HydrophobicContact CB-CB 3.72Å; C232-C243 WeakPolarHBondContact CB-SG 3.18Å; C232-C243 WeakPolarHBondContact SG-CA 2.95Å; C232-C243 WeakPolarHBondContact SG-CB 3.24Å; C232-C243 CovalentContact SG-SG 2.04Å; C232-C243 PolarHBondContact SG-SG 3.06Å; C232-K266 PolarHBondContact O-NZ 2.94Å
233	A	73.1	Confident	75.2	Confident	11 Å²	11	74.4 Å²	74.4	9%	0.091	36%	0.364	C	S	.	.			trans	-58.7	165.4	177.3	0	0	0	0	0	111.9	K235 E236 K266	A233-K235 PolarHBondContact O-N 2.8Å; A233-E236 HydrophobicContact CB-CG 4.45Å; A233-E236 PolarHBondContact N-OE2 3.19Å; A233-E236 PolarHBondContact O-N 3.25Å; A233-K266 PolarHBondContact O-NZ 3.34Å
234	I	72.6	Confident	76.3	Confident	37 Å²	37	65.4 Å²	65.4	19%	0.19	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-46.2	-172.9	-71.5	176.5	0	0	0	112.2	T196 G197 Y198 E236 W271	T196-I234 WeakPolarHBondContact O-CB 3.24Å; T196-I234 WeakPolarHBondContact O-CD1 3.03Å; T196-I234 WeakPolarHBondContact O-CG1 3.47Å; G197-I234 WeakPolarHBondContact O-CD1 3.48Å; Y198-I234 HydrophobicContact CD1-CD1 3.58Å; Y198-I234 HydrophobicContact CD1-CG1 4.03Å; Y198-I234 HydrophobicContact CD2-CD1 4.19Å; Y198-I234 HydrophobicContact CD2-CG1 4.09Å; Y198-I234 HydrophobicContact CE1-CD1 3.36Å; Y198-I234 HydrophobicContact CE1-CG1 3.35Å; Y198-I234 HydrophobicContact CE2-CD1 4.07Å; Y198-I234 HydrophobicContact CE2-CG1 3.51Å; Y198-I234 HydrophobicContact CG-CD1 3.95Å; Y198-I234 HydrophobicContact CG-CG1 4.32Å; Y198-I234 WeakPolarHBondContact OH-CG1 3.23Å; I234-E236 VanDerWaalsContact C-N 3.26Å; I234-E236 PolarHBondContact O-N 2.62Å; I234-W271 HydrophobicContact CG2-CH2 3.89Å; I234-W271 WeakPolarHBondContact O-CH2 3.47Å; I234-W271 VanDerWaalsContact O-CZ3 3.3Å; I234-W271 WeakPolarHBondContact O-CZ3 3.03Å
235	K	76.7	Confident	77.1	Confident	136 Å²	136	64.8 Å²	64.8	59%	0.591	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	29.6	-174.8	-58.9	-174.3	178	-176.3	0	114.1	A233 M245 A246	A233-K235 PolarHBondContact O-N 2.8Å; K235-M245 HydrophobicContact CB-CE 4.01Å; K235-M245 CarbonylContact O-C 3.6Å; K235-M245 WeakPolarHBondContact O-CA 3.45Å; K235-A246 CarbonylContact C-O 3.46Å; K235-A246 PolarHBondContact O-N 2.81Å; K235-A246 VanDerWaalsContact O-O 3.06Å
236	E	79.9	Confident	77.8	Confident	18 Å²	18	56.9 Å²	56.9	8%	0.084	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	143.6	-174.9	-67.8	176.3	170.3	0	0	112.7	K194 C232 A233 I234 C243 T244 M245 K266	K194-E236 IonicContact NZ-OE1 3.03Å; K194-E236 PolarHBondContact NZ-OE1 3.48Å; K194-E236 IonicContact NZ-OE2 3.73Å; K194-E236 PolarHBondContact NZ-OE2 2.74Å; C232-E236 HydrophobicContact CB-CB 3.66Å; A233-E236 HydrophobicContact CB-CG 4.45Å; A233-E236 PolarHBondContact N-OE2 3.19Å; A233-E236 PolarHBondContact O-N 3.25Å; I234-E236 VanDerWaalsContact C-N 3.26Å; I234-E236 PolarHBondContact O-N 2.62Å; E236-C243 HydrophobicContact CB-CB 4.33Å; E236-T244 CarbonylContact C-O 3.44Å; E236-T244 WeakPolarHBondContact CA-O 3.23Å; E236-T244 VanDerWaalsContact CB-O 3.26Å; E236-T244 WeakPolarHBondContact CB-O 3.2Å; E236-M245 HydrophobicContact CG-SD 3.66Å; E236-K266 WeakPolarHBondContact O-CD 3Å; E236-K266 PolarHBondContact O-NZ 2.03Å
237	L	82.8	Confident	78.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	134.6	170.2	-75.2	175.7	0	0	0	110.2	H229 M239 T244 A246 A264 K266 W271	H229-L237 HydrophobicContact CB-CD2 4.18Å; L237-M239 HydrophobicContact CB-CE 3.86Å; L237-M239 HydrophobicContact CB-CG 4.25Å; L237-M239 HydrophobicContact CD1-CE 3.48Å; L237-M239 VanDerWaalsContact CD1-CE 3.48Å; L237-M239 HydrophobicContact CG-CE 4.36Å; L237-M239 PolarHBondContact O-N 3.15Å; L237-T244 PolarHBondContact N-O 3.06Å; L237-T244 PolarHBondContact O-N 3.23Å; L237-T244 PolarHBondContact O-OG1 3.27Å; L237-A246 HydrophobicContact CB-CB 4.05Å; L237-A246 HydrophobicContact CD1-CB 3.72Å; L237-A246 HydrophobicContact CG-CB 3.54Å; L237-A264 HydrophobicContact CD1-CB 3.91Å; L237-A264 HydrophobicContact CD2-CB 3.87Å; L237-A264 HydrophobicContact CG-CB 4.47Å; L237-K266 HydrophobicContact CD2-CB 3.98Å; L237-K266 HydrophobicContact CD2-CD 4.29Å; L237-W271 HydrophobicContact CD1-CB 3.71Å; L237-W271 WeakPolarHBondContact CD1-O 3.34Å; L237-W271 HydrophobicContact CD2-CB 3.98Å; L237-W271 HydrophobicContact CG-CB 3.92Å
238	C	83.7	Confident	78.4	Confident	16 Å²	16	56.4 Å²	56.4	11%	0.108	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	114.8	166.1	-171.2	0	0	0	0	110.3	C226 G228 H229 C232	C226-C238 HydrophobicContact CB-CB 3.7Å; C226-C238 WeakPolarHBondContact CB-SG 3.4Å; C226-C238 PolarHBondContact O-SG 2.78Å; C226-C238 WeakPolarHBondContact SG-CA 3.27Å; C226-C238 WeakPolarHBondContact SG-CB 3.14Å; C226-C238 CovalentContact SG-SG 2.02Å; C226-C238 PolarHBondContact SG-SG 2.82Å; G228-C238 WeakPolarHBondContact O-CB 3.2Å; H229-C238 PolarHBondContact CE1-O 2.78Å; H229-C238 PolarHBondContact ND1-N 2.89Å; H229-C238 VanDerWaalsContact ND1-N 3.17Å; H229-C238 PolarHBondContact ND1-O 3.02Å; C232-C238 PolarHBondContact SG-N 2.94Å
239	M	76	Confident	78.6	Confident	57 Å²	57	56.1 Å²	56.1	28%	0.281	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	127.5	176.4	-62.3	-167.3	175	0	0	108.5	L237 D241 M242 T244 P273	L237-M239 HydrophobicContact CB-CE 3.86Å; L237-M239 HydrophobicContact CB-CG 4.25Å; L237-M239 HydrophobicContact CD1-CE 3.48Å; L237-M239 VanDerWaalsContact CD1-CE 3.48Å; L237-M239 HydrophobicContact CG-CE 4.36Å; L237-M239 PolarHBondContact O-N 3.15Å; M239-D241 VanDerWaalsContact C-N 3.28Å; M239-D241 PolarHBondContact O-N 2.77Å; M239-M242 PolarHBondContact N-O 2.81Å; M239-M242 PolarHBondContact O-N 3.29Å; M239-T244 HydrophobicContact CB-CG2 4.09Å; M239-P273 HydrophobicContact CE-CB 3.74Å; M239-P273 HydrophobicContact CE-CG 3.5Å; M239-P273 HydrophobicContact SD-CB 4.05Å; M239-P273 HydrophobicContact SD-CG 4.04Å
240	E	71.6	Confident	78.5	Confident	180 Å²	180	63.9 Å²	63.9	84%	0.841	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	48.4	-179.1	-59	-178.6	173.2	0	0	112.7	M242	E240-M242 PolarHBondContact O-N 3.26Å; E240-M242 VanDerWaalsContact O-N 3.15Å
241	D	79.3	Confident	78.8	Confident	105 Å²	105	63.9 Å²	63.9	56%	0.561	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	15.7	-177.5	-52.4	-41.5	0	0	0	115.1	Q225 C226 M239	Q225-D241 WeakPolarHBondContact CA-O 3.29Å; C226-D241 PolarHBondContact N-O 2.78Å; C226-D241 VanDerWaalsContact N-O 3.1Å; M239-D241 VanDerWaalsContact C-N 3.28Å; M239-D241 PolarHBondContact O-N 2.77Å
242	M	73.8	Confident	79.5	Confident	94 Å²	94	70.8 Å²	70.8	46%	0.463	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.6	176.1	-72.5	-173.4	-70.9	0	0	112.9	C226 M239 E240 T244	C226-M242 PolarHBondContact SG-N 2.8Å; C226-M242 VanDerWaalsContact SG-N 3.41Å; M239-M242 PolarHBondContact N-O 2.81Å; M239-M242 PolarHBondContact O-N 3.29Å; E240-M242 PolarHBondContact O-N 3.26Å; E240-M242 VanDerWaalsContact O-N 3.15Å; M242-T244 PolarHBondContact O-N 2.8Å
243	C	76.1	Confident	80.3	Confident	34 Å²	34	70.8 Å²	70.8	23%	0.23	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	112.1	172.3	-65	0	0	0	0	111	C232 E236	C232-C243 WeakPolarHBondContact CA-SG 3.44Å; C232-C243 HydrophobicContact CB-CB 3.72Å; C232-C243 WeakPolarHBondContact CB-SG 3.18Å; C232-C243 WeakPolarHBondContact SG-CA 2.95Å; C232-C243 WeakPolarHBondContact SG-CB 3.24Å; C232-C243 CovalentContact SG-SG 2.04Å; C232-C243 PolarHBondContact SG-SG 3.06Å; E236-C243 HydrophobicContact CB-CB 4.33Å
244	T	74.6	Confident	81	Confident	45 Å²	45	77.1 Å²	77.1	28%	0.276	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	145.7	177.4	59.9	0	0	0	0	110.5	E236 L237 M239 M242	E236-T244 CarbonylContact C-O 3.44Å; E236-T244 WeakPolarHBondContact CA-O 3.23Å; E236-T244 VanDerWaalsContact CB-O 3.26Å; E236-T244 WeakPolarHBondContact CB-O 3.2Å; L237-T244 PolarHBondContact N-O 3.06Å; L237-T244 PolarHBondContact O-N 3.23Å; L237-T244 PolarHBondContact O-OG1 3.27Å; M239-T244 HydrophobicContact CB-CG2 4.09Å; M242-T244 PolarHBondContact O-N 2.8Å
245	M	73.9	Confident	81.7	Confident	62 Å²	62	78.6 Å²	78.6	31%	0.305	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	139.3	176.5	-70.7	-65.7	-67.3	0	0	111	K235 E236 P273 V274	K235-M245 HydrophobicContact CB-CE 4.01Å; K235-M245 CarbonylContact O-C 3.6Å; K235-M245 WeakPolarHBondContact O-CA 3.45Å; E236-M245 HydrophobicContact CG-SD 3.66Å; M245-P273 CarbonylContact O-C 3.54Å; M245-P273 VanDerWaalsContact O-CA 3.3Å; M245-P273 WeakPolarHBondContact O-CA 3.33Å; M245-V274 HydrophobicContact CB-CB 4.23Å; M245-V274 HydrophobicContact CB-CG2 4.34Å; M245-V274 PolarHBondContact O-N 3.29Å
246	A	81.4	Confident	82.1	Confident	2 Å²	2	75.7 Å²	75.7	2%	0.017	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	153.1	-179.1	0	0	0	0	0	111.4	K235 L237 W271 K272	K235-A246 CarbonylContact C-O 3.46Å; K235-A246 PolarHBondContact O-N 2.81Å; K235-A246 VanDerWaalsContact O-O 3.06Å; L237-A246 HydrophobicContact CB-CB 4.05Å; L237-A246 HydrophobicContact CD1-CB 3.72Å; L237-A246 HydrophobicContact CG-CB 3.54Å; A246-W271 HydrophobicContact CB-CB 4.18Å; A246-W271 HydrophobicContact CB-CE3 4.13Å; A246-W271 WeakPolarHBondContact O-CZ3 3.03Å; A246-K272 CarbonylContact C-O 3.47Å; A246-K272 WeakPolarHBondContact CA-O 3.32Å; A246-K272 WeakPolarHBondContact CB-O 3.03Å
247	E	83.9	Confident	82.3	Confident	83 Å²	83	82 Å²	82	39%	0.388	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	145.7	175.6	60.8	178.7	176.3	0	0	111.3	W271 K272 V274	E247-W271 CarbonylContact O-C 3.59Å; E247-W271 VanDerWaalsContact O-CA 3.25Å; E247-W271 WeakPolarHBondContact O-CA 3.45Å; E247-K272 HydrophobicContact CG-CD 4.17Å; E247-K272 HydrophobicContact CG-CG 3.6Å; E247-K272 PolarHBondContact N-O 3.07Å; E247-K272 PolarHBondContact O-N 3.47Å; E247-K272 WeakPolarHBondContact OE1-CE 3.12Å; E247-K272 IonicContact OE1-NZ 3.3Å; E247-K272 PolarHBondContact OE1-NZ 2.98Å; E247-V274 HydrophobicContact CB-CG2 4.18Å; E247-V274 HydrophobicContact CG-CG2 4.26Å
248	P	88	Confident	82.6	Confident	63 Å²	63	85.9 Å²	85.9	41%	0.409	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	143.6	179.6	30.4	-31.8	0	0	0	110.4	Q269 W271	P248-Q269 HydrophobicContact CB-CG 4.16Å; P248-W271 HydrophobicContact CB-CD2 4.07Å; P248-W271 HydrophobicContact CB-CE3 4.31Å; P248-W271 HydrophobicContact CB-CH2 4.17Å; P248-W271 HydrophobicContact CB-CZ2 3.94Å; P248-W271 HydrophobicContact CB-CZ3 4.34Å; P248-W271 VanDerWaalsContact CD-CZ3 3.49Å; P248-W271 HydrophobicContact CG-CH2 4.12Å; P248-W271 HydrophobicContact CG-CZ2 4.36Å; P248-W271 HydrophobicContact CG-CZ3 4.25Å
249	T	85.8	Confident	82.7	Confident	20 Å²	20	85.9 Å²	85.9	12%	0.123	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	170.1	170.8	68.9	0	0	0	0	110.5	E251 Q269 C270 K272	T249-E251 PolarHBondContact O-N 2.73Å; T249-E251 PolarHBondContact OG1-N 2.82Å; T249-Q269 VanDerWaalsContact O-CG 3.24Å; T249-Q269 WeakPolarHBondContact O-CG 3.17Å; T249-Q269 PolarHBondContact O-NE2 3.37Å; T249-C270 WeakPolarHBondContact CB-O 3.42Å; T249-C270 PolarHBondContact N-O 3.04Å; T249-C270 VanDerWaalsContact OG1-CB 3.23Å; T249-C270 WeakPolarHBondContact OG1-CB 2.91Å; T249-C270 PolarHBondContact OG1-O 3.34Å; T249-K272 HydrophobicContact CG2-CB 4.27Å; T249-K272 HydrophobicContact CG2-CD 4.24Å; T249-K272 HydrophobicContact CG2-CG 3.9Å
250	E	83.7	Confident	82.9	Confident	198 Å²	198	85 Å²	85	93%	0.925	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	-12.7	176	-61	-170.2	169	0	0	113
251	E	85.5	Confident	82.9	Confident	97 Å²	97	82.3 Å²	82.3	45%	0.453	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	135.4	-174.8	-62.8	-176.3	-165.6	0	0	111.8	T249 P260 Q269 C270	T249-E251 PolarHBondContact O-N 2.73Å; T249-E251 PolarHBondContact OG1-N 2.82Å; E251-P260 WeakPolarHBondContact OE2-CD 3.33Å; E251-P260 WeakPolarHBondContact OE2-CG 2.93Å; E251-Q269 WeakPolarHBondContact O-CA 3.23Å; E251-C270 HydrophobicContact CB-CB 4.24Å; E251-C270 PolarHBondContact O-N 3.16Å
252	R	91	Very high	82.3	Confident	224 Å²	224	88.3 Å²	88.3	85%	0.845	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	147.3	173.3	-65	-173.6	-178.6	-153.9	0.6	110.1	N268	R252-N268 VanDerWaalsContact CA-O 3.3Å; R252-N268 WeakPolarHBondContact CA-O 3.01Å; R252-N268 WeakPolarHBondContact CB-O 3.48Å
253	C	92.3	Very high	82.8	Confident	5 Å²	5	85.9 Å²	85.9	3%	0.034	43%	0.431	C	S	.	.			trans	-139.7	163.8	-179.8	56.6	0	0	0	0	111.3	N258 C259 C265 N268 Q269 C270	C253-N258 HydrophobicContact CB-CB 3.81Å; C253-C259 VanDerWaalsContact CB-SG 3.58Å; C253-C265 HydrophobicContact CB-CB 3.68Å; C253-C265 WeakPolarHBondContact CB-SG 3.49Å; C253-C265 WeakPolarHBondContact SG-CA 2.99Å; C253-C265 WeakPolarHBondContact SG-CB 3.21Å; C253-C265 CovalentContact SG-SG 2.02Å; C253-C265 PolarHBondContact SG-SG 3.5Å; C253-N268 PolarHBondContact N-O 3.24Å; C253-N268 CarbonylContact O-C 3.57Å; C253-N268 WeakPolarHBondContact O-CA 3.33Å; C253-Q269 PolarHBondContact SG-N 3.27Å; C253-Q269 VanDerWaalsContact SG-N 3.38Å; C253-Q269 PolarHBondContact SG-O 2.02Å; C253-C270 VanDerWaalsContact CB-SG 3.51Å
254	L	88.5	Confident	83.3	Confident	143 Å²	143	84.6 Å²	84.6	75%	0.749	42%	0.423	S	S	*	.	S	Bend	trans	-114.1	-33.9	165.8	-64.2	173.6	0	0	0	110.6	N258	L254-N258 PolarHBondContact N-OD1 3.28Å
255	T	87.3	Confident	84.1	Confident	68 Å²	68	83.2 Å²	83.2	42%	0.417	42%	0.415	S	S	.	.	S	Bend	trans	-135.1	166.7	174.9	64	0	0	0	0	110.2	D257 N258 C265	T255-D257 PolarHBondContact O-N 3.15Å; T255-N258 PolarHBondContact N-OD1 2.91Å; T255-N258 WeakPolarHBondContact O-CB 3.49Å; T255-N258 PolarHBondContact O-N 2.93Å; T255-N258 PolarHBondContact O-OD1 2.85Å; T255-C265 WeakPolarHBondContact O-CB 3.47Å
256	D	85	Confident	84.7	Confident	75 Å²	75	80.4 Å²	80.4	40%	0.401	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-58.5	-30.3	178.9	-59.7	-22.4	0	0	0	112.4	H229 N258 C259 C265	H229-D256 IonicContact NE2-OD1 2.84Å; H229-D256 IonicContact NE2-OD2 3.56Å; D256-N258 PolarHBondContact O-N 3.41Å; D256-C259 WeakPolarHBondContact O-CB 3.24Å; D256-C259 PolarHBondContact O-N 2.78Å; D256-C265 WeakPolarHBondContact OD1-CA 3.16Å; D256-C265 WeakPolarHBondContact OD1-CB 3.14Å; D256-C265 PolarHBondContact OD1-N 3.37Å
257	D	84.8	Confident	84.9	Confident	150 Å²	150	85.6 Å²	85.6	80%	0.802	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-64.2	-18.1	177.3	-56	-46	0	0	0	113.8	T255 C259	T255-D257 PolarHBondContact O-N 3.15Å; D257-C259 VanDerWaalsContact C-N 3.26Å
258	N	88.9	Confident	85.1	Confident	82 Å²	82	86.5 Å²	86.5	44%	0.439	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-82.4	-9.1	174.3	-53.9	138.9	0	0	0	112.5	C253 L254 T255 D256	C253-N258 HydrophobicContact CB-CB 3.81Å; L254-N258 PolarHBondContact N-OD1 3.28Å; T255-N258 PolarHBondContact N-OD1 2.91Å; T255-N258 WeakPolarHBondContact O-CB 3.49Å; T255-N258 PolarHBondContact O-N 2.93Å; T255-N258 PolarHBondContact O-OD1 2.85Å; D256-N258 PolarHBondContact O-N 3.41Å
259	C	85.8	Confident	85.3	Confident	16 Å²	16	87 Å²	87	11%	0.108	43%	0.425	C	S	.	.	S	Bend	trans	-95.8	148.2	-178.7	-59.7	0	0	0	0	111.2	C253 D256 D257 Q263 C270	C253-C259 VanDerWaalsContact CB-SG 3.58Å; D256-C259 WeakPolarHBondContact O-CB 3.24Å; D256-C259 PolarHBondContact O-N 2.78Å; D257-C259 VanDerWaalsContact C-N 3.26Å; C259-Q263 HydrophobicContact CB-CB 3.75Å; C259-C270 WeakPolarHBondContact CA-SG 3.21Å; C259-C270 HydrophobicContact CB-CB 3.76Å; C259-C270 WeakPolarHBondContact CB-SG 2.9Å; C259-C270 WeakPolarHBondContact SG-CA 3.48Å; C259-C270 WeakPolarHBondContact SG-CB 3.41Å; C259-C270 CovalentContact SG-SG 2.04Å; C259-C270 PolarHBondContact SG-SG 3.44Å
260	P	79.7	Confident	85.6	Confident	38 Å²	38	86 Å²	86	25%	0.247	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-55	157.5	172.6	-25.6	33.2	0	0	0	111.7	E251 R262 Q263	E251-P260 WeakPolarHBondContact OE2-CD 3.33Å; E251-P260 WeakPolarHBondContact OE2-CG 2.93Å; P260-R262 PolarHBondContact O-N 3.1Å; P260-Q263 HydrophobicContact CB-CG 4.45Å; P260-Q263 VanDerWaalsContact O-CB 3.32Å; P260-Q263 WeakPolarHBondContact O-CB 3.44Å; P260-Q263 PolarHBondContact O-N 3.3Å
261	P	71.7	Confident	85.9	Confident	125 Å²	125	77.4 Å²	77.4	81%	0.812	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	135.8	-179.9	-27	34.2	0	0	0	112.7	Q263	P261-Q263 VanDerWaalsContact C-N 3.29Å; P261-Q263 PolarHBondContact O-N 3.37Å
262	R	66.6	Low	85.9	Confident	230 Å²	230	77 Å²	77	87%	0.868	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	12.1	-176.9	-52.1	-179.6	173.2	-173.8	-2.8	116.2	P260 P273	P260-R262 PolarHBondContact O-N 3.1Å; R262-P273 WeakPolarHBondContact O-CD 3.24Å
263	Q	85.4	Confident	85.3	Confident	43 Å²	43	68.4 Å²	68.4	20%	0.201	35%	0.348	C	S	.	.			trans	-105.7	164.8	168.9	-57.9	-172.7	22.9	0	0	109.9	C259 P260 P261 W271 K272	C259-Q263 HydrophobicContact CB-CB 3.75Å; P260-Q263 HydrophobicContact CB-CG 4.45Å; P260-Q263 VanDerWaalsContact O-CB 3.32Å; P260-Q263 WeakPolarHBondContact O-CB 3.44Å; P260-Q263 PolarHBondContact O-N 3.3Å; P261-Q263 VanDerWaalsContact C-N 3.29Å; P261-Q263 PolarHBondContact O-N 3.37Å; Q263-W271 CarbonylContact C-O 3.52Å; Q263-W271 VanDerWaalsContact CA-O 3.23Å; Q263-W271 WeakPolarHBondContact CA-O 3.48Å; Q263-W271 VanDerWaalsContact CB-O 3.27Å; Q263-W271 WeakPolarHBondContact CB-O 3.46Å; Q263-K272 HydrophobicContact CG-CB 3.96Å
264	A	86.3	Confident	84.1	Confident	7 Å²	7	70.7 Å²	70.7	6%	0.058	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	151.6	175.4	0	0	0	0	0	111.8	H229 L237 K266 W271	H229-A264 VanDerWaalsContact NE2-CB 3.3Å; H229-A264 WeakPolarHBondContact NE2-CB 3.16Å; L237-A264 HydrophobicContact CD1-CB 3.91Å; L237-A264 HydrophobicContact CD2-CB 3.87Å; L237-A264 HydrophobicContact CG-CB 4.47Å; A264-K266 PolarHBondContact O-N 2.97Å; A264-W271 PolarHBondContact N-O 2.8Å; A264-W271 PolarHBondContact O-N 2.01Å
265	C	90.4	Very high	82.6	Confident	17 Å²	17	70 Å²	70	12%	0.115	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	112	-177.7	-169.5	0	0	0	0	110.3	C253 T255 D256	C253-C265 HydrophobicContact CB-CB 3.68Å; C253-C265 WeakPolarHBondContact CB-SG 3.49Å; C253-C265 WeakPolarHBondContact SG-CA 2.99Å; C253-C265 WeakPolarHBondContact SG-CB 3.21Å; C253-C265 CovalentContact SG-SG 2.02Å; C253-C265 PolarHBondContact SG-SG 3.5Å; T255-C265 WeakPolarHBondContact O-CB 3.47Å; D256-C265 WeakPolarHBondContact OD1-CA 3.16Å; D256-C265 WeakPolarHBondContact OD1-CB 3.14Å; D256-C265 PolarHBondContact OD1-N 3.37Å
266	K	87.9	Confident	80.7	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.009	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	115.6	172	-173.7	-179.8	-171.5	168.8	0	108.9	H229 C232 A233 E236 L237 A264 Q269 W271	H229-K266 HydrophobicContact CB-CB 4.33Å; H229-K266 HydrophobicContact CB-CD 4.16Å; H229-K266 HydrophobicContact CB-CG 4.16Å; H229-K266 WeakPolarHBondContact O-CE 3.29Å; H229-K266 PolarHBondContact O-NZ 3.07Å; C232-K266 PolarHBondContact O-NZ 2.94Å; A233-K266 PolarHBondContact O-NZ 3.34Å; E236-K266 WeakPolarHBondContact O-CD 3Å; E236-K266 PolarHBondContact O-NZ 2.03Å; L237-K266 HydrophobicContact CD2-CB 3.98Å; L237-K266 HydrophobicContact CD2-CD 4.29Å; A264-K266 PolarHBondContact O-N 2.97Å; K266-Q269 PolarHBondContact N-O 2.78Å; K266-Q269 PolarHBondContact O-N 2.04Å; K266-Q269 VanDerWaalsContact O-O 3.04Å; K266-W271 HydrophobicContact CB-CG 4.17Å; K266-W271 PolarHBondContact O-NE1 2.98Å
267	R	84.7	Confident	79.1	Confident	111 Å²	111	75.3 Å²	75.3	42%	0.419	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	46.5	176.8	-59.7	164.5	159.3	-131.9	-13.9	114.3	Y198 E230 Q269	Y198-R267 VanDerWaalsContact CE1-CZ 3.48Å; Y198-R267 VanDerWaalsContact CE1-NH1 3.28Å; Y198-R267 PolarHBondContact OH-NH1 3.23Å; Y198-R267 PolarHBondContact OH-NH2 3.08Å; E230-R267 IonicContact OE1-NE 3.58Å; R267-Q269 PolarHBondContact O-N 3.49Å
268	N	89	Confident	77.7	Confident	103 Å²	103	77 Å²	77	55%	0.551	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	19.2	179.3	-45.5	-69.6	0	0	0	115.1	R252 C253	R252-N268 VanDerWaalsContact CA-O 3.3Å; R252-N268 WeakPolarHBondContact CA-O 3.01Å; R252-N268 WeakPolarHBondContact CB-O 3.48Å; C253-N268 PolarHBondContact N-O 3.24Å; C253-N268 CarbonylContact O-C 3.57Å; C253-N268 WeakPolarHBondContact O-CA 3.33Å
269	Q	91.2	Very high	76.5	Confident	73 Å²	73	80 Å²	80	34%	0.341	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	139.8	175.7	-168.5	164.6	28.2	0	0	107.8	P248 T249 E251 C253 K266 R267	P248-Q269 HydrophobicContact CB-CG 4.16Å; T249-Q269 VanDerWaalsContact O-CG 3.24Å; T249-Q269 WeakPolarHBondContact O-CG 3.17Å; T249-Q269 PolarHBondContact O-NE2 3.37Å; E251-Q269 WeakPolarHBondContact O-CA 3.23Å; C253-Q269 PolarHBondContact SG-N 3.27Å; C253-Q269 VanDerWaalsContact SG-N 3.38Å; C253-Q269 PolarHBondContact SG-O 2.02Å; K266-Q269 PolarHBondContact N-O 2.78Å; K266-Q269 PolarHBondContact O-N 2.04Å; K266-Q269 VanDerWaalsContact O-O 3.04Å; R267-Q269 PolarHBondContact O-N 3.49Å
270	C	91.8	Very high	76	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.8	174.5	-68.6	0	0	0	0	108.9	T249 E251 C253 C259	T249-C270 WeakPolarHBondContact CB-O 3.42Å; T249-C270 PolarHBondContact N-O 3.04Å; T249-C270 VanDerWaalsContact OG1-CB 3.23Å; T249-C270 WeakPolarHBondContact OG1-CB 2.91Å; T249-C270 PolarHBondContact OG1-O 3.34Å; E251-C270 HydrophobicContact CB-CB 4.24Å; E251-C270 PolarHBondContact O-N 3.16Å; C253-C270 VanDerWaalsContact CB-SG 3.51Å; C259-C270 WeakPolarHBondContact CA-SG 3.21Å; C259-C270 HydrophobicContact CB-CB 3.76Å; C259-C270 WeakPolarHBondContact CB-SG 2.9Å; C259-C270 WeakPolarHBondContact SG-CA 3.48Å; C259-C270 WeakPolarHBondContact SG-CB 3.41Å; C259-C270 CovalentContact SG-SG 2.04Å; C259-C270 PolarHBondContact SG-SG 3.44Å
271	W	90.7	Very high	76.1	Confident	16 Å²	16	83.1 Å²	83.1	6%	0.061	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.9	176	-69.6	66.5	0	0	0	108.6	I234 L237 A246 E247 P248 Q263 A264 K266	I234-W271 HydrophobicContact CG2-CH2 3.89Å; I234-W271 WeakPolarHBondContact O-CH2 3.47Å; I234-W271 VanDerWaalsContact O-CZ3 3.3Å; I234-W271 WeakPolarHBondContact O-CZ3 3.03Å; L237-W271 HydrophobicContact CD1-CB 3.71Å; L237-W271 WeakPolarHBondContact CD1-O 3.34Å; L237-W271 HydrophobicContact CD2-CB 3.98Å; L237-W271 HydrophobicContact CG-CB 3.92Å; A246-W271 HydrophobicContact CB-CB 4.18Å; A246-W271 HydrophobicContact CB-CE3 4.13Å; A246-W271 WeakPolarHBondContact O-CZ3 3.03Å; E247-W271 CarbonylContact O-C 3.59Å; E247-W271 VanDerWaalsContact O-CA 3.25Å; E247-W271 WeakPolarHBondContact O-CA 3.45Å; P248-W271 HydrophobicContact CB-CD2 4.07Å; P248-W271 HydrophobicContact CB-CE3 4.31Å; P248-W271 HydrophobicContact CB-CH2 4.17Å; P248-W271 HydrophobicContact CB-CZ2 3.94Å; P248-W271 HydrophobicContact CB-CZ3 4.34Å; P248-W271 VanDerWaalsContact CD-CZ3 3.49Å; P248-W271 HydrophobicContact CG-CH2 4.12Å; P248-W271 HydrophobicContact CG-CZ2 4.36Å; P248-W271 HydrophobicContact CG-CZ3 4.25Å; Q263-W271 CarbonylContact C-O 3.52Å; Q263-W271 VanDerWaalsContact CA-O 3.23Å; Q263-W271 WeakPolarHBondContact CA-O 3.48Å; Q263-W271 VanDerWaalsContact CB-O 3.27Å; Q263-W271 WeakPolarHBondContact CB-O 3.46Å; A264-W271 PolarHBondContact N-O 2.8Å; A264-W271 PolarHBondContact O-N 2.01Å; K266-W271 HydrophobicContact CB-CG 4.17Å; K266-W271 PolarHBondContact O-NE1 2.98Å
272	K	85.3	Confident	76.7	Confident	88 Å²	88	80.3 Å²	80.3	38%	0.383	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.4	171.5	54.5	173.9	159.7	141.5	0	109.2	A246 E247 T249 Q263 V274	A246-K272 CarbonylContact C-O 3.47Å; A246-K272 WeakPolarHBondContact CA-O 3.32Å; A246-K272 WeakPolarHBondContact CB-O 3.03Å; E247-K272 HydrophobicContact CG-CD 4.17Å; E247-K272 HydrophobicContact CG-CG 3.6Å; E247-K272 PolarHBondContact N-O 3.07Å; E247-K272 PolarHBondContact O-N 3.47Å; E247-K272 WeakPolarHBondContact OE1-CE 3.12Å; E247-K272 IonicContact OE1-NZ 3.3Å; E247-K272 PolarHBondContact OE1-NZ 2.98Å; T249-K272 HydrophobicContact CG2-CB 4.27Å; T249-K272 HydrophobicContact CG2-CD 4.24Å; T249-K272 HydrophobicContact CG2-CG 3.9Å; Q263-K272 HydrophobicContact CG-CB 3.96Å; K272-V274 PolarHBondContact O-N 3.3Å
273	P	77.4	Confident	77.4	Confident	44 Å²	44	71.8 Å²	71.8	29%	0.286	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	136.5	171.9	21.6	-28.6	0	0	0	109.5	M239 M245 R262 D275	M239-P273 HydrophobicContact CE-CB 3.74Å; M239-P273 HydrophobicContact CE-CG 3.5Å; M239-P273 HydrophobicContact SD-CB 4.05Å; M239-P273 HydrophobicContact SD-CG 4.04Å; M245-P273 CarbonylContact O-C 3.54Å; M245-P273 VanDerWaalsContact O-CA 3.3Å; M245-P273 WeakPolarHBondContact O-CA 3.33Å; R262-P273 WeakPolarHBondContact O-CD 3.24Å; P273-D275 PolarHBondContact O-N 3.36Å
274	V	67.8	Low	77.2	Confident	54 Å²	54	75.6 Å²	75.6	33%	0.327	38%	0.375	S	S	.	.			trans	-70.7	112.6	175.6	179.3	0	0	0	0	106.5	M245 E247 K272 N276	M245-V274 HydrophobicContact CB-CB 4.23Å; M245-V274 HydrophobicContact CB-CG2 4.34Å; M245-V274 PolarHBondContact O-N 3.29Å; E247-V274 HydrophobicContact CB-CG2 4.18Å; E247-V274 HydrophobicContact CG-CG2 4.26Å; K272-V274 PolarHBondContact O-N 3.3Å; V274-N276 VanDerWaalsContact C-N 3.29Å; V274-N276 PolarHBondContact O-N 2.65Å
275	D	57.4	Low	76.7	Confident	128 Å²	128	79.3 Å²	79.3	68%	0.684	39%	0.394	S	S	*	.			trans	-70.8	90	172.7	-162.3	-2.8	0	0	0	107.7	P273 Q277	P273-D275 PolarHBondContact O-N 3.36Å; D275-Q277 PolarHBondContact O-N 2.88Å
276	N	48.1	Very low	76	Confident	118 Å²	118	78.8 Å²	78.8	63%	0.631	39%	0.39	S	S	*	.			trans	-64.1	10.9	177.8	-97.3	4.7	0	0	0	113	V274	V274-N276 VanDerWaalsContact C-N 3.29Å; V274-N276 PolarHBondContact O-N 2.65Å
277	Q	51	Low	75.1	Confident	137 Å²	137	85.7 Å²	85.7	64%	0.64	42%	0.417	S	S	*	.	S	Bend	trans	-139.8	99.2	179.7	-63.4	-175.9	-3.2	0	0	110.2	D275	D275-Q277 PolarHBondContact O-N 2.88Å
278	R	55.3	Low	74.8	Confident	185 Å²	185	83.4 Å²	83.4	70%	0.698	41%	0.414	S	S	*	.	S	Bend	trans	141	124.5	141	-74	154.8	-167.9	-132.4	2.4	113.3
279	F	62.4	Low	74.5	Confident	145 Å²	145	81.2 Å²	81.2	64%	0.636	40%	0.398	S	S	*	.			trans	79.7	109.8	173.7	-48.8	-70.7	0	0	0	115.9	D295	F279-D295 WeakPolarHBondContact CA-O 3.23Å; F279-D295 HydrophobicContact CD1-CB 3.93Å; F279-D295 PolarHBondContact N-O 2.68Å
280	C	76.9	Confident	73.9	Confident	2 Å²	2	79.7 Å²	79.7	1%	0.014	39%	0.392	C	S	.	.			trans	-124.9	156	165	60.6	0	0	0	0	107.8	D285 C292 D295 R296	C280-D285 HydrophobicContact CB-CB 3.78Å; C280-C292 HydrophobicContact CB-CB 3.64Å; C280-C292 WeakPolarHBondContact CB-SG 2.91Å; C280-C292 PolarHBondContact O-SG 3.23Å; C280-C292 WeakPolarHBondContact SG-CA 3.45Å; C280-C292 WeakPolarHBondContact SG-CB 3.49Å; C280-C292 CovalentContact SG-SG 2.01Å; C280-C292 PolarHBondContact SG-SG 2.96Å; C280-D295 PolarHBondContact N-O 3.33Å; C280-D295 VanDerWaalsContact O-CA 3.24Å; C280-D295 WeakPolarHBondContact O-CA 3.28Å; C280-D295 VanDerWaalsContact SG-C 3.53Å; C280-R296 PolarHBondContact SG-N 2.84Å; C280-R296 PolarHBondContact SG-O 3.4Å; C280-R296 VanDerWaalsContact SG-O 3.39Å
281	T	80.1	Confident	73.4	Confident	118 Å²	118	79.7 Å²	79.7	72%	0.724	39%	0.392	S	S	*	.	S	Bend	trans	-116.6	-25.7	171.6	58.1	0	0	0	0	111.2	D285	T281-D285 WeakPolarHBondContact CA-OD2 3.32Å; T281-D285 PolarHBondContact N-OD2 3.22Å; T281-D285 PolarHBondContact OG1-OD2 3.4Å
282	T	84.9	Confident	72.8	Confident	66 Å²	66	79.6 Å²	79.6	41%	0.405	39%	0.394	S	S	.	.	S	Bend	trans	-137.9	162.1	178.1	72.2	0	0	0	0	109.3	D284 D285 C292	T282-D284 PolarHBondContact O-N 3.08Å; T282-D284 VanDerWaalsContact O-N 3.15Å; T282-D284 PolarHBondContact OG1-N 2.88Å; T282-D285 PolarHBondContact N-OD2 3.33Å; T282-D285 WeakPolarHBondContact O-CB 3.3Å; T282-D285 PolarHBondContact O-N 2.88Å; T282-D285 VanDerWaalsContact O-N 3.1Å; T282-D285 PolarHBondContact OG1-OD2 3.21Å; T282-C292 VanDerWaalsContact C-CB 3.45Å; T282-C292 VanDerWaalsContact O-CB 3.27Å; T282-C292 WeakPolarHBondContact O-CB 3.15Å
283	H	81.8	Confident	72.4	Confident	50 Å²	50	78.2 Å²	78.2	23%	0.231	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-62.5	-19.8	174.2	-51.7	-43	0	0	0	112.8	D285 C286 V291 C292 I318 R320	H283-D285 PolarHBondContact O-N 2.83Å; H283-C286 WeakPolarHBondContact O-CB 3.47Å; H283-C286 PolarHBondContact O-N 2.9Å; H283-C286 VanDerWaalsContact O-N 3.16Å; H283-V291 WeakPolarHBondContact CE1-CG1 3.2Å; H283-V291 VanDerWaalsContact ND1-CG1 3.34Å; H283-V291 WeakPolarHBondContact ND1-CG1 3.36Å; H283-C292 PolarHBondContact CE1-O 3.37Å; H283-C292 PolarHBondContact ND1-N 3.05Å; H283-C292 PolarHBondContact ND1-O 2.67Å; H283-I318 WeakPolarHBondContact NE2-CG2 2.9Å; H283-R320 PolarHBondContact O-NE 2.64Å; H283-R320 PolarHBondContact O-NH2 3.07Å
284	D	81.6	Confident	72.1	Confident	123 Å²	123	84.6 Å²	84.6	66%	0.658	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-68.6	-19.8	175.1	-73.1	-35.8	0	0	0	114.3	T282 C286 R320	T282-D284 PolarHBondContact O-N 3.08Å; T282-D284 VanDerWaalsContact O-N 3.15Å; T282-D284 PolarHBondContact OG1-N 2.88Å; D284-C286 PolarHBondContact O-N 2.88Å; D284-R320 VanDerWaalsContact CA-NH2 3.3Å; D284-R320 IonicContact OD1-CZ 3.84Å; D284-R320 IonicContact OD1-NH1 2.7Å; D284-R320 PolarHBondContact OD1-NH1 2.05Å; D284-R320 IonicContact OD1-NH2 2.82Å; D284-R320 PolarHBondContact OD1-NH2 3.22Å
285	D	75.2	Confident	72.5	Confident	86 Å²	86	86.5 Å²	86.5	46%	0.46	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-77.9	-10	174.5	-51.9	-36.7	0	0	0	111.9	C280 T281 T282 H283	C280-D285 HydrophobicContact CB-CB 3.78Å; T281-D285 WeakPolarHBondContact CA-OD2 3.32Å; T281-D285 PolarHBondContact N-OD2 3.22Å; T281-D285 PolarHBondContact OG1-OD2 3.4Å; T282-D285 PolarHBondContact N-OD2 3.33Å; T282-D285 WeakPolarHBondContact O-CB 3.3Å; T282-D285 PolarHBondContact O-N 2.88Å; T282-D285 VanDerWaalsContact O-N 3.1Å; T282-D285 PolarHBondContact OG1-OD2 3.21Å; H283-D285 PolarHBondContact O-N 2.83Å
286	C	74.7	Confident	73.1	Confident	6 Å²	6	87.8 Å²	87.8	4%	0.041	42%	0.419	C	S	.	.	S	Bend	trans	-101.3	145.9	-177.6	-58.8	0	0	0	0	112.7	H283 D284 D290 C292 C297	H283-C286 WeakPolarHBondContact O-CB 3.47Å; H283-C286 PolarHBondContact O-N 2.9Å; H283-C286 VanDerWaalsContact O-N 3.16Å; D284-C286 PolarHBondContact O-N 2.88Å; C286-D290 HydrophobicContact CB-CB 3.79Å; C286-D290 WeakPolarHBondContact CB-O 3.44Å; C286-C292 PolarHBondContact SG-N 3.41Å; C286-C292 VanDerWaalsContact SG-N 3.44Å; C286-C297 WeakPolarHBondContact CA-SG 2.99Å; C286-C297 HydrophobicContact CB-CB 3.76Å; C286-C297 WeakPolarHBondContact CB-SG 3.29Å; C286-C297 WeakPolarHBondContact SG-CA 3.5Å; C286-C297 WeakPolarHBondContact SG-CB 3.48Å; C286-C297 CovalentContact SG-SG 2.04Å; C286-C297 PolarHBondContact SG-SG 2.02Å
287	Y	69.9	Low	74.3	Confident	146 Å²	146	84.5 Å²	84.5	57%	0.573	41%	0.405	S	S	*	.			trans	-77.8	144.2	-176.6	-169	-98.1	0	0	0	111.9	Y289 D290	Y287-Y289 PolarHBondContact O-N 3.42Å; Y287-Y289 VanDerWaalsContact O-N 3.12Å; Y287-D290 WeakPolarHBondContact O-CB 3.44Å; Y287-D290 PolarHBondContact O-N 3.02Å
288	D	79.2	Confident	75.3	Confident	64 Å²	64	79.1 Å²	79.1	34%	0.342	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	-111.6	177.3	-155.9	19	0	0	0	115.4	R321	D288-R321 VanDerWaalsContact O-CD 3.3Å; D288-R321 WeakPolarHBondContact O-CD 3.4Å; D288-R321 PolarHBondContact O-NE 3.07Å; D288-R321 VanDerWaalsContact O-NE 3.09Å; D288-R321 IonicContact OD1-NH1 3.71Å; D288-R321 PolarHBondContact OD1-NH1 3.19Å
289	Y	82.1	Confident	76	Confident	57 Å²	57	74.2 Å²	74.2	22%	0.224	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	4.2	178.2	-64.6	-76.4	0	0	0	112.9	Y287 V291 G300 P302 R321 Y323 V325	Y287-Y289 PolarHBondContact O-N 3.42Å; Y287-Y289 VanDerWaalsContact O-N 3.12Å; Y289-V291 WeakPolarHBondContact O-CG2 3.41Å; Y289-G300 WeakPolarHBondContact CB-O 3.2Å; Y289-G300 WeakPolarHBondContact O-CA 3.35Å; Y289-P302 HydrophobicContact CD1-CB 3.61Å; Y289-P302 HydrophobicContact CD1-CG 3.96Å; Y289-P302 HydrophobicContact CD2-CB 4.23Å; Y289-P302 HydrophobicContact CD2-CG 3.62Å; Y289-P302 HydrophobicContact CE1-CB 3.64Å; Y289-P302 HydrophobicContact CE1-CG 4.02Å; Y289-P302 HydrophobicContact CE2-CB 4.27Å; Y289-P302 HydrophobicContact CE2-CG 3.71Å; Y289-P302 HydrophobicContact CG-CB 3.91Å; Y289-P302 HydrophobicContact CG-CG 3.75Å; Y289-R321 HydrophobicContact CE1-CB 4.38Å; Y289-Y323 HydrophobicContact CE1-CD2 4.25Å; Y289-V325 HydrophobicContact CD1-CG2 3.91Å; Y289-V325 HydrophobicContact CG-CG2 4.43Å; Y289-V325 WeakPolarHBondContact O-CG1 3.23Å
290	D	78.9	Confident	76.6	Confident	40 Å²	40	67.7 Å²	67.7	21%	0.214	34%	0.344	C	S	.	.			trans	-64.5	151.5	178.2	-65	-12.9	0	0	0	111.4	C286 Y287 C297 M298 T299 G300	C286-D290 HydrophobicContact CB-CB 3.79Å; C286-D290 WeakPolarHBondContact CB-O 3.44Å; Y287-D290 WeakPolarHBondContact O-CB 3.44Å; Y287-D290 PolarHBondContact O-N 3.02Å; D290-C297 HydrophobicContact CB-CB 4.44Å; D290-M298 CarbonylContact C-O 3.36Å; D290-M298 VanDerWaalsContact CA-O 3.3Å; D290-M298 WeakPolarHBondContact CA-O 3.02Å; D290-M298 WeakPolarHBondContact CB-O 3.38Å; D290-T299 VanDerWaalsContact OD1-CA 3.31Å; D290-T299 WeakPolarHBondContact OD1-CA 3.41Å; D290-G300 PolarHBondContact OD1-N 3.44Å
291	V	79.8	Confident	76.7	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	124.1	-168.2	-173	0	0	0	0	109.8	H283 Y289 I293 M298 I318 V325 I327	H283-V291 WeakPolarHBondContact CE1-CG1 3.2Å; H283-V291 VanDerWaalsContact ND1-CG1 3.34Å; H283-V291 WeakPolarHBondContact ND1-CG1 3.36Å; Y289-V291 WeakPolarHBondContact O-CG2 3.41Å; V291-I293 HydrophobicContact CG1-CG1 4.31Å; V291-I293 PolarHBondContact O-N 2.03Å; V291-M298 PolarHBondContact N-O 2.96Å; V291-M298 PolarHBondContact O-N 3.24Å; V291-I318 HydrophobicContact CG1-CB 4Å; V291-I318 HydrophobicContact CG1-CD1 3.4Å; V291-I318 VanDerWaalsContact CG1-CD1 3.4Å; V291-I318 HydrophobicContact CG1-CG1 4.25Å; V291-I318 HydrophobicContact CG1-CG2 3.79Å; V291-V325 HydrophobicContact CG2-CB 4.22Å; V291-V325 HydrophobicContact CG2-CG1 3.7Å; V291-I327 HydrophobicContact CB-CD1 4.02Å; V291-I327 HydrophobicContact CB-CG1 3.96Å; V291-I327 HydrophobicContact CG1-CD1 3.91Å; V291-I327 HydrophobicContact CG1-CG1 4.4Å; V291-I327 HydrophobicContact CG2-CD1 4.27Å; V291-I327 HydrophobicContact CG2-CG1 3.94Å
292	C	79.6	Confident	76.9	Confident	15 Å²	15	70.6 Å²	70.6	10%	0.101	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	120	174.2	-172.6	0	0	0	0	112.5	C280 T282 H283 C286 R296	C280-C292 HydrophobicContact CB-CB 3.64Å; C280-C292 WeakPolarHBondContact CB-SG 2.91Å; C280-C292 PolarHBondContact O-SG 3.23Å; C280-C292 WeakPolarHBondContact SG-CA 3.45Å; C280-C292 WeakPolarHBondContact SG-CB 3.49Å; C280-C292 CovalentContact SG-SG 2.01Å; C280-C292 PolarHBondContact SG-SG 2.96Å; T282-C292 VanDerWaalsContact C-CB 3.45Å; T282-C292 VanDerWaalsContact O-CB 3.27Å; T282-C292 WeakPolarHBondContact O-CB 3.15Å; H283-C292 PolarHBondContact CE1-O 3.37Å; H283-C292 PolarHBondContact ND1-N 3.05Å; H283-C292 PolarHBondContact ND1-O 2.67Å; C286-C292 PolarHBondContact SG-N 3.41Å; C286-C292 VanDerWaalsContact SG-N 3.44Å; C292-R296 WeakPolarHBondContact CA-O 3.42Å
293	I	75.4	Confident	76.7	Confident	59 Å²	59	69.2 Å²	69.2	30%	0.303	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	125.9	175.5	-53.2	179.9	0	0	0	108.3	V291 D295 R296 M298 I327	V291-I293 HydrophobicContact CG1-CG1 4.31Å; V291-I293 PolarHBondContact O-N 2.03Å; I293-D295 VanDerWaalsContact C-N 3.28Å; I293-D295 PolarHBondContact O-N 2.68Å; I293-R296 PolarHBondContact N-O 3.11Å; I293-R296 PolarHBondContact O-N 2.78Å; I293-R296 VanDerWaalsContact O-O 3.07Å; I293-M298 HydrophobicContact CB-CG 3.92Å; I293-M298 HydrophobicContact CD1-CB 4.1Å; I293-M298 HydrophobicContact CD1-CG 3.82Å; I293-M298 HydrophobicContact CG1-CB 4.46Å; I293-M298 HydrophobicContact CG1-CG 4.01Å; I293-I327 HydrophobicContact CD1-CD1 3.39Å; I293-I327 HydrophobicContact CD1-CG1 4.16Å; I293-I327 HydrophobicContact CD1-CG2 3.96Å; I293-I327 HydrophobicContact CG1-CD1 4.33Å
294	E	71	Confident	76.7	Confident	178 Å²	178	75 Å²	75	83%	0.832	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	49.9	176.5	-64.3	178.7	177.3	0	0	112.4	R296	E294-R296 PolarHBondContact O-N 2.94Å
295	D	76.8	Confident	76.9	Confident	93 Å²	93	73.5 Å²	73.5	50%	0.497	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	27.6	-177.3	-44.9	-48.5	0	0	0	114.9	F279 C280 I293	F279-D295 WeakPolarHBondContact CA-O 3.23Å; F279-D295 HydrophobicContact CD1-CB 3.93Å; F279-D295 PolarHBondContact N-O 2.68Å; C280-D295 PolarHBondContact N-O 3.33Å; C280-D295 VanDerWaalsContact O-CA 3.24Å; C280-D295 WeakPolarHBondContact O-CA 3.28Å; C280-D295 VanDerWaalsContact SG-C 3.53Å; I293-D295 VanDerWaalsContact C-N 3.28Å; I293-D295 PolarHBondContact O-N 2.68Å
296	R	70.8	Confident	77.5	Confident	155 Å²	155	76.9 Å²	76.9	59%	0.585	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.6	137.1	175.3	-62.8	-176.7	177.4	-154.1	0.6	111.5	C280 C292 I293 E294 M298	C280-R296 PolarHBondContact SG-N 2.84Å; C280-R296 PolarHBondContact SG-O 3.4Å; C280-R296 VanDerWaalsContact SG-O 3.39Å; C292-R296 WeakPolarHBondContact CA-O 3.42Å; I293-R296 PolarHBondContact N-O 3.11Å; I293-R296 PolarHBondContact O-N 2.78Å; I293-R296 VanDerWaalsContact O-O 3.07Å; E294-R296 PolarHBondContact O-N 2.94Å; R296-M298 PolarHBondContact O-N 3.47Å
297	C	72.6	Confident	78.4	Confident	49 Å²	49	76.9 Å²	76.9	33%	0.331	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	118.3	170.3	-65.2	0	0	0	0	109.3	C286 D290	C286-C297 WeakPolarHBondContact CA-SG 2.99Å; C286-C297 HydrophobicContact CB-CB 3.76Å; C286-C297 WeakPolarHBondContact CB-SG 3.29Å; C286-C297 WeakPolarHBondContact SG-CA 3.5Å; C286-C297 WeakPolarHBondContact SG-CB 3.48Å; C286-C297 CovalentContact SG-SG 2.04Å; C286-C297 PolarHBondContact SG-SG 2.02Å; D290-C297 HydrophobicContact CB-CB 4.44Å
298	M	72	Confident	79.3	Confident	24 Å²	24	76 Å²	76	12%	0.118	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	140.2	176.2	-62.7	-71.4	-72.2	0	0	109.1	D290 V291 I293 R296 G300 I327 T330 T333	D290-M298 CarbonylContact C-O 3.36Å; D290-M298 VanDerWaalsContact CA-O 3.3Å; D290-M298 WeakPolarHBondContact CA-O 3.02Å; D290-M298 WeakPolarHBondContact CB-O 3.38Å; V291-M298 PolarHBondContact N-O 2.96Å; V291-M298 PolarHBondContact O-N 3.24Å; I293-M298 HydrophobicContact CB-CG 3.92Å; I293-M298 HydrophobicContact CD1-CB 4.1Å; I293-M298 HydrophobicContact CD1-CG 3.82Å; I293-M298 HydrophobicContact CG1-CB 4.46Å; I293-M298 HydrophobicContact CG1-CG 4.01Å; R296-M298 PolarHBondContact O-N 3.47Å; M298-G300 PolarHBondContact O-N 2.96Å; M298-I327 HydrophobicContact CB-CG2 3.8Å; M298-I327 HydrophobicContact CE-CG2 4.38Å; M298-T330 HydrophobicContact CE-CG2 3.77Å; M298-T333 HydrophobicContact CE-CG2 4.01Å
299	T	70.8	Confident	79.7	Confident	83 Å²	83	76.5 Å²	76.5	51%	0.509	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-63.7	124	-179.1	-57.6	0	0	0	0	111	D290 F301	D290-T299 VanDerWaalsContact OD1-CA 3.31Å; D290-T299 WeakPolarHBondContact OD1-CA 3.41Å; T299-F301 HydrophobicContact CG2-CE2 3.97Å; T299-F301 HydrophobicContact CG2-CZ 4.06Å
300	G	75.3	Confident	79.8	Confident	7 Å²	7	77.8 Å²	77.8	7%	0.072	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.3	-178	0	0	0	0	0	112.4	Y289 D290 M298	Y289-G300 WeakPolarHBondContact CB-O 3.2Å; Y289-G300 WeakPolarHBondContact O-CA 3.35Å; D290-G300 PolarHBondContact OD1-N 3.44Å; M298-G300 PolarHBondContact O-N 2.96Å
301	F	78.3	Confident	80.1	Confident	122 Å²	122	87.1 Å²	87.1	54%	0.535	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	116.8	174.4	-64.1	-86.8	0	0	0	110.2	T299 V325 K326 T328	T299-F301 HydrophobicContact CG2-CE2 3.97Å; T299-F301 HydrophobicContact CG2-CZ 4.06Å; F301-V325 WeakPolarHBondContact O-CA 3.31Å; F301-K326 PolarHBondContact N-O 3.44Å; F301-K326 PolarHBondContact O-N 3.36Å; F301-T328 WeakPolarHBondContact CD2-OG1 3.43Å; F301-T328 WeakPolarHBondContact CE2-OG1 3.46Å
302	P	83.8	Confident	80.4	Confident	60 Å²	60	89 Å²	89	39%	0.39	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	136.6	177.8	28.2	-34.5	0	0	0	111.3	Y289	Y289-P302 HydrophobicContact CD1-CB 3.61Å; Y289-P302 HydrophobicContact CD1-CG 3.96Å; Y289-P302 HydrophobicContact CD2-CB 4.23Å; Y289-P302 HydrophobicContact CD2-CG 3.62Å; Y289-P302 HydrophobicContact CE1-CB 3.64Å; Y289-P302 HydrophobicContact CE1-CG 4.02Å; Y289-P302 HydrophobicContact CE2-CB 4.27Å; Y289-P302 HydrophobicContact CE2-CG 3.71Å; Y289-P302 HydrophobicContact CG-CB 3.91Å; Y289-P302 HydrophobicContact CG-CG 3.75Å
303	T	80.6	Confident	80.7	Confident	37 Å²	37	89.1 Å²	89.1	23%	0.227	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	167.4	170.2	68.2	0	0	0	0	110.5	R305 Y323 C324	T303-R305 PolarHBondContact O-N 3.36Å; T303-R305 VanDerWaalsContact O-N 3.17Å; T303-R305 WeakPolarHBondContact OG1-CB 2.95Å; T303-R305 PolarHBondContact OG1-N 3.02Å; T303-Y323 WeakPolarHBondContact O-CD1 3.02Å; T303-C324 WeakPolarHBondContact CB-O 3.48Å; T303-C324 WeakPolarHBondContact CG2-O 2.93Å; T303-C324 PolarHBondContact N-O 2.81Å; T303-C324 WeakPolarHBondContact OG1-CB 3.4Å; T303-C324 PolarHBondContact OG1-O 2.99Å
304	D	81.5	Confident	80.9	Confident	171 Å²	171	91.3 Å²	91.3	91%	0.914	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	-5.3	172.5	-69.4	-36.4	0	0	0	113.2
305	R	85.5	Confident	80.6	Confident	91 Å²	91	89.6 Å²	89.6	34%	0.343	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	121.8	-176.7	-176.8	-179.1	175.1	139.7	-6.9	110.7	T303 S312 E314 Y323 C324	T303-R305 PolarHBondContact O-N 3.36Å; T303-R305 VanDerWaalsContact O-N 3.17Å; T303-R305 WeakPolarHBondContact OG1-CB 2.95Å; T303-R305 PolarHBondContact OG1-N 3.02Å; R305-S312 PolarHBondContact NE-O 3.35Å; R305-S312 PolarHBondContact NH2-O 2.92Å; R305-E314 IonicContact CZ-OE1 3.5Å; R305-E314 VanDerWaalsContact NH1-CG 3.3Å; R305-E314 IonicContact NH1-OE1 2.64Å; R305-E314 PolarHBondContact NH1-OE1 2.9Å; R305-E314 IonicContact NH1-OE2 2.66Å; R305-E314 PolarHBondContact NH1-OE2 2.65Å; R305-E314 IonicContact NH2-OE1 3.61Å; R305-Y323 WeakPolarHBondContact O-CA 3.43Å; R305-C324 HydrophobicContact CB-CB 4.29Å; R305-C324 HydrophobicContact CG-CB 4.5Å; R305-C324 PolarHBondContact O-N 2.85Å
306	K	89.9	Confident	80.1	Confident	157 Å²	157	91.9 Å²	91.9	68%	0.683	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	148.4	173.8	-64.6	-176.5	-179.4	-178.6	0	111.5	N322 Y323	K306-N322 CarbonylContact C-O 3.59Å; K306-N322 WeakPolarHBondContact CA-O 3.48Å; K306-Y323 HydrophobicContact CG-CD1 4.45Å; K306-Y323 HydrophobicContact CG-CE1 4.15Å
307	C	92.1	Very high	80.6	Confident	6 Å²	6	86.1 Å²	86.1	4%	0.041	44%	0.443	C	S	.	.			trans	-140.3	156.6	179.4	66.5	0	0	0	0	111.6	C313 C319 N322 Y323 C324	C307-C313 VanDerWaalsContact CB-SG 3.51Å; C307-C319 HydrophobicContact CB-CB 3.72Å; C307-C319 WeakPolarHBondContact CB-SG 3.46Å; C307-C319 WeakPolarHBondContact SG-CA 3.36Å; C307-C319 WeakPolarHBondContact SG-CB 3.16Å; C307-C319 CovalentContact SG-SG 2.02Å; C307-C319 PolarHBondContact SG-SG 3.06Å; C307-N322 PolarHBondContact N-O 2.88Å; C307-N322 WeakPolarHBondContact O-CA 3.42Å; C307-N322 VanDerWaalsContact SG-C 3.5Å; C307-Y323 PolarHBondContact SG-N 3.3Å; C307-Y323 PolarHBondContact SG-O 3.11Å; C307-C324 VanDerWaalsContact CB-SG 3.58Å
308	V	89.6	Confident	81.2	Confident	128 Å²	128	85.2 Å²	85.2	78%	0.776	43%	0.434	S	S	*	.	S	Bend	trans	-113	-28.8	168.5	-177.4	0	0	0	0	110.5
309	T	87.9	Confident	82	Confident	74 Å²	74	85.2 Å²	85.2	45%	0.454	44%	0.436	S	S	.	.	S	Bend	trans	-143.8	164.2	177.8	63.8	0	0	0	0	109	R311 S312 C319	T309-R311 PolarHBondContact O-N 2.8Å; T309-R311 VanDerWaalsContact O-N 3.14Å; T309-S312 WeakPolarHBondContact O-CB 3.24Å; T309-S312 PolarHBondContact O-N 3.27Å; T309-S312 PolarHBondContact O-OG 2.04Å; T309-C319 WeakPolarHBondContact O-CB 3.48Å
310	D	83.5	Confident	82.8	Confident	84 Å²	84	82.2 Å²	82.2	45%	0.449	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-57.7	-29.7	177.5	-55.6	-30.7	0	0	0	112.7	S312 C313 C319	D310-S312 PolarHBondContact O-N 2.75Å; D310-S312 VanDerWaalsContact O-N 3.14Å; D310-C313 WeakPolarHBondContact O-CB 3.23Å; D310-C313 PolarHBondContact O-N 2.03Å; D310-C319 WeakPolarHBondContact OD1-CB 2.81Å; D310-C319 PolarHBondContact OD1-N 3.35Å
311	R	85.4	Confident	83.3	Confident	237 Å²	237	87.8 Å²	87.8	89%	0.894	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-63	-19.7	174.7	-65.1	-176.5	-178.4	166.2	1.4	113.6	T309	T309-R311 PolarHBondContact O-N 2.8Å; T309-R311 VanDerWaalsContact O-N 3.14Å
312	S	86.9	Confident	83.8	Confident	40 Å²	40	87.3 Å²	87.3	28%	0.28	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-78.9	-6	175.5	-51.9	0	0	0	0	112.2	R305 T309 D310	R305-S312 PolarHBondContact NE-O 3.35Å; R305-S312 PolarHBondContact NH2-O 2.92Å; T309-S312 WeakPolarHBondContact O-CB 3.24Å; T309-S312 PolarHBondContact O-N 3.27Å; T309-S312 PolarHBondContact O-OG 2.04Å; D310-S312 PolarHBondContact O-N 2.75Å; D310-S312 VanDerWaalsContact O-N 3.14Å
313	C	84.4	Confident	84.1	Confident	17 Å²	17	88.3 Å²	88.3	12%	0.115	43%	0.434	C	S	.	.	S	Bend	trans	-106.7	159.5	-177.8	-57	0	0	0	0	112.4	C307 D310 E317 C324	C307-C313 VanDerWaalsContact CB-SG 3.51Å; D310-C313 WeakPolarHBondContact O-CB 3.23Å; D310-C313 PolarHBondContact O-N 2.03Å; C313-E317 HydrophobicContact CB-CB 3.59Å; C313-C324 WeakPolarHBondContact CA-SG 3.35Å; C313-C324 HydrophobicContact CB-CB 3.69Å; C313-C324 WeakPolarHBondContact CB-SG 3.08Å; C313-C324 WeakPolarHBondContact SG-CA 3.47Å; C313-C324 WeakPolarHBondContact SG-CB 3.06Å; C313-C324 CovalentContact SG-SG 2.04Å; C313-C324 PolarHBondContact SG-SG 3.22Å
314	E	79.6	Confident	84.5	Confident	105 Å²	105	86.6 Å²	86.6	49%	0.491	42%	0.423	S	S	.	.	S	Bend	trans	-107.1	160.4	-179.5	-86.8	169.5	-151	0	0	110.8	R305 N316 E317	R305-E314 IonicContact CZ-OE1 3.5Å; R305-E314 VanDerWaalsContact NH1-CG 3.3Å; R305-E314 IonicContact NH1-OE1 2.64Å; R305-E314 PolarHBondContact NH1-OE1 2.9Å; R305-E314 IonicContact NH1-OE2 2.66Å; R305-E314 PolarHBondContact NH1-OE2 2.65Å; R305-E314 IonicContact NH2-OE1 3.61Å; E314-N316 PolarHBondContact O-N 3.46Å; E314-E317 PolarHBondContact N-OE2 3.47Å; E314-E317 WeakPolarHBondContact O-CB 3.38Å; E314-E317 WeakPolarHBondContact O-CG 3.32Å; E314-E317 PolarHBondContact O-N 2.8Å
315	N	65.6	Low	84.7	Confident	141 Å²	141	78.4 Å²	78.4	75%	0.754	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	48.5	166.7	-56.9	-38.4	0	0	0	116.2	E317	N315-E317 PolarHBondContact O-N 3.32Å
316	N	65.7	Low	84.4	Confident	142 Å²	142	77.7 Å²	77.7	76%	0.759	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	18	179.7	-50	-47.7	0	0	0	115.2	E314	E314-N316 PolarHBondContact O-N 3.46Å
317	E	82.1	Confident	83.5	Confident	34 Å²	34	71.8 Å²	71.8	16%	0.159	35%	0.354	C	S	.	.			trans	-65.6	150.4	167.6	-71.4	164.1	179.4	0	0	111.2	C313 E314 N315 C324 V325	C313-E317 HydrophobicContact CB-CB 3.59Å; E314-E317 PolarHBondContact N-OE2 3.47Å; E314-E317 WeakPolarHBondContact O-CB 3.38Å; E314-E317 WeakPolarHBondContact O-CG 3.32Å; E314-E317 PolarHBondContact O-N 2.8Å; N315-E317 PolarHBondContact O-N 3.32Å; E317-C324 HydrophobicContact CB-CB 4.16Å; E317-C324 VanDerWaalsContact OE2-CB 3.29Å; E317-C324 WeakPolarHBondContact OE2-CB 3.18Å; E317-V325 WeakPolarHBondContact CA-O 3.36Å
318	I	85.4	Confident	82.3	Confident	30 Å²	30	73.3 Å²	73.3	15%	0.154	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.9	-178.8	-74.8	169.9	0	0	0	109.9	H283 V291 R320 V325 I327	H283-I318 WeakPolarHBondContact NE2-CG2 2.9Å; V291-I318 HydrophobicContact CG1-CB 4Å; V291-I318 HydrophobicContact CG1-CD1 3.4Å; V291-I318 VanDerWaalsContact CG1-CD1 3.4Å; V291-I318 HydrophobicContact CG1-CG1 4.25Å; V291-I318 HydrophobicContact CG1-CG2 3.79Å; I318-R320 PolarHBondContact O-N 3.44Å; I318-V325 PolarHBondContact N-O 3.27Å; I318-V325 VanDerWaalsContact N-O 3.09Å; I318-V325 PolarHBondContact O-N 2.93Å; I318-I327 HydrophobicContact CD1-CD1 3.79Å; I318-I327 HydrophobicContact CG1-CD1 4.49Å
319	C	88.9	Confident	81.1	Confident	23 Å²	23	67.4 Å²	67.4	16%	0.155	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	107	179.7	-175.5	0	0	0	0	110.5	C307 T309 D310	C307-C319 HydrophobicContact CB-CB 3.72Å; C307-C319 WeakPolarHBondContact CB-SG 3.46Å; C307-C319 WeakPolarHBondContact SG-CA 3.36Å; C307-C319 WeakPolarHBondContact SG-CB 3.16Å; C307-C319 CovalentContact SG-SG 2.02Å; C307-C319 PolarHBondContact SG-SG 3.06Å; T309-C319 WeakPolarHBondContact O-CB 3.48Å; D310-C319 WeakPolarHBondContact OD1-CB 2.81Å; D310-C319 PolarHBondContact OD1-N 3.35Å
320	R	87.1	Confident	80.1	Confident	21 Å²	21	67 Å²	67	8%	0.079	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127	-178.3	-169.9	75.4	-167	128.5	9.4	109.9	H283 D284 I318 N322 Y323 V325	H283-R320 PolarHBondContact O-NE 2.64Å; H283-R320 PolarHBondContact O-NH2 3.07Å; D284-R320 VanDerWaalsContact CA-NH2 3.3Å; D284-R320 IonicContact OD1-CZ 3.84Å; D284-R320 IonicContact OD1-NH1 2.7Å; D284-R320 PolarHBondContact OD1-NH1 2.05Å; D284-R320 IonicContact OD1-NH2 2.82Å; D284-R320 PolarHBondContact OD1-NH2 3.22Å; I318-R320 PolarHBondContact O-N 3.44Å; R320-N322 PolarHBondContact O-N 3.17Å; R320-N322 VanDerWaalsContact O-N 3.1Å; R320-Y323 PolarHBondContact N-O 3.36Å; R320-Y323 PolarHBondContact O-N 3.48Å; R320-V325 HydrophobicContact CB-CB 4.37Å; R320-V325 HydrophobicContact CB-CG2 3.61Å; R320-V325 HydrophobicContact CG-CG2 4.44Å
321	R	84.8	Confident	79.5	Confident	124 Å²	124	68.3 Å²	68.3	47%	0.468	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	37	177.8	-64.5	-178.8	172.5	-168.6	-0.1	113.8	D288 Y289 Y323	D288-R321 VanDerWaalsContact O-CD 3.3Å; D288-R321 WeakPolarHBondContact O-CD 3.4Å; D288-R321 PolarHBondContact O-NE 3.07Å; D288-R321 VanDerWaalsContact O-NE 3.09Å; D288-R321 IonicContact OD1-NH1 3.71Å; D288-R321 PolarHBondContact OD1-NH1 3.19Å; Y289-R321 HydrophobicContact CE1-CB 4.38Å; R321-Y323 VanDerWaalsContact C-N 3.31Å; R321-Y323 WeakPolarHBondContact O-CD2 3.3Å
322	N	88.8	Confident	78.4	Confident	111 Å²	111	58.2 Å²	58.2	59%	0.594	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	10.6	-177.5	-44.7	-70.9	0	0	0	116.2	K306 C307 R320	K306-N322 CarbonylContact C-O 3.59Å; K306-N322 WeakPolarHBondContact CA-O 3.48Å; C307-N322 PolarHBondContact N-O 2.88Å; C307-N322 WeakPolarHBondContact O-CA 3.42Å; C307-N322 VanDerWaalsContact SG-C 3.5Å; R320-N322 PolarHBondContact O-N 3.17Å; R320-N322 VanDerWaalsContact O-N 3.1Å
323	Y	90.3	Very high	77.4	Confident	82 Å²	82	58 Å²	58	32%	0.322	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142.8	175	-67	-88.2	0	0	0	110.2	Y289 T303 R305 K306 C307 R320 R321 V325	Y289-Y323 HydrophobicContact CE1-CD2 4.25Å; T303-Y323 WeakPolarHBondContact O-CD1 3.02Å; R305-Y323 WeakPolarHBondContact O-CA 3.43Å; K306-Y323 HydrophobicContact CG-CD1 4.45Å; K306-Y323 HydrophobicContact CG-CE1 4.15Å; C307-Y323 PolarHBondContact SG-N 3.3Å; C307-Y323 PolarHBondContact SG-O 3.11Å; R320-Y323 PolarHBondContact N-O 3.36Å; R320-Y323 PolarHBondContact O-N 3.48Å; R321-Y323 VanDerWaalsContact C-N 3.31Å; R321-Y323 WeakPolarHBondContact O-CD2 3.3Å; Y323-V325 PolarHBondContact O-N 2.81Å
324	C	89.1	Confident	76.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	127.3	168.9	-64.3	0	0	0	0	108.4	T303 R305 C307 C313 E317	T303-C324 WeakPolarHBondContact CB-O 3.48Å; T303-C324 WeakPolarHBondContact CG2-O 2.93Å; T303-C324 PolarHBondContact N-O 2.81Å; T303-C324 WeakPolarHBondContact OG1-CB 3.4Å; T303-C324 PolarHBondContact OG1-O 2.99Å; R305-C324 HydrophobicContact CB-CB 4.29Å; R305-C324 HydrophobicContact CG-CB 4.5Å; R305-C324 PolarHBondContact O-N 2.85Å; C307-C324 VanDerWaalsContact CB-SG 3.58Å; C313-C324 WeakPolarHBondContact CA-SG 3.35Å; C313-C324 HydrophobicContact CB-CB 3.69Å; C313-C324 WeakPolarHBondContact CB-SG 3.08Å; C313-C324 WeakPolarHBondContact SG-CA 3.47Å; C313-C324 WeakPolarHBondContact SG-CB 3.06Å; C313-C324 CovalentContact SG-SG 2.04Å; C313-C324 PolarHBondContact SG-SG 3.22Å; E317-C324 HydrophobicContact CB-CB 4.16Å; E317-C324 VanDerWaalsContact OE2-CB 3.29Å; E317-C324 WeakPolarHBondContact OE2-CB 3.18Å
325	V	85.9	Confident	76.8	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.2	-178.2	173.4	0	0	0	0	109.2	Y289 V291 F301 E317 I318 R320 Y323	Y289-V325 HydrophobicContact CD1-CG2 3.91Å; Y289-V325 HydrophobicContact CG-CG2 4.43Å; Y289-V325 WeakPolarHBondContact O-CG1 3.23Å; V291-V325 HydrophobicContact CG2-CB 4.22Å; V291-V325 HydrophobicContact CG2-CG1 3.7Å; F301-V325 WeakPolarHBondContact O-CA 3.31Å; E317-V325 WeakPolarHBondContact CA-O 3.36Å; I318-V325 PolarHBondContact N-O 3.27Å; I318-V325 VanDerWaalsContact N-O 3.09Å; I318-V325 PolarHBondContact O-N 2.93Å; R320-V325 HydrophobicContact CB-CB 4.37Å; R320-V325 HydrophobicContact CB-CG2 3.61Å; R320-V325 HydrophobicContact CG-CG2 4.44Å; Y323-V325 PolarHBondContact O-N 2.81Å
326	K	79.5	Confident	77.6	Confident	76 Å²	76	60.3 Å²	60.3	33%	0.33	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	129.8	169.9	-169.2	179.1	-173.7	-171.1	0	109.2	F301 E339 D340	F301-K326 PolarHBondContact N-O 3.44Å; F301-K326 PolarHBondContact O-N 3.36Å; K326-E339 PolarHBondContact NZ-O 3.48Å; K326-D340 WeakPolarHBondContact CE-OD1 3.04Å; K326-D340 IonicContact NZ-OD1 3.1Å; K326-D340 PolarHBondContact NZ-OD1 2.88Å
327	I	71.1	Confident	78.6	Confident	32 Å²	32	55.3 Å²	55.3	16%	0.164	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	133.7	175.1	-59.9	145.4	0	0	0	108.5	V291 I293 M298 I318	V291-I327 HydrophobicContact CB-CD1 4.02Å; V291-I327 HydrophobicContact CB-CG1 3.96Å; V291-I327 HydrophobicContact CG1-CD1 3.91Å; V291-I327 HydrophobicContact CG1-CG1 4.4Å; V291-I327 HydrophobicContact CG2-CD1 4.27Å; V291-I327 HydrophobicContact CG2-CG1 3.94Å; I293-I327 HydrophobicContact CD1-CD1 3.39Å; I293-I327 HydrophobicContact CD1-CG1 4.16Å; I293-I327 HydrophobicContact CD1-CG2 3.96Å; I293-I327 HydrophobicContact CG1-CD1 4.33Å; M298-I327 HydrophobicContact CB-CG2 3.8Å; M298-I327 HydrophobicContact CE-CG2 4.38Å; I318-I327 HydrophobicContact CD1-CD1 3.79Å; I318-I327 HydrophobicContact CG1-CD1 4.49Å
328	T	67.2	Low	78.9	Confident	38 Å²	38	54.5 Å²	54.5	23%	0.233	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-86.7	122.4	169.6	-31.3	0	0	0	0	108.9	F301 D342	F301-T328 WeakPolarHBondContact CD2-OG1 3.43Å; F301-T328 WeakPolarHBondContact CE2-OG1 3.46Å; T328-D342 HydrophobicContact CG2-CB 4.38Å
329	G	63.7	Low	78.8	Confident	5 Å²	5	58.2 Å²	58.2	5%	0.052	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-72.5	131.6	-177.4	0	0	0	0	0	112.4	T333 D340 D342 M345	G329-T333 WeakPolarHBondContact CA-OG1 3.05Å; G329-D340 WeakPolarHBondContact CA-O 3.38Å; G329-D340 PolarHBondContact N-O 2.95Å; G329-D342 PolarHBondContact O-N 3.22Å; G329-M345 WeakPolarHBondContact O-CE 3.27Å
330	T	67.7	Low	78.3	Confident	65 Å²	65	58.9 Å²	58.9	40%	0.399	30%	0.303	S	S	.	.			trans	-87.2	176.2	172.3	59.8	0	0	0	0	111.6	M298 G332 T333 M345 C352	M298-T330 HydrophobicContact CE-CG2 3.77Å; T330-G332 PolarHBondContact O-N 3.16Å; T330-G332 VanDerWaalsContact O-N 3.11Å; T330-T333 PolarHBondContact N-OG1 3.24Å; T330-T333 VanDerWaalsContact N-OG1 3.16Å; T330-T333 WeakPolarHBondContact O-CB 3.3Å; T330-T333 WeakPolarHBondContact O-CG2 3.01Å; T330-T333 PolarHBondContact O-N 3.17Å; T330-T333 PolarHBondContact O-OG1 3.05Å; T330-T333 WeakPolarHBondContact OG1-CG2 3.02Å; T330-M345 VanDerWaalsContact CA-CE 3.44Å; T330-C352 WeakPolarHBondContact O-CB 3.39Å
331	L	69.9	Low	78	Confident	111 Å²	111	58 Å²	58	58%	0.581	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	122.7	-179.4	-176	65.1	0	0	0	112.1	M345 Q354	L331-M345 HydrophobicContact CB-SD 4.12Å; L331-M345 HydrophobicContact CD1-SD 4.32Å; L331-Q354 HydrophobicContact CD1-CG 4.34Å
332	G	62.5	Low	77.8	Confident	25 Å²	25	55.4 Å²	55.4	26%	0.258	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-10.3	179.1	0	0	0	0	0	116.1	T330 R351 C352	T330-G332 PolarHBondContact O-N 3.16Å; T330-G332 VanDerWaalsContact O-N 3.11Å; G332-R351 WeakPolarHBondContact O-CD 3.5Å; G332-R351 PolarHBondContact O-NH1 2.73Å; G332-C352 PolarHBondContact N-O 3.06Å
333	T	65.5	Low	77.2	Confident	37 Å²	37	57.4 Å²	57.4	23%	0.227	30%	0.302	C	S	.	.			trans	-66.5	152.9	178.8	57.4	0	0	0	0	112	M298 G329 T330 R351 C352	M298-T333 HydrophobicContact CE-CG2 4.01Å; G329-T333 WeakPolarHBondContact CA-OG1 3.05Å; T330-T333 PolarHBondContact N-OG1 3.24Å; T330-T333 VanDerWaalsContact N-OG1 3.16Å; T330-T333 WeakPolarHBondContact O-CB 3.3Å; T330-T333 WeakPolarHBondContact O-CG2 3.01Å; T330-T333 PolarHBondContact O-N 3.17Å; T330-T333 PolarHBondContact O-OG1 3.05Å; T330-T333 WeakPolarHBondContact OG1-CG2 3.02Å; T333-R351 CarbonylContact O-C 3.58Å; T333-R351 WeakPolarHBondContact O-CA 3.4Å; T333-C352 PolarHBondContact O-N 2.88Å
334	K	71.5	Confident	76.9	Confident	181 Å²	181	57.1 Å²	57.1	79%	0.787	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-64.2	139.6	175.9	-68.3	177.1	-175.7	167.7	0	111	K350	K334-K350 CarbonylContact C-O 3.56Å; K334-K350 WeakPolarHBondContact CA-O 3.37Å
335	C	79.7	Confident	76.8	Confident	9 Å²	9	57.4 Å²	57.4	6%	0.061	31%	0.307	C	S	.	.			trans	-143	156.8	178.7	56.9	0	0	0	0	110.9	D340 C347 K350 R351	C335-D340 HydrophobicContact CB-CB 3.96Å; C335-C347 HydrophobicContact CB-CB 3.71Å; C335-C347 WeakPolarHBondContact CB-SG 3.4Å; C335-C347 PolarHBondContact O-SG 2.74Å; C335-C347 VanDerWaalsContact O-SG 3.41Å; C335-C347 WeakPolarHBondContact SG-CA 3.33Å; C335-C347 WeakPolarHBondContact SG-CB 3.17Å; C335-C347 CovalentContact SG-SG 2.02Å; C335-C347 PolarHBondContact SG-SG 3.48Å; C335-K350 PolarHBondContact N-O 3.37Å; C335-K350 WeakPolarHBondContact O-CA 3.44Å; C335-R351 VanDerWaalsContact SG-CA 3.5Å; C335-R351 PolarHBondContact SG-N 2.9Å
336	V	83.9	Confident	77	Confident	120 Å²	120	57.4 Å²	57.4	73%	0.727	31%	0.307	S	S	*	.	S	Bend	trans	-109.9	-39.3	174	-177.6	0	0	0	0	110.3	D340	V336-D340 WeakPolarHBondContact CA-OD2 2.92Å; V336-D340 WeakPolarHBondContact CB-OD2 3.31Å; V336-D340 PolarHBondContact N-OD2 2.82Å
337	A	86.5	Confident	77.4	Confident	37 Å²	37	54.6 Å²	54.6	31%	0.306	30%	0.297	S	S	.	.	S	Bend	trans	-132.6	168.5	179	0	0	0	0	0	111.6	E339 D340 C347	A337-E339 VanDerWaalsContact CB-OE2 3.26Å; A337-E339 WeakPolarHBondContact CB-OE2 3.29Å; A337-E339 PolarHBondContact O-N 3.28Å; A337-D340 PolarHBondContact N-OD2 3Å; A337-D340 WeakPolarHBondContact O-CB 3.02Å; A337-D340 PolarHBondContact O-N 2.04Å; A337-D340 VanDerWaalsContact O-N 3.14Å; A337-C347 VanDerWaalsContact O-CB 3.31Å; A337-C347 WeakPolarHBondContact O-CB 3.42Å
338	H	87.8	Confident	78.2	Confident	17 Å²	17	55.1 Å²	55.1	8%	0.079	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-65.4	-27.3	-179.4	-64.5	-26.9	0	0	0	112.7	D340 C341 L346 C347 D365 G372 K374	H338-D340 PolarHBondContact O-N 2.86Å; H338-C341 PolarHBondContact O-N 3.33Å; H338-L346 HydrophobicContact CB-CD2 3.96Å; H338-C347 PolarHBondContact CE1-O 3.27Å; H338-C347 VanDerWaalsContact CE1-O 3.22Å; H338-C347 PolarHBondContact ND1-N 3.18Å; H338-C347 PolarHBondContact ND1-O 3.34Å; H338-D365 IonicContact CD2-OD1 2.96Å; H338-D365 IonicContact NE2-OD1 2.73Å; H338-D365 PolarHBondContact NE2-OD1 3.32Å; H338-D365 IonicContact NE2-OD2 2.56Å; H338-G372 WeakPolarHBondContact NE2-CA 3.21Å; H338-K374 HydrophobicContact CB-CB 4.26Å; H338-K374 HydrophobicContact CB-CD 4.25Å; H338-K374 HydrophobicContact CB-CG 4.12Å; H338-K374 WeakPolarHBondContact O-CE 2.92Å; H338-K374 PolarHBondContact O-NZ 3.01Å
339	E	84.1	Confident	79	Confident	108 Å²	108	63.1 Å²	63.1	51%	0.505	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-71.8	-6.4	175.3	-59.7	74.2	-162.6	0	0	113.6	K326 A337 C341	K326-E339 PolarHBondContact NZ-O 3.48Å; A337-E339 VanDerWaalsContact CB-OE2 3.26Å; A337-E339 WeakPolarHBondContact CB-OE2 3.29Å; A337-E339 PolarHBondContact O-N 3.28Å; E339-C341 VanDerWaalsContact C-N 3.34Å
340	D	78.5	Confident	79.9	Confident	37 Å²	37	70.6 Å²	70.6	20%	0.198	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-89.5	-6.9	173.3	-56.5	-28.3	0	0	0	111.9	K326 G329 C335 V336 A337 H338	K326-D340 WeakPolarHBondContact CE-OD1 3.04Å; K326-D340 IonicContact NZ-OD1 3.1Å; K326-D340 PolarHBondContact NZ-OD1 2.88Å; G329-D340 WeakPolarHBondContact CA-O 3.38Å; G329-D340 PolarHBondContact N-O 2.95Å; C335-D340 HydrophobicContact CB-CB 3.96Å; V336-D340 WeakPolarHBondContact CA-OD2 2.92Å; V336-D340 WeakPolarHBondContact CB-OD2 3.31Å; V336-D340 PolarHBondContact N-OD2 2.82Å; A337-D340 PolarHBondContact N-OD2 3Å; A337-D340 WeakPolarHBondContact O-CB 3.02Å; A337-D340 PolarHBondContact O-N 2.04Å; A337-D340 VanDerWaalsContact O-N 3.14Å; H338-D340 PolarHBondContact O-N 2.86Å
341	C	80.6	Confident	80.4	Confident	4 Å²	4	74.1 Å²	74.1	3%	0.027	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-106.9	150.5	-180	-59.2	0	0	0	0	111.2	H338 E339 M345 C352 K374	H338-C341 PolarHBondContact O-N 3.33Å; E339-C341 VanDerWaalsContact C-N 3.34Å; C341-M345 HydrophobicContact CB-CB 3.73Å; C341-C352 WeakPolarHBondContact CA-SG 3.16Å; C341-C352 HydrophobicContact CB-CB 3.72Å; C341-C352 WeakPolarHBondContact CB-SG 3.38Å; C341-C352 WeakPolarHBondContact SG-CA 3.29Å; C341-C352 WeakPolarHBondContact SG-CB 3.41Å; C341-C352 CovalentContact SG-SG 2.04Å; C341-C352 PolarHBondContact SG-SG 2.91Å; C341-K374 PolarHBondContact O-NZ 3.04Å
342	D	80.6	Confident	81.1	Confident	69 Å²	69	68.9 Å²	68.9	37%	0.369	33%	0.334	S	S	.	.			trans	-52.3	160.3	176.5	-153	-4.2	0	0	0	112.4	T328 G329 D344 M345 K374	T328-D342 HydrophobicContact CG2-CB 4.38Å; G329-D342 PolarHBondContact O-N 3.22Å; D342-D344 PolarHBondContact O-N 2.04Å; D342-M345 HydrophobicContact CB-CE 3.37Å; D342-M345 PolarHBondContact O-N 2.69Å; D342-K374 PolarHBondContact O-NZ 3.18Å
343	E	76.8	Confident	82.3	Confident	153 Å²	153	72.8 Å²	72.8	72%	0.715	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	-40.5	-166.6	-66.9	-173.7	172.3	0	0	113.1	K374 W379	E343-K374 PolarHBondContact O-NZ 3.47Å; E343-W379 VanDerWaalsContact O-CH2 3.28Å; E343-W379 WeakPolarHBondContact O-CH2 3.23Å
344	D	83.4	Confident	83.3	Confident	75 Å²	75	74.9 Å²	74.9	40%	0.401	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	18.9	-176.7	67.5	-23.6	0	0	0	115.3	D342 A355 W379	D342-D344 PolarHBondContact O-N 2.04Å; D344-A355 PolarHBondContact O-N 3.29Å; D344-W379 HydrophobicContact CB-CZ3 4.49Å
345	M	86.9	Confident	84.1	Confident	6 Å²	6	66.6 Å²	66.6	3%	0.03	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.4	-174.3	-67	-162.3	-73.4	0	0	115.2	G329 T330 L331 C341 D342 C352 R353 Q354 K374	G329-M345 WeakPolarHBondContact O-CE 3.27Å; T330-M345 VanDerWaalsContact CA-CE 3.44Å; L331-M345 HydrophobicContact CB-SD 4.12Å; L331-M345 HydrophobicContact CD1-SD 4.32Å; C341-M345 HydrophobicContact CB-CB 3.73Å; D342-M345 HydrophobicContact CB-CE 3.37Å; D342-M345 PolarHBondContact O-N 2.69Å; M345-C352 HydrophobicContact CE-CB 4.14Å; M345-C352 HydrophobicContact SD-CB 4.04Å; M345-R353 CarbonylContact C-O 3.58Å; M345-R353 WeakPolarHBondContact CA-O 3.22Å; M345-R353 VanDerWaalsContact CB-O 3.24Å; M345-R353 WeakPolarHBondContact CB-O 3.42Å; M345-Q354 HydrophobicContact CG-CG 4.48Å; M345-K374 WeakPolarHBondContact O-CD 3.42Å; M345-K374 PolarHBondContact O-NZ 2.95Å
346	L	89.2	Confident	84.4	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	147.4	172.6	-69.4	178.8	0	0	0	111.6	H338 Q348 C352 R353 A355 G372 K374 W379 Y381	H338-L346 HydrophobicContact CB-CD2 3.96Å; L346-Q348 PolarHBondContact O-N 3.38Å; L346-C352 CarbonylContact O-C 3.59Å; L346-C352 WeakPolarHBondContact O-CA 3.29Å; L346-R353 PolarHBondContact N-O 3.09Å; L346-R353 PolarHBondContact O-N 3.27Å; L346-A355 HydrophobicContact CB-CB 4.21Å; L346-A355 HydrophobicContact CD1-CB 3.76Å; L346-A355 HydrophobicContact CG-CB 3.63Å; L346-G372 VanDerWaalsContact CD1-N 3.31Å; L346-K374 HydrophobicContact CD2-CB 3.78Å; L346-K374 HydrophobicContact CD2-CD 4.18Å; L346-W379 HydrophobicContact CD1-CB 3.66Å; L346-W379 WeakPolarHBondContact CD1-O 3.02Å; L346-W379 HydrophobicContact CD2-CB 3.95Å; L346-W379 HydrophobicContact CD2-CG 4.35Å; L346-W379 HydrophobicContact CG-CB 3.86Å; L346-Y381 HydrophobicContact CB-CE1 3.7Å; L346-Y381 HydrophobicContact CD1-CD1 4.49Å; L346-Y381 HydrophobicContact CD1-CE1 4.01Å; L346-Y381 HydrophobicContact CD1-CE2 4.43Å
347	C	88.7	Confident	84.6	Confident	17 Å²	17	66.3 Å²	66.3	12%	0.115	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	108.2	170.2	-171.4	0	0	0	0	112	C335 A337 H338	C335-C347 HydrophobicContact CB-CB 3.71Å; C335-C347 WeakPolarHBondContact CB-SG 3.4Å; C335-C347 PolarHBondContact O-SG 2.74Å; C335-C347 VanDerWaalsContact O-SG 3.41Å; C335-C347 WeakPolarHBondContact SG-CA 3.33Å; C335-C347 WeakPolarHBondContact SG-CB 3.17Å; C335-C347 CovalentContact SG-SG 2.02Å; C335-C347 PolarHBondContact SG-SG 3.48Å; A337-C347 VanDerWaalsContact O-CB 3.31Å; A337-C347 WeakPolarHBondContact O-CB 3.42Å; H338-C347 PolarHBondContact CE1-O 3.27Å; H338-C347 VanDerWaalsContact CE1-O 3.22Å; H338-C347 PolarHBondContact ND1-N 3.18Å; H338-C347 PolarHBondContact ND1-O 3.34Å
348	Q	86.8	Confident	84.5	Confident	44 Å²	44	65.7 Å²	65.7	21%	0.206	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.3	176.4	-160.5	-176.3	37.5	0	0	110.6	L346 K350 R351 R353 Y381	L346-Q348 PolarHBondContact O-N 3.38Å; Q348-K350 PolarHBondContact O-N 3.33Å; Q348-R351 PolarHBondContact N-O 3.44Å; Q348-R351 PolarHBondContact O-N 2.93Å; Q348-R353 HydrophobicContact CB-CG 4.22Å; Q348-Y381 HydrophobicContact CB-CE1 3.64Å; Q348-Y381 WeakPolarHBondContact CB-OH 3.38Å; Q348-Y381 HydrophobicContact CG-CE1 3.98Å; Q348-Y381 HydrophobicContact CG-CE2 4.18Å; Q348-Y381 WeakPolarHBondContact CG-OH 3.37Å
349	R	84	Confident	84	Confident	205 Å²	205	69.8 Å²	69.8	77%	0.774	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	43.5	178.8	-63	178.4	178.3	159.6	1.2	112.4	R351	R349-R351 VanDerWaalsContact C-N 3.25Å; R349-R351 PolarHBondContact O-N 2.88Å
350	K	83.3	Confident	84	Confident	162 Å²	162	69.1 Å²	69.1	70%	0.704	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	21.3	-176.5	-51.4	-178.1	177.2	-177.1	0	114.9	K334 C335 Q348	K334-K350 CarbonylContact C-O 3.56Å; K334-K350 WeakPolarHBondContact CA-O 3.37Å; C335-K350 PolarHBondContact N-O 3.37Å; C335-K350 WeakPolarHBondContact O-CA 3.44Å; Q348-K350 PolarHBondContact O-N 3.33Å
351	R	79.1	Confident	84.4	Confident	140 Å²	140	70.1 Å²	70.1	53%	0.528	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.8	172.1	-69.2	-174	175.9	-106.4	8.9	112.5	G332 T333 C335 Q348 R349	G332-R351 WeakPolarHBondContact O-CD 3.5Å; G332-R351 PolarHBondContact O-NH1 2.73Å; T333-R351 CarbonylContact O-C 3.58Å; T333-R351 WeakPolarHBondContact O-CA 3.4Å; C335-R351 VanDerWaalsContact SG-CA 3.5Å; C335-R351 PolarHBondContact SG-N 2.9Å; Q348-R351 PolarHBondContact N-O 3.44Å; Q348-R351 PolarHBondContact O-N 2.93Å; R349-R351 VanDerWaalsContact C-N 3.25Å; R349-R351 PolarHBondContact O-N 2.88Å
352	C	84.8	Confident	85	Confident	0 Å²	0	70 Å²	70	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.5	176.1	-64.8	0	0	0	0	111.1	T330 G332 T333 C341 M345 L346	T330-C352 WeakPolarHBondContact O-CB 3.39Å; G332-C352 PolarHBondContact N-O 3.06Å; T333-C352 PolarHBondContact O-N 2.88Å; C341-C352 WeakPolarHBondContact CA-SG 3.16Å; C341-C352 HydrophobicContact CB-CB 3.72Å; C341-C352 WeakPolarHBondContact CB-SG 3.38Å; C341-C352 WeakPolarHBondContact SG-CA 3.29Å; C341-C352 WeakPolarHBondContact SG-CB 3.41Å; C341-C352 CovalentContact SG-SG 2.04Å; C341-C352 PolarHBondContact SG-SG 2.91Å; M345-C352 HydrophobicContact CE-CB 4.14Å; M345-C352 HydrophobicContact SD-CB 4.04Å; L346-C352 CarbonylContact O-C 3.59Å; L346-C352 WeakPolarHBondContact O-CA 3.29Å
353	R	85.8	Confident	85.4	Confident	107 Å²	107	74 Å²	74	40%	0.404	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148.5	177.6	-73	-143	-176.9	178.7	-7.8	110.9	M345 L346 Q348 Y381	M345-R353 CarbonylContact C-O 3.58Å; M345-R353 WeakPolarHBondContact CA-O 3.22Å; M345-R353 VanDerWaalsContact CB-O 3.24Å; M345-R353 WeakPolarHBondContact CB-O 3.42Å; L346-R353 PolarHBondContact N-O 3.09Å; L346-R353 PolarHBondContact O-N 3.27Å; Q348-R353 HydrophobicContact CB-CG 4.22Å; R353-Y381 HydrophobicContact CB-CD1 4.13Å; R353-Y381 HydrophobicContact CB-CE1 4.14Å
354	Q	87.2	Confident	86.1	Confident	82 Å²	82	72.3 Å²	72.3	38%	0.383	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	134.9	173.3	-78.1	179.1	-36.8	0	0	111.7	L331 M345 E382	L331-Q354 HydrophobicContact CD1-CG 4.34Å; M345-Q354 HydrophobicContact CG-CG 4.48Å; Q354-E382 HydrophobicContact CB-CB 4.43Å; Q354-E382 PolarHBondContact O-N 2.95Å; Q354-E382 PolarHBondContact OE1-OE2 2.78Å
355	A	88.6	Confident	86.3	Confident	6 Å²	6	72.6 Å²	72.6	5%	0.05	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	150.4	175.8	0	0	0	0	0	109.6	D344 L346 W379 E380	D344-A355 PolarHBondContact O-N 3.29Å; L346-A355 HydrophobicContact CB-CB 4.21Å; L346-A355 HydrophobicContact CD1-CB 3.76Å; L346-A355 HydrophobicContact CG-CB 3.63Å; A355-W379 HydrophobicContact CB-CB 3.99Å; A355-W379 HydrophobicContact CB-CE3 4.03Å; A355-W379 WeakPolarHBondContact O-CZ3 3.37Å; A355-E380 CarbonylContact C-O 3.36Å; A355-E380 WeakPolarHBondContact CA-O 3.35Å; A355-E380 WeakPolarHBondContact CB-O 3.34Å
356	I	86.5	Confident	86.4	Confident	77 Å²	77	76.7 Å²	76.7	40%	0.395	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.3	178.3	-58.6	175	0	0	0	107.5	T358 W379 E380 E382	I356-T358 PolarHBondContact O-N 3.49Å; I356-W379 CarbonylContact O-C 3.53Å; I356-W379 WeakPolarHBondContact O-CA 3.27Å; I356-E380 PolarHBondContact N-O 3.3Å; I356-E380 PolarHBondContact O-N 3.35Å; I356-E382 HydrophobicContact CD1-CB 4.05Å; I356-E382 HydrophobicContact CD1-CG 3.68Å; I356-E382 HydrophobicContact CG1-CB 4.09Å; I356-E382 HydrophobicContact CG1-CG 4.23Å
357	P	88.2	Confident	86.4	Confident	47 Å²	47	80.3 Å²	80.3	31%	0.305	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.4	177.4	28.2	-32.7	0	0	0	110.3	I377 W379	P357-I377 HydrophobicContact CB-CG2 4.41Å; P357-W379 HydrophobicContact CB-CD2 3.98Å; P357-W379 HydrophobicContact CB-CE3 4.14Å; P357-W379 HydrophobicContact CB-CH2 4.19Å; P357-W379 HydrophobicContact CB-CZ2 4.02Å; P357-W379 HydrophobicContact CB-CZ3 4.24Å; P357-W379 VanDerWaalsContact CD-CZ3 3.5Å; P357-W379 HydrophobicContact CG-CE3 4.45Å; P357-W379 HydrophobicContact CG-CH2 4.16Å; P357-W379 HydrophobicContact CG-CZ2 4.45Å; P357-W379 HydrophobicContact CG-CZ3 4.16Å
358	T	84.5	Confident	86.5	Confident	23 Å²	23	80.2 Å²	80.2	14%	0.141	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-177.4	173.6	74.5	0	0	0	0	111.4	I356 M360 I377 C378 E380	I356-T358 PolarHBondContact O-N 3.49Å; T358-M360 PolarHBondContact OG1-N 3.38Å; T358-I377 VanDerWaalsContact O-CG2 3.3Å; T358-I377 WeakPolarHBondContact O-CG2 2.98Å; T358-C378 WeakPolarHBondContact CA-O 3.49Å; T358-C378 VanDerWaalsContact CB-O 3.22Å; T358-C378 WeakPolarHBondContact CB-O 3.38Å; T358-C378 HydrophobicContact CG2-CB 4.37Å; T358-C378 VanDerWaalsContact CG2-O 3.25Å; T358-C378 WeakPolarHBondContact CG2-O 3.5Å; T358-C378 PolarHBondContact N-O 2.89Å; T358-C378 VanDerWaalsContact OG1-CB 3.3Å; T358-C378 WeakPolarHBondContact OG1-CB 3.5Å; T358-C378 PolarHBondContact OG1-O 2.97Å; T358-E380 HydrophobicContact CG2-CB 3.79Å; T358-E380 HydrophobicContact CG2-CG 3.36Å; T358-E380 WeakPolarHBondContact CG2-OE1 3.46Å
359	Q	76.8	Confident	86.1	Confident	104 Å²	104	83.3 Å²	83.3	49%	0.486	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	2.3	170.4	-61.2	-175.9	9.6	0	0	113.3	L70	L70-Q359 HydrophobicContact CD2-CG 3.73Å; L70-Q359 HydrophobicContact CG-CG 4.47Å
360	M	83.5	Confident	85.9	Confident	93 Å²	93	76.6 Å²	76.6	46%	0.458	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.8	-174.6	-167.2	178.3	-52.2	0	0	110	T358 C378	T358-M360 PolarHBondContact OG1-N 3.38Å; M360-C378 HydrophobicContact CB-CB 4.16Å; M360-C378 PolarHBondContact O-N 2.74Å
361	E	87.3	Confident	86.1	Confident	58 Å²	58	69.9 Å²	69.9	27%	0.271	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	152.2	169.2	-73.6	-159.9	165.4	0	0	111.4	K104 N376	K104-E361 VanDerWaalsContact CB-CD 3.49Å; K104-E361 HydrophobicContact CB-CG 4.06Å; K104-E361 WeakPolarHBondContact CB-OE1 3.38Å; K104-E361 HydrophobicContact CD-CG 4.01Å; K104-E361 WeakPolarHBondContact CD-OE1 3.08Å; K104-E361 WeakPolarHBondContact CD-OE2 3.34Å; K104-E361 WeakPolarHBondContact CE-OE2 3.47Å; K104-E361 HydrophobicContact CG-CG 4.13Å; K104-E361 IonicContact NZ-OE2 2.82Å; K104-E361 PolarHBondContact NZ-OE2 2.84Å; E361-N376 WeakPolarHBondContact CA-O 3.29Å
362	C	92.9	Very high	86.7	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.02	34%	0.336	C	S	.	.			trans	-145.8	157.2	176.1	55.7	0	0	0	0	111.5	E367 C373 N376 I377 C378	C362-E367 VanDerWaalsContact CA-OE2 3.28Å; C362-E367 WeakPolarHBondContact CA-OE2 3.34Å; C362-E367 HydrophobicContact CB-CB 3.97Å; C362-C373 HydrophobicContact CB-CB 3.85Å; C362-C373 WeakPolarHBondContact CB-SG 3.43Å; C362-C373 PolarHBondContact O-SG 2.73Å; C362-C373 WeakPolarHBondContact SG-CA 3.31Å; C362-C373 WeakPolarHBondContact SG-CB 3Å; C362-C373 CovalentContact SG-SG 2.03Å; C362-C373 PolarHBondContact SG-SG 3.19Å; C362-N376 PolarHBondContact N-O 2.91Å; C362-N376 VanDerWaalsContact N-O 3.13Å; C362-N376 WeakPolarHBondContact O-CA 3.36Å; C362-I377 PolarHBondContact SG-O 2.76Å; C362-C378 VanDerWaalsContact CB-SG 3.52Å; C362-C378 PolarHBondContact SG-N 2.99Å
363	L	89.6	Confident	87.1	Confident	151 Å²	151	63.9 Å²	63.9	79%	0.791	34%	0.341	S	S	*	.	S	Bend	trans	-106.4	-16	167.2	-65	174.3	0	0	0	112.9	E367	L363-E367 PolarHBondContact N-OE2 2.72Å
364	K	90.8	Very high	87.3	Confident	118 Å²	118	59 Å²	59	51%	0.513	32%	0.323	S	S	.	.	S	Bend	trans	-160.1	156.4	-175.9	51	175.6	179.8	171.4	0	110.4	S366 E367	K364-S366 WeakPolarHBondContact CD-OG 3.18Å; K364-S366 WeakPolarHBondContact CE-OG 3.39Å; K364-S366 WeakPolarHBondContact CG-OG 3.44Å; K364-S366 PolarHBondContact O-N 3.15Å; K364-S366 VanDerWaalsContact O-N 3.08Å; K364-E367 WeakPolarHBondContact CE-OE1 3.41Å; K364-E367 HydrophobicContact CG-CG 4.07Å; K364-E367 VanDerWaalsContact CG-OE1 3.24Å; K364-E367 WeakPolarHBondContact CG-OE1 3.3Å; K364-E367 WeakPolarHBondContact O-CB 3.4Å; K364-E367 PolarHBondContact O-N 3.5Å
365	D	88.9	Confident	87.3	Confident	81 Å²	81	61.1 Å²	61.1	43%	0.433	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-56.9	-30.7	-175.2	-57.6	-17.8	0	0	0	114	H338 E367 C368 C373	H338-D365 IonicContact CD2-OD1 2.96Å; H338-D365 IonicContact NE2-OD1 2.73Å; H338-D365 PolarHBondContact NE2-OD1 3.32Å; H338-D365 IonicContact NE2-OD2 2.56Å; D365-E367 PolarHBondContact O-N 3.49Å; D365-C368 WeakPolarHBondContact O-CB 3.45Å; D365-C368 PolarHBondContact O-N 3.44Å; D365-C373 WeakPolarHBondContact OD1-CB 3.23Å; D365-C373 PolarHBondContact OD1-N 3.07Å
366	S	88.7	Confident	87.3	Confident	92 Å²	92	65.4 Å²	65.4	64%	0.643	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-64.3	-13.1	-180	64.8	0	0	0	0	114.4	K364 C368	K364-S366 WeakPolarHBondContact CD-OG 3.18Å; K364-S366 WeakPolarHBondContact CE-OG 3.39Å; K364-S366 WeakPolarHBondContact CG-OG 3.44Å; K364-S366 PolarHBondContact O-N 3.15Å; K364-S366 VanDerWaalsContact O-N 3.08Å; S366-C368 VanDerWaalsContact C-N 3.34Å
367	E	89.7	Confident	87.4	Confident	76 Å²	76	63.6 Å²	63.6	36%	0.355	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-86.6	-9.9	176.5	-66	168.3	-154.4	0	0	111.9	C362 L363 K364 D365	C362-E367 VanDerWaalsContact CA-OE2 3.28Å; C362-E367 WeakPolarHBondContact CA-OE2 3.34Å; C362-E367 HydrophobicContact CB-CB 3.97Å; L363-E367 PolarHBondContact N-OE2 2.72Å; K364-E367 WeakPolarHBondContact CE-OE1 3.41Å; K364-E367 HydrophobicContact CG-CG 4.07Å; K364-E367 VanDerWaalsContact CG-OE1 3.24Å; K364-E367 WeakPolarHBondContact CG-OE1 3.3Å; K364-E367 WeakPolarHBondContact O-CB 3.4Å; K364-E367 PolarHBondContact O-N 3.5Å; D365-E367 PolarHBondContact O-N 3.49Å
368	C	89	Confident	87.6	Confident	15 Å²	15	61.5 Å²	61.5	10%	0.101	33%	0.33	C	S	.	.			trans	-102	135.1	-178.4	-52.8	0	0	0	0	111.1	D365 S366 C378	D365-C368 WeakPolarHBondContact O-CB 3.45Å; D365-C368 PolarHBondContact O-N 3.44Å; S366-C368 VanDerWaalsContact C-N 3.34Å; C368-C378 WeakPolarHBondContact CA-SG 3.35Å; C368-C378 HydrophobicContact CB-CB 3.77Å; C368-C378 WeakPolarHBondContact CB-SG 3.46Å; C368-C378 WeakPolarHBondContact SG-CA 3.25Å; C368-C378 WeakPolarHBondContact SG-CB 2.99Å; C368-C378 CovalentContact SG-SG 2.05Å; C368-C378 PolarHBondContact SG-SG 2.94Å
369	S	80.2	Confident	88	Confident	109 Å²	109	61.7 Å²	61.7	76%	0.762	33%	0.328	S	S	*	.	S	Bend	trans	-71.7	-53.4	-171.8	-63.5	0	0	0	0	112.8
370	N	79.3	Confident	88.5	Confident	65 Å²	65	60.8 Å²	60.8	35%	0.348	32%	0.324	S	S	.	.	S	Bend	trans	-136.6	80.6	177.2	-176.8	21.8	0	0	0	110.9	E380 Y381 E383	N370-E380 VanDerWaalsContact O-CA 3.25Å; N370-E380 WeakPolarHBondContact O-CA 3.08Å; N370-Y381 PolarHBondContact O-N 3.08Å; N370-Y381 VanDerWaalsContact O-N 3.1Å; N370-E383 PolarHBondContact ND2-OE1 2.87Å
371	G	87.8	Confident	88.6	Confident	20 Å²	20	57.8 Å²	57.8	21%	0.206	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.7	-146.5	-162.9	0	0	0	0	0	115.1	W379 Y381	G371-W379 CarbonylContact C-O 3.56Å; G371-W379 WeakPolarHBondContact CA-O 3.47Å; G371-Y381 VanDerWaalsContact CA-CE2 3.48Å
372	G	90.3	Very high	87.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	161.7	-179.8	0	0	0	0	0	111.4	H338 L346 W379	H338-G372 WeakPolarHBondContact NE2-CA 3.21Å; L346-G372 VanDerWaalsContact CD1-N 3.31Å; G372-W379 PolarHBondContact N-O 3.44Å; G372-W379 PolarHBondContact O-N 2.97Å
373	C	93.1	Very high	86	Confident	15 Å²	15	66 Å²	66	10%	0.101	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	113.4	-179.5	-166.3	0	0	0	0	109.8	C362 D365	C362-C373 HydrophobicContact CB-CB 3.85Å; C362-C373 WeakPolarHBondContact CB-SG 3.43Å; C362-C373 PolarHBondContact O-SG 2.73Å; C362-C373 WeakPolarHBondContact SG-CA 3.31Å; C362-C373 WeakPolarHBondContact SG-CB 3Å; C362-C373 CovalentContact SG-SG 2.03Å; C362-C373 PolarHBondContact SG-SG 3.19Å; D365-C373 WeakPolarHBondContact OD1-CB 3.23Å; D365-C373 PolarHBondContact OD1-N 3.07Å
374	K	89.8	Confident	83.9	Confident	3 Å²	3	64.1 Å²	64.1	1%	0.013	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	129.7	177.7	-168	-171.8	-174.4	-179.6	0	108.8	H338 C341 D342 E343 M345 L346 N376 I377 W379	H338-K374 HydrophobicContact CB-CB 4.26Å; H338-K374 HydrophobicContact CB-CD 4.25Å; H338-K374 HydrophobicContact CB-CG 4.12Å; H338-K374 WeakPolarHBondContact O-CE 2.92Å; H338-K374 PolarHBondContact O-NZ 3.01Å; C341-K374 PolarHBondContact O-NZ 3.04Å; D342-K374 PolarHBondContact O-NZ 3.18Å; E343-K374 PolarHBondContact O-NZ 3.47Å; M345-K374 WeakPolarHBondContact O-CD 3.42Å; M345-K374 PolarHBondContact O-NZ 2.95Å; L346-K374 HydrophobicContact CD2-CB 3.78Å; L346-K374 HydrophobicContact CD2-CD 4.18Å; K374-N376 VanDerWaalsContact C-N 3.28Å; K374-N376 PolarHBondContact O-N 3.32Å; K374-I377 PolarHBondContact N-O 3.24Å; K374-I377 PolarHBondContact O-N 3.03Å; K374-I377 VanDerWaalsContact O-O 3.08Å; K374-W379 HydrophobicContact CB-CG 4.35Å; K374-W379 VanDerWaalsContact O-CD1 3.32Å; K374-W379 PolarHBondContact O-NE1 3.02Å
375	F	87.1	Confident	81.3	Confident	128 Å²	128	64.6 Å²	64.6	56%	0.561	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	36.9	-174.7	-49.4	-60	0	0	0	114.2	I377 W379	F375-I377 PolarHBondContact O-N 2.63Å; F375-W379 HydrophobicContact CD2-CZ2 4.32Å
376	N	89.6	Confident	78.8	Confident	96 Å²	96	65.3 Å²	65.3	51%	0.513	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	15.7	-178.2	-52.2	-49.9	0	0	0	115.6	E361 C362 K374	E361-N376 WeakPolarHBondContact CA-O 3.29Å; C362-N376 PolarHBondContact N-O 2.91Å; C362-N376 VanDerWaalsContact N-O 3.13Å; C362-N376 WeakPolarHBondContact O-CA 3.36Å; K374-N376 VanDerWaalsContact C-N 3.28Å; K374-N376 PolarHBondContact O-N 3.32Å
377	I	89.6	Confident	76.5	Confident	39 Å²	39	65.3 Å²	65.3	20%	0.2	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.5	177.9	-57.1	167.7	0	0	0	107	I105 P357 T358 C362 K374 F375 W379	I105-I377 HydrophobicContact CD1-CD1 3.93Å; P357-I377 HydrophobicContact CB-CG2 4.41Å; T358-I377 VanDerWaalsContact O-CG2 3.3Å; T358-I377 WeakPolarHBondContact O-CG2 2.98Å; C362-I377 PolarHBondContact SG-O 2.76Å; K374-I377 PolarHBondContact N-O 3.24Å; K374-I377 PolarHBondContact O-N 3.03Å; K374-I377 VanDerWaalsContact O-O 3.08Å; F375-I377 PolarHBondContact O-N 2.63Å; I377-W379 PolarHBondContact O-N 2.94Å
378	C	91.8	Very high	74.3	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.014	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	125.1	169.3	-80.1	0	0	0	0	108.2	T358 M360 C362 C368	T358-C378 WeakPolarHBondContact CA-O 3.49Å; T358-C378 VanDerWaalsContact CB-O 3.22Å; T358-C378 WeakPolarHBondContact CB-O 3.38Å; T358-C378 HydrophobicContact CG2-CB 4.37Å; T358-C378 VanDerWaalsContact CG2-O 3.25Å; T358-C378 WeakPolarHBondContact CG2-O 3.5Å; T358-C378 PolarHBondContact N-O 2.89Å; T358-C378 VanDerWaalsContact OG1-CB 3.3Å; T358-C378 WeakPolarHBondContact OG1-CB 3.5Å; T358-C378 PolarHBondContact OG1-O 2.97Å; M360-C378 HydrophobicContact CB-CB 4.16Å; M360-C378 PolarHBondContact O-N 2.74Å; C362-C378 VanDerWaalsContact CB-SG 3.52Å; C362-C378 PolarHBondContact SG-N 2.99Å; C368-C378 WeakPolarHBondContact CA-SG 3.35Å; C368-C378 HydrophobicContact CB-CB 3.77Å; C368-C378 WeakPolarHBondContact CB-SG 3.46Å; C368-C378 WeakPolarHBondContact SG-CA 3.25Å; C368-C378 WeakPolarHBondContact SG-CB 2.99Å; C368-C378 CovalentContact SG-SG 2.05Å; C368-C378 PolarHBondContact SG-SG 2.94Å
379	W	91.7	Very high	72.6	Confident	28 Å²	28	71.8 Å²	71.8	11%	0.106	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.2	169.5	-72.2	71.9	0	0	0	107.2	E343 D344 L346 A355 I356 P357 G371 G372 K374 F375 I377	E343-W379 VanDerWaalsContact O-CH2 3.28Å; E343-W379 WeakPolarHBondContact O-CH2 3.23Å; D344-W379 HydrophobicContact CB-CZ3 4.49Å; L346-W379 HydrophobicContact CD1-CB 3.66Å; L346-W379 WeakPolarHBondContact CD1-O 3.02Å; L346-W379 HydrophobicContact CD2-CB 3.95Å; L346-W379 HydrophobicContact CD2-CG 4.35Å; L346-W379 HydrophobicContact CG-CB 3.86Å; A355-W379 HydrophobicContact CB-CB 3.99Å; A355-W379 HydrophobicContact CB-CE3 4.03Å; A355-W379 WeakPolarHBondContact O-CZ3 3.37Å; I356-W379 CarbonylContact O-C 3.53Å; I356-W379 WeakPolarHBondContact O-CA 3.27Å; P357-W379 HydrophobicContact CB-CD2 3.98Å; P357-W379 HydrophobicContact CB-CE3 4.14Å; P357-W379 HydrophobicContact CB-CH2 4.19Å; P357-W379 HydrophobicContact CB-CZ2 4.02Å; P357-W379 HydrophobicContact CB-CZ3 4.24Å; P357-W379 VanDerWaalsContact CD-CZ3 3.5Å; P357-W379 HydrophobicContact CG-CE3 4.45Å; P357-W379 HydrophobicContact CG-CH2 4.16Å; P357-W379 HydrophobicContact CG-CZ2 4.45Å; P357-W379 HydrophobicContact CG-CZ3 4.16Å; G371-W379 CarbonylContact C-O 3.56Å; G371-W379 WeakPolarHBondContact CA-O 3.47Å; G372-W379 PolarHBondContact N-O 3.44Å; G372-W379 PolarHBondContact O-N 2.97Å; K374-W379 HydrophobicContact CB-CG 4.35Å; K374-W379 VanDerWaalsContact O-CD1 3.32Å; K374-W379 PolarHBondContact O-NE1 3.02Å; F375-W379 HydrophobicContact CD2-CZ2 4.32Å; I377-W379 PolarHBondContact O-N 2.94Å
380	E	87.6	Confident	71.8	Confident	84 Å²	84	74.3 Å²	74.3	39%	0.393	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	136.4	173.3	-84.5	168	-170	0	0	108.5	A355 I356 T358 N370 E382	A355-E380 CarbonylContact C-O 3.36Å; A355-E380 WeakPolarHBondContact CA-O 3.35Å; A355-E380 WeakPolarHBondContact CB-O 3.34Å; I356-E380 PolarHBondContact N-O 3.3Å; I356-E380 PolarHBondContact O-N 3.35Å; T358-E380 HydrophobicContact CG2-CB 3.79Å; T358-E380 HydrophobicContact CG2-CG 3.36Å; T358-E380 WeakPolarHBondContact CG2-OE1 3.46Å; N370-E380 VanDerWaalsContact O-CA 3.25Å; N370-E380 WeakPolarHBondContact O-CA 3.08Å; E380-E382 PolarHBondContact O-N 2.83Å
381	Y	85.5	Confident	71.2	Confident	30 Å²	30	71.9 Å²	71.9	12%	0.118	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	138.8	171.7	-68.3	-71.2	0	0	0	108.7	L346 Q348 R353 N370 G371 E383	L346-Y381 HydrophobicContact CB-CE1 3.7Å; L346-Y381 HydrophobicContact CD1-CD1 4.49Å; L346-Y381 HydrophobicContact CD1-CE1 4.01Å; L346-Y381 HydrophobicContact CD1-CE2 4.43Å; Q348-Y381 HydrophobicContact CB-CE1 3.64Å; Q348-Y381 WeakPolarHBondContact CB-OH 3.38Å; Q348-Y381 HydrophobicContact CG-CE1 3.98Å; Q348-Y381 HydrophobicContact CG-CE2 4.18Å; Q348-Y381 WeakPolarHBondContact CG-OH 3.37Å; R353-Y381 HydrophobicContact CB-CD1 4.13Å; R353-Y381 HydrophobicContact CB-CE1 4.14Å; N370-Y381 PolarHBondContact O-N 3.08Å; N370-Y381 VanDerWaalsContact O-N 3.1Å; G371-Y381 VanDerWaalsContact CA-CE2 3.48Å; Y381-E383 PolarHBondContact O-N 3.32Å
382	E	71.3	Confident	69.9	Low	93 Å²	93	75 Å²	75	44%	0.435	39%	0.388	S	S	.	.			trans	-64.9	91.3	176.3	-174.2	172	-156.4	0	0	108.5	Q354 I356 E380 K384	Q354-E382 HydrophobicContact CB-CB 4.43Å; Q354-E382 PolarHBondContact O-N 2.95Å; Q354-E382 PolarHBondContact OE1-OE2 2.78Å; I356-E382 HydrophobicContact CD1-CB 4.05Å; I356-E382 HydrophobicContact CD1-CG 3.68Å; I356-E382 HydrophobicContact CG1-CB 4.09Å; I356-E382 HydrophobicContact CG1-CG 4.23Å; E380-E382 PolarHBondContact O-N 2.83Å; E382-K384 PolarHBondContact O-N 2.58Å
383	E	54.9	Low	68.6	Low	142 Å²	142	79.8 Å²	79.8	66%	0.664	41%	0.411	S	S	*	.			trans	-66.6	89.5	167	-69.4	-173.8	-165	0	0	106.3	N370 Y381	N370-E383 PolarHBondContact ND2-OE1 2.87Å; Y381-E383 PolarHBondContact O-N 3.32Å
384	K	45.6	Very low	67	Low	110 Å²	110	81.1 Å²	81.1	48%	0.478	42%	0.416	S	S	.	.			trans	-46.3	136.3	151.6	-76.5	-178.2	179.9	175.1	0	105.7	E382 I386	E382-K384 PolarHBondContact O-N 2.58Å; K384-I386 WeakPolarHBondContact O-CG1 3.16Å; K384-I386 PolarHBondContact O-N 2.81Å
385	P	36.1	Very low	65.8	Low	128 Å²	128	87.4 Å²	87.4	83%	0.831	45%	0.45	S	S	*	.			trans	-64.1	85.8	-175.2	26.1	-33.2	0	0	0	109.1	V387	P385-V387 VanDerWaalsContact C-N 3.27Å; P385-V387 PolarHBondContact O-N 2.96Å
386	I	36.7	Very low	64.8	Low	96 Å²	96	83.5 Å²	83.5	49%	0.492	43%	0.433	S	S	.	.			trans	-83.7	89.9	163.5	-57.7	167.1	0	0	0	101.2	K384 E388	K384-I386 WeakPolarHBondContact O-CG1 3.16Å; K384-I386 PolarHBondContact O-N 2.81Å; I386-E388 VanDerWaalsContact C-N 3.29Å; I386-E388 PolarHBondContact O-N 2.97Å
387	V	39.4	Very low	63.5	Low	92 Å²	92	79.8 Å²	79.8	56%	0.558	41%	0.414	S	S	*	.			trans	-50.2	112.5	150.5	176.4	0	0	0	0	103.6	P385 G389 R390	P385-V387 VanDerWaalsContact C-N 3.27Å; P385-V387 PolarHBondContact O-N 2.96Å; V387-G389 CarbonylContact O-C 3.51Å; V387-G389 PolarHBondContact O-N 2.9Å; V387-R390 HydrophobicContact CB-CB 4.21Å; V387-R390 HydrophobicContact CB-CG 4.18Å; V387-R390 HydrophobicContact CG1-CG 4.26Å; V387-R390 WeakPolarHBondContact O-CA 3.3Å; V387-R390 WeakPolarHBondContact O-CB 2.96Å; V387-R390 PolarHBondContact O-N 3.49Å
388	E	43.7	Very low	62.6	Low	193 Å²	193	81.7 Å²	81.7	90%	0.902	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.9	116.9	-166.9	-147.7	175.6	-169.1	0	0	111.1	I386	I386-E388 VanDerWaalsContact C-N 3.29Å; I386-E388 PolarHBondContact O-N 2.97Å
389	G	54.1	Low	61	Low	34 Å²	34	86 Å²	86	35%	0.351	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	18.6	-174.9	0	0	0	0	0	115.9	V387 V407	V387-G389 CarbonylContact O-C 3.51Å; V387-G389 PolarHBondContact O-N 2.9Å; G389-V407 WeakPolarHBondContact O-CA 3.15Å; G389-V407 VanDerWaalsContact O-CB 3.31Å; G389-V407 WeakPolarHBondContact O-CB 3.35Å; G389-V407 VanDerWaalsContact O-CG1 3.25Å; G389-V407 WeakPolarHBondContact O-CG1 3.15Å; G389-V407 WeakPolarHBondContact O-CG2 3Å
390	R	61.9	Low	59.5	Low	163 Å²	163	92.3 Å²	92.3	62%	0.615	49%	0.491	S	S	*	.			trans	-115.1	143.5	170.3	-61.6	-167.3	-172.8	-177.6	2	115.2	V387 G406	V387-R390 HydrophobicContact CB-CB 4.21Å; V387-R390 HydrophobicContact CB-CG 4.18Å; V387-R390 HydrophobicContact CG1-CG 4.26Å; V387-R390 WeakPolarHBondContact O-CA 3.3Å; V387-R390 WeakPolarHBondContact O-CB 2.96Å; V387-R390 PolarHBondContact O-N 3.49Å; R390-G406 CarbonylContact C-O 3.52Å; R390-G406 WeakPolarHBondContact CA-O 3.41Å; R390-G406 WeakPolarHBondContact CB-O 3.37Å; R390-G406 VanDerWaalsContact CG-O 3.29Å; R390-G406 WeakPolarHBondContact CG-O 3.26Å
391	C	68.1	Low	58.6	Low	14 Å²	14	91.9 Å²	91.9	10%	0.095	49%	0.488	C	S	.	.			trans	-136.1	160.9	-177.9	63.1	0	0	0	0	110.3	H396 C403 G406 V407	C391-H396 HydrophobicContact CB-CB 3.88Å; C391-C403 HydrophobicContact CB-CB 3.54Å; C391-C403 WeakPolarHBondContact CB-SG 3.19Å; C391-C403 WeakPolarHBondContact SG-CA 3.38Å; C391-C403 WeakPolarHBondContact SG-CB 3.02Å; C391-C403 CovalentContact SG-SG 2Å; C391-C403 PolarHBondContact SG-SG 2.04Å; C391-G406 PolarHBondContact N-O 3.18Å; C391-G406 WeakPolarHBondContact O-CA 3.21Å; C391-G406 VanDerWaalsContact SG-CA 3.52Å; C391-V407 PolarHBondContact SG-N 3.19Å; C391-V407 PolarHBondContact SG-O 3.12Å
392	A	59	Low	57.4	Low	85 Å²	85	91.1 Å²	91.1	70%	0.702	49%	0.486	S	S	*	.	S	Bend	trans	-119.8	-24.6	171.6	0	0	0	0	0	111.5	H396	A392-H396 PolarHBondContact N-ND1 2.95Å; A392-H396 VanDerWaalsContact N-ND1 3.12Å
393	M	63	Low	57	Low	101 Å²	101	87.4 Å²	87.4	50%	0.498	47%	0.47	S	S	.	.	S	Bend	trans	-146.7	168.3	174.8	54.8	-175.5	136.2	0	0	109.3	D395 H396 C403	M393-D395 VanDerWaalsContact C-N 3.3Å; M393-D395 PolarHBondContact O-N 3.04Å; M393-H396 WeakPolarHBondContact CE-NE2 3Å; M393-H396 VanDerWaalsContact CG-CD2 3.43Å; M393-H396 WeakPolarHBondContact CG-CD2 3.49Å; M393-H396 WeakPolarHBondContact CG-NE2 3.26Å; M393-H396 VanDerWaalsContact O-CB 3.29Å; M393-H396 WeakPolarHBondContact O-CB 3.36Å; M393-H396 PolarHBondContact O-N 2.9Å; M393-H396 VanDerWaalsContact O-N 3.11Å; M393-C403 VanDerWaalsContact C-CB 3.47Å; M393-C403 VanDerWaalsContact O-CB 3.26Å; M393-C403 WeakPolarHBondContact O-CB 3.46Å
394	H	60.7	Low	57.4	Low	43 Å²	43	82.5 Å²	82.5	20%	0.199	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-65.9	-34.5	-171.1	-64.3	75.7	0	0	0	112.3	H396 C397 C403 K431	H394-H396 PolarHBondContact O-N 3.49Å; H394-C397 WeakPolarHBondContact O-CB 3.1Å; H394-C397 PolarHBondContact O-N 3.05Å; H394-C403 PolarHBondContact CD2-N 3.25Å; H394-C403 PolarHBondContact NE2-O 2.83Å; H394-K431 WeakPolarHBondContact CD2-CE 3.35Å; H394-K431 PolarHBondContact CD2-NZ 3.31Å; H394-K431 PolarHBondContact CE1-NZ 3.38Å; H394-K431 PolarHBondContact ND1-NZ 3.33Å; H394-K431 VanDerWaalsContact ND1-NZ 3.14Å; H394-K431 WeakPolarHBondContact NE2-CE 3.48Å; H394-K431 PolarHBondContact NE2-NZ 3.27Å
395	D	64.1	Low	58.2	Low	134 Å²	134	84.8 Å²	84.8	72%	0.717	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-63.6	-7.7	175.9	-57.8	1.7	0	0	0	113.7	M393 C397	M393-D395 VanDerWaalsContact C-N 3.3Å; M393-D395 PolarHBondContact O-N 3.04Å; D395-C397 VanDerWaalsContact C-N 3.29Å
396	H	66.5	Low	59.6	Low	47 Å²	47	79.7 Å²	79.7	22%	0.218	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-84	-5.1	172.2	-63.7	-168.2	0	0	0	112.9	C391 A392 M393 H394	C391-H396 HydrophobicContact CB-CB 3.88Å; A392-H396 PolarHBondContact N-ND1 2.95Å; A392-H396 VanDerWaalsContact N-ND1 3.12Å; M393-H396 WeakPolarHBondContact CE-NE2 3Å; M393-H396 VanDerWaalsContact CG-CD2 3.43Å; M393-H396 WeakPolarHBondContact CG-CD2 3.49Å; M393-H396 WeakPolarHBondContact CG-NE2 3.26Å; M393-H396 VanDerWaalsContact O-CB 3.29Å; M393-H396 WeakPolarHBondContact O-CB 3.36Å; M393-H396 PolarHBondContact O-N 2.9Å; M393-H396 VanDerWaalsContact O-N 3.11Å; H394-H396 PolarHBondContact O-N 3.49Å
397	C	63.1	Low	61.4	Low	17 Å²	17	78.3 Å²	78.3	12%	0.115	42%	0.424	C	S	.	.	S	Bend	trans	-107.6	147.5	-179.3	-60.9	0	0	0	0	110.6	H394 D395 K401 L402 C408	H394-C397 WeakPolarHBondContact O-CB 3.1Å; H394-C397 PolarHBondContact O-N 3.05Å; D395-C397 VanDerWaalsContact C-N 3.29Å; C397-K401 HydrophobicContact CB-CB 3.8Å; C397-K401 WeakPolarHBondContact CB-O 3.31Å; C397-L402 VanDerWaalsContact SG-C 3.57Å; C397-C408 WeakPolarHBondContact CA-SG 2.96Å; C397-C408 HydrophobicContact CB-CB 3.8Å; C397-C408 WeakPolarHBondContact CB-SG 3.26Å; C397-C408 WeakPolarHBondContact SG-CA 3.5Å; C397-C408 WeakPolarHBondContact SG-CB 3.38Å; C397-C408 CovalentContact SG-SG 2.04Å; C397-C408 PolarHBondContact SG-SG 3.17Å
398	D	70.7	Confident	62.8	Low	79 Å²	79	75.3 Å²	75.3	42%	0.422	41%	0.407	S	S	.	.			trans	-53.6	154.4	170.3	-70.6	-48.9	0	0	0	110.5	E400 K401	D398-E400 PolarHBondContact O-N 2.02Å; D398-K401 PolarHBondContact O-N 3.38Å
399	A	56.6	Low	64.1	Low	93 Å²	93	68.7 Å²	68.7	77%	0.769	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-6.7	-168.7	0	0	0	0	0	116.9
400	E	61.5	Low	64.6	Low	160 Å²	160	71.9 Å²	71.9	75%	0.748	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	3.6	178.2	-61	176.9	174.6	0	0	113.1	D398 P411	D398-E400 PolarHBondContact O-N 2.02Å; E400-P411 VanDerWaalsContact O-CD 3.23Å; E400-P411 WeakPolarHBondContact O-CD 3.26Å
401	K	67.8	Low	64.1	Low	75 Å²	75	65 Å²	65	33%	0.326	37%	0.369	S	S	.	.			trans	-123.2	150.1	-175.5	-67.8	175.4	-172	168.1	0	111.4	C397 D398 C408 V409 V410	C397-K401 HydrophobicContact CB-CB 3.8Å; C397-K401 WeakPolarHBondContact CB-O 3.31Å; D398-K401 PolarHBondContact O-N 3.38Å; K401-C408 HydrophobicContact CB-CB 4.12Å; K401-C408 HydrophobicContact CD-CB 4.1Å; K401-V409 CarbonylContact C-O 3.41Å; K401-V409 VanDerWaalsContact CA-O 3.23Å; K401-V409 WeakPolarHBondContact CA-O 3.32Å; K401-V410 HydrophobicContact CG-CG2 3.96Å
402	L	60.3	Low	63.3	Low	14 Å²	14	72.1 Å²	72.1	7%	0.073	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	148	178.8	-61.2	172.5	0	0	0	111.3	C397 H404 C408 V409 P411 K431 L432 T436	C397-L402 VanDerWaalsContact SG-C 3.57Å; L402-H404 PolarHBondContact O-N 2.72Å; L402-C408 CarbonylContact O-C 3.6Å; L402-C408 VanDerWaalsContact O-CA 3.32Å; L402-C408 WeakPolarHBondContact O-CA 3.27Å; L402-V409 PolarHBondContact N-O 2.83Å; L402-V409 PolarHBondContact O-N 2.97Å; L402-P411 HydrophobicContact CD1-CB 3.7Å; L402-P411 HydrophobicContact CD1-CG 3.9Å; L402-P411 HydrophobicContact CG-CB 4.46Å; L402-P411 HydrophobicContact CG-CG 4.19Å; L402-K431 HydrophobicContact CD2-CD 3.99Å; L402-K431 HydrophobicContact CD2-CG 3.99Å; L402-L432 HydrophobicContact CD2-CD1 3.7Å; L402-L432 HydrophobicContact CD2-CG 4.33Å; L402-T436 HydrophobicContact CD1-CG2 3.32Å
403	C	64.2	Low	62.7	Low	16 Å²	16	70.1 Å²	70.1	11%	0.108	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	105.1	174.3	-176.6	0	0	0	0	112.2	C391 M393 H394	C391-C403 HydrophobicContact CB-CB 3.54Å; C391-C403 WeakPolarHBondContact CB-SG 3.19Å; C391-C403 WeakPolarHBondContact SG-CA 3.38Å; C391-C403 WeakPolarHBondContact SG-CB 3.02Å; C391-C403 CovalentContact SG-SG 2Å; C391-C403 PolarHBondContact SG-SG 2.04Å; M393-C403 VanDerWaalsContact C-CB 3.47Å; M393-C403 VanDerWaalsContact O-CB 3.26Å; M393-C403 WeakPolarHBondContact O-CB 3.46Å; H394-C403 PolarHBondContact CD2-N 3.25Å; H394-C403 PolarHBondContact NE2-O 2.83Å
404	H	62.2	Low	62.2	Low	38 Å²	38	67.9 Å²	67.9	18%	0.176	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	120	178	-177.3	76.5	0	0	0	111.4	L402 G406 V407 V409	L402-H404 PolarHBondContact O-N 2.72Å; H404-G406 PolarHBondContact O-N 2.98Å; H404-G406 VanDerWaalsContact O-N 3.12Å; H404-V407 PolarHBondContact N-O 3.39Å; H404-V407 WeakPolarHBondContact O-CA 3.47Å; H404-V407 PolarHBondContact O-N 2.9Å; H404-V407 VanDerWaalsContact O-O 3.13Å; H404-V409 HydrophobicContact CB-CG1 4.27Å; H404-V409 HydrophobicContact CB-CG2 3.61Å
405	K	63.5	Low	61.6	Low	158 Å²	158	71.6 Å²	71.6	69%	0.687	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	37.7	-179.1	-67.7	179.7	-179.8	172.1	0	113.2	V407	K405-V407 VanDerWaalsContact C-N 3.33Å
406	G	65.5	Low	61.4	Low	22 Å²	22	69.9 Å²	69.9	23%	0.227	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	65	34.9	-175.4	0	0	0	0	0	113.6	R390 C391 H404	R390-G406 CarbonylContact C-O 3.52Å; R390-G406 WeakPolarHBondContact CA-O 3.41Å; R390-G406 WeakPolarHBondContact CB-O 3.37Å; R390-G406 VanDerWaalsContact CG-O 3.29Å; R390-G406 WeakPolarHBondContact CG-O 3.26Å; C391-G406 PolarHBondContact N-O 3.18Å; C391-G406 WeakPolarHBondContact O-CA 3.21Å; C391-G406 VanDerWaalsContact SG-CA 3.52Å; H404-G406 PolarHBondContact O-N 2.98Å; H404-G406 VanDerWaalsContact O-N 3.12Å
407	V	73.3	Confident	61.4	Low	66 Å²	66	73.7 Å²	73.7	40%	0.4	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.9	168.7	177.4	0	0	0	0	111.6	G389 C391 H404 K405 V409	G389-V407 WeakPolarHBondContact O-CA 3.15Å; G389-V407 VanDerWaalsContact O-CB 3.31Å; G389-V407 WeakPolarHBondContact O-CB 3.35Å; G389-V407 VanDerWaalsContact O-CG1 3.25Å; G389-V407 WeakPolarHBondContact O-CG1 3.15Å; G389-V407 WeakPolarHBondContact O-CG2 3Å; C391-V407 PolarHBondContact SG-N 3.19Å; C391-V407 PolarHBondContact SG-O 3.12Å; H404-V407 PolarHBondContact N-O 3.39Å; H404-V407 WeakPolarHBondContact O-CA 3.47Å; H404-V407 PolarHBondContact O-N 2.9Å; H404-V407 VanDerWaalsContact O-O 3.13Å; K405-V407 VanDerWaalsContact C-N 3.33Å; V407-V409 HydrophobicContact CG1-CG1 4.27Å; V407-V409 PolarHBondContact O-N 2.71Å
408	C	69.1	Low	61.7	Low	30 Å²	30	73 Å²	73	20%	0.203	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	110.8	175	-67.9	0	0	0	0	111	C397 K401 L402	C397-C408 WeakPolarHBondContact CA-SG 2.96Å; C397-C408 HydrophobicContact CB-CB 3.8Å; C397-C408 WeakPolarHBondContact CB-SG 3.26Å; C397-C408 WeakPolarHBondContact SG-CA 3.5Å; C397-C408 WeakPolarHBondContact SG-CB 3.38Å; C397-C408 CovalentContact SG-SG 2.04Å; C397-C408 PolarHBondContact SG-SG 3.17Å; K401-C408 HydrophobicContact CB-CB 4.12Å; K401-C408 HydrophobicContact CD-CB 4.1Å; L402-C408 CarbonylContact O-C 3.6Å; L402-C408 VanDerWaalsContact O-CA 3.32Å; L402-C408 WeakPolarHBondContact O-CA 3.27Å
409	V	70.3	Confident	61.7	Low	53 Å²	53	72.6 Å²	72.6	32%	0.321	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	143.2	-179.8	-60.8	0	0	0	0	110.5	K401 L402 H404 V407	K401-V409 CarbonylContact C-O 3.41Å; K401-V409 VanDerWaalsContact CA-O 3.23Å; K401-V409 WeakPolarHBondContact CA-O 3.32Å; L402-V409 PolarHBondContact N-O 2.83Å; L402-V409 PolarHBondContact O-N 2.97Å; H404-V409 HydrophobicContact CB-CG1 4.27Å; H404-V409 HydrophobicContact CB-CG2 3.61Å; V407-V409 HydrophobicContact CG1-CG1 4.27Å; V407-V409 PolarHBondContact O-N 2.71Å
410	V	64.9	Low	62.3	Low	101 Å²	101	68.3 Å²	68.3	61%	0.612	38%	0.375	S	S	*	.			trans	-71.8	124	166.6	-179.8	0	0	0	0	106.5	K401 E412	K401-V410 HydrophobicContact CG-CG2 3.96Å; V410-E412 PolarHBondContact O-N 3.41Å
411	P	52.9	Low	62.6	Low	20 Å²	20	61 Å²	61	13%	0.13	34%	0.34	C	S	.	.			trans	-62.2	132.2	173.1	23.1	-26.8	0	0	0	109.2	E400 L402 S413 T436	E400-P411 VanDerWaalsContact O-CD 3.23Å; E400-P411 WeakPolarHBondContact O-CD 3.26Å; L402-P411 HydrophobicContact CD1-CB 3.7Å; L402-P411 HydrophobicContact CD1-CG 3.9Å; L402-P411 HydrophobicContact CG-CB 4.46Å; L402-P411 HydrophobicContact CG-CG 4.19Å; P411-S413 PolarHBondContact O-N 2.83Å; P411-T436 HydrophobicContact CB-CG2 3.87Å; P411-T436 HydrophobicContact CG-CG2 4.39Å
412	E	49.5	Very low	62.8	Low	162 Å²	162	58 Å²	58	76%	0.757	33%	0.328	S	S	*	.			trans	-71.2	71.4	164.4	-69.9	-178.9	175.1	0	0	107.8	V410	V410-E412 PolarHBondContact O-N 3.41Å
413	S	48	Very low	63.3	Low	43 Å²	43	59.7 Å²	59.7	30%	0.301	34%	0.336	S	S	.	.			trans	-91.5	122.8	178.3	62.1	0	0	0	0	109.4	P411 P435	P411-S413 PolarHBondContact O-N 2.83Å; S413-P435 WeakPolarHBondContact CB-O 3.19Å
414	T	50.9	Low	63.6	Low	54 Å²	54	59 Å²	59	33%	0.331	33%	0.331	S	S	.	.			trans	-57.3	136	162.7	50	0	0	0	0	109.1	D416	T414-D416 PolarHBondContact O-N 2.77Å
415	S	48.7	Very low	63.8	Low	122 Å²	122	61.7 Å²	61.7	85%	0.853	34%	0.342	S	S	*	.	S	Bend	trans	-16.7	-9.8	175.1	-173	0	0	0	0	122.6
416	D	61	Low	63.9	Low	98 Å²	98	57 Å²	57	52%	0.524	33%	0.329	S	S	.	.			trans	-103.1	124.1	-169.5	-60.6	-41.5	0	0	0	110	T414 P435	T414-D416 PolarHBondContact O-N 2.77Å; D416-P435 WeakPolarHBondContact O-CD 3.34Å; D416-P435 WeakPolarHBondContact O-CG 3.44Å
417	M	65.6	Low	63.7	Low	127 Å²	127	60.3 Å²	60.3	63%	0.626	35%	0.345	S	S	*	.			trans	-67	139.9	162.8	-64.1	178	70.1	0	0	108.5	N433 F434	M417-N433 CarbonylContact C-O 3.38Å; M417-N433 VanDerWaalsContact CA-O 3.23Å; M417-N433 WeakPolarHBondContact CA-O 3.3Å; M417-N433 HydrophobicContact CE-CB 4.23Å; M417-F434 HydrophobicContact CG-CE1 4.46Å
418	C	70.4	Confident	63.4	Low	1 Å²	1	57.4 Å²	57.4	1%	0.007	33%	0.327	C	S	.	.			trans	-115.7	156.7	168.9	63	0	0	0	0	108.6	E423 C430 N433 F434 P435	C418-E423 HydrophobicContact CB-CB 3.77Å; C418-C430 HydrophobicContact CB-CB 3.83Å; C418-C430 WeakPolarHBondContact CB-SG 3.2Å; C418-C430 PolarHBondContact O-SG 2.56Å; C418-C430 WeakPolarHBondContact SG-CA 3.34Å; C418-C430 WeakPolarHBondContact SG-CB 2.95Å; C418-C430 CovalentContact SG-SG 2.03Å; C418-C430 PolarHBondContact SG-SG 3.14Å; C418-N433 PolarHBondContact N-O 2.92Å; C418-N433 CarbonylContact O-C 3.48Å; C418-N433 WeakPolarHBondContact O-CA 3.23Å; C418-N433 WeakPolarHBondContact O-CB 3.44Å; C418-N433 VanDerWaalsContact SG-C 3.56Å; C418-F434 PolarHBondContact SG-N 2.85Å; C418-F434 PolarHBondContact SG-O 2.88Å; C418-F434 VanDerWaalsContact SG-O 3.35Å; C418-P435 HydrophobicContact CB-CG 4.03Å; C418-P435 VanDerWaalsContact SG-N 3.36Å
419	T	69.4	Low	63.3	Low	72 Å²	72	57.8 Å²	57.8	44%	0.442	33%	0.325	S	S	.	.	S	Bend	trans	-110.3	-23.6	168.5	64.1	0	0	0	0	111.6	E423	T419-E423 WeakPolarHBondContact CB-OE1 3.46Å; T419-E423 PolarHBondContact N-OE1 3.4Å; T419-E423 PolarHBondContact OG1-OE1 3.16Å
420	T	68.6	Low	63.2	Low	3 Å²	3	56.5 Å²	56.5	2%	0.018	32%	0.317	C	S	.	.	S	Bend	trans	-145.1	160.1	-178.9	75.7	0	0	0	0	111.3	L422 E423 C430 Y454 V601	T420-L422 PolarHBondContact O-N 2.71Å; T420-L422 WeakPolarHBondContact OG1-CB 3.26Å; T420-L422 PolarHBondContact OG1-N 2.69Å; T420-E423 PolarHBondContact O-N 3.26Å; T420-C430 PolarHBondContact N-SG 2.94Å; T420-C430 VanDerWaalsContact O-CB 3.31Å; T420-C430 WeakPolarHBondContact O-CB 3.43Å; T420-Y454 VanDerWaalsContact CB-CE2 3.47Å; T420-Y454 WeakPolarHBondContact CB-OH 3.24Å; T420-Y454 HydrophobicContact CG2-CE2 4.31Å; T420-Y454 WeakPolarHBondContact CG2-OH 2.91Å; T420-Y454 WeakPolarHBondContact OG1-CE2 3.05Å; T420-V601 HydrophobicContact CG2-CB 4.33Å; T420-V601 HydrophobicContact CG2-CG1 3.92Å; T420-V601 HydrophobicContact CG2-CG2 3.58Å
421	D	69.2	Low	63.1	Low	5 Å²	5	54.4 Å²	54.4	3%	0.027	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-54.4	-20.1	176.6	-92.3	14	0	0	0	113.5	E423 C424 R429 C430 G452 Y454	D421-E423 VanDerWaalsContact C-N 3.27Å; D421-E423 PolarHBondContact O-N 3.04Å; D421-C424 PolarHBondContact O-N 2.96Å; D421-R429 WeakPolarHBondContact OD1-CA 3.26Å; D421-R429 WeakPolarHBondContact OD2-CD 3.4Å; D421-R429 IonicContact OD2-CZ 2.69Å; D421-R429 IonicContact OD2-NE 3.7Å; D421-R429 IonicContact OD2-NH1 3.82Å; D421-R429 PolarHBondContact OD2-NH1 3.37Å; D421-C430 PolarHBondContact OD1-N 2.94Å; D421-G452 WeakPolarHBondContact OD2-CA 3.13Å; D421-Y454 HydrophobicContact CB-CD2 3.97Å
422	L	72.1	Confident	63.6	Low	14 Å²	14	57.6 Å²	57.6	7%	0.073	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-63.7	-35.4	176.5	-138.3	69.2	0	0	0	110.5	T420 C424 Y454 L464 R515 Y562	T420-L422 PolarHBondContact O-N 2.71Å; T420-L422 WeakPolarHBondContact OG1-CB 3.26Å; T420-L422 PolarHBondContact OG1-N 2.69Å; L422-C424 PolarHBondContact O-N 3Å; L422-Y454 HydrophobicContact CB-CD2 4.08Å; L422-Y454 HydrophobicContact CB-CE2 3.77Å; L422-Y454 HydrophobicContact CD1-CD2 3.88Å; L422-Y454 HydrophobicContact CD1-CE2 4.24Å; L422-Y454 HydrophobicContact CD1-CG 4.22Å; L422-Y454 HydrophobicContact CG-CE2 4.48Å; L422-L464 HydrophobicContact CD1-CD2 4.32Å; L422-R515 PolarHBondContact O-NH1 3.31Å; L422-R515 PolarHBondContact O-NH2 3.48Å; L422-Y562 HydrophobicContact CD1-CD2 3.72Å; L422-Y562 HydrophobicContact CD1-CE1 4.39Å; L422-Y562 HydrophobicContact CD1-CE2 3.54Å; L422-Y562 HydrophobicContact CD1-CG 4.22Å; L422-Y562 HydrophobicContact CD2-CD2 3.48Å; L422-Y562 VanDerWaalsContact CD2-CD2 3.48Å; L422-Y562 HydrophobicContact CD2-CE2 4.08Å; L422-Y562 HydrophobicContact CD2-CG 4.03Å; L422-Y562 HydrophobicContact CG-CD2 4.25Å; L422-Y562 HydrophobicContact CG-CE2 4.42Å
423	E	71	Confident	64.4	Low	48 Å²	48	53.9 Å²	53.9	22%	0.224	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-78.6	-6.3	-177.3	-65.2	-176.4	-108.2	0	0	113.9	C418 T419 T420 D421 N511 K536	C418-E423 HydrophobicContact CB-CB 3.77Å; T419-E423 WeakPolarHBondContact CB-OE1 3.46Å; T419-E423 PolarHBondContact N-OE1 3.4Å; T419-E423 PolarHBondContact OG1-OE1 3.16Å; T420-E423 PolarHBondContact O-N 3.26Å; D421-E423 VanDerWaalsContact C-N 3.27Å; D421-E423 PolarHBondContact O-N 3.04Å; E423-N511 PolarHBondContact O-ND2 2.04Å; E423-K536 IonicContact OE2-NZ 3.52Å; E423-K536 PolarHBondContact OE2-NZ 2.77Å
424	C	68.7	Low	65.2	Low	1 Å²	1	55.6 Å²	55.6	1%	0.007	30%	0.303	C	S	.	.	S	Bend	trans	-93.2	153.4	-174.1	-62.5	0	0	0	0	112.6	D421 L422 D428 R429 C430 P435 N511	D421-C424 PolarHBondContact O-N 2.96Å; L422-C424 PolarHBondContact O-N 3Å; C424-D428 HydrophobicContact CB-CB 3.77Å; C424-D428 WeakPolarHBondContact CB-O 3.04Å; C424-R429 VanDerWaalsContact SG-C 3.54Å; C424-C430 VanDerWaalsContact SG-CA 3.55Å; C424-C430 VanDerWaalsContact SG-CB 3.59Å; C424-C430 PolarHBondContact SG-N 2.84Å; C424-P435 HydrophobicContact CB-CB 4.31Å; C424-N511 VanDerWaalsContact O-CB 3.23Å; C424-N511 WeakPolarHBondContact O-CB 3.29Å; C424-N511 PolarHBondContact O-ND2 3.25Å
425	K	68	Low	66	Low	96 Å²	96	53.2 Å²	53.2	42%	0.417	29%	0.288	S	S	.	.			trans	-61	163.4	170	-69.6	177.8	-179.1	172.7	0	110.7	T427 D428 N511	K425-T427 PolarHBondContact O-N 3.04Å; K425-D428 HydrophobicContact CB-CB 4.36Å; K425-D428 PolarHBondContact O-N 2.76Å; K425-N511 CarbonylContact C-O 3.53Å
426	S	64.4	Low	66.6	Low	58 Å²	58	47.5 Å²	47.5	41%	0.406	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-22.2	-169.8	64.5	0	0	0	0	116.9	N511 F513	S426-N511 WeakPolarHBondContact CA-O 3.14Å; S426-N511 WeakPolarHBondContact CB-O 3.34Å; S426-N511 PolarHBondContact N-O 3.29Å; S426-F513 VanDerWaalsContact CA-CE2 3.47Å; S426-F513 VanDerWaalsContact CB-CE2 3.47Å
427	T	61.3	Low	66.4	Low	92 Å²	92	46.8 Å²	46.8	56%	0.564	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-7.4	179.5	49.4	0	0	0	0	113.8	K425	K425-T427 PolarHBondContact O-N 3.04Å
428	D	68.2	Low	65.8	Low	6 Å²	6	43.4 Å²	43.4	3%	0.032	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	151.1	-165.4	-59.7	6.6	0	0	0	109.4	C424 K425 P435 T436 Q437	C424-D428 HydrophobicContact CB-CB 3.77Å; C424-D428 WeakPolarHBondContact CB-O 3.04Å; K425-D428 HydrophobicContact CB-CB 4.36Å; K425-D428 PolarHBondContact O-N 2.76Å; D428-P435 HydrophobicContact CB-CB 4.2Å; D428-T436 VanDerWaalsContact CA-O 3.29Å; D428-T436 WeakPolarHBondContact CA-O 3.49Å; D428-Q437 WeakPolarHBondContact OD1-CG 3.43Å
429	R	65.7	Low	64.5	Low	38 Å²	38	47.6 Å²	47.6	14%	0.143	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.2	176.8	-61.7	-66.8	176.4	-170	-7.8	110	D421 C424 K431 T436 F438 S455	D421-R429 WeakPolarHBondContact OD1-CA 3.26Å; D421-R429 WeakPolarHBondContact OD2-CD 3.4Å; D421-R429 IonicContact OD2-CZ 2.69Å; D421-R429 IonicContact OD2-NE 3.7Å; D421-R429 IonicContact OD2-NH1 3.82Å; D421-R429 PolarHBondContact OD2-NH1 3.37Å; C424-R429 VanDerWaalsContact SG-C 3.54Å; R429-K431 PolarHBondContact O-N 3.41Å; R429-T436 PolarHBondContact N-O 2.02Å; R429-T436 PolarHBondContact O-N 2.9Å; R429-T436 PolarHBondContact O-OG1 3.3Å; R429-F438 HydrophobicContact CB-CD2 4.32Å; R429-F438 HydrophobicContact CB-CE2 4.17Å; R429-F438 HydrophobicContact CG-CD2 4.11Å; R429-F438 HydrophobicContact CG-CE2 4.26Å; R429-S455 PolarHBondContact NH1-OG 2.03Å
430	C	68.9	Low	63.1	Low	25 Å²	25	50.9 Å²	50.9	17%	0.169	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	111.1	175.8	-167.1	0	0	0	0	109.6	C418 T420 D421 C424	C418-C430 HydrophobicContact CB-CB 3.83Å; C418-C430 WeakPolarHBondContact CB-SG 3.2Å; C418-C430 PolarHBondContact O-SG 2.56Å; C418-C430 WeakPolarHBondContact SG-CA 3.34Å; C418-C430 WeakPolarHBondContact SG-CB 2.95Å; C418-C430 CovalentContact SG-SG 2.03Å; C418-C430 PolarHBondContact SG-SG 3.14Å; T420-C430 PolarHBondContact N-SG 2.94Å; T420-C430 VanDerWaalsContact O-CB 3.31Å; T420-C430 WeakPolarHBondContact O-CB 3.43Å; D421-C430 PolarHBondContact OD1-N 2.94Å; C424-C430 VanDerWaalsContact SG-CA 3.55Å; C424-C430 VanDerWaalsContact SG-CB 3.59Å; C424-C430 PolarHBondContact SG-N 2.84Å
431	K	63.2	Low	61.9	Low	58 Å²	58	57.3 Å²	57.3	25%	0.252	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	125.6	-177.1	-167.5	164.5	-158.2	162.5	0	110.1	H394 L402 R429 N433 F434 T436	H394-K431 WeakPolarHBondContact CD2-CE 3.35Å; H394-K431 PolarHBondContact CD2-NZ 3.31Å; H394-K431 PolarHBondContact CE1-NZ 3.38Å; H394-K431 PolarHBondContact ND1-NZ 3.33Å; H394-K431 VanDerWaalsContact ND1-NZ 3.14Å; H394-K431 WeakPolarHBondContact NE2-CE 3.48Å; H394-K431 PolarHBondContact NE2-NZ 3.27Å; L402-K431 HydrophobicContact CD2-CD 3.99Å; L402-K431 HydrophobicContact CD2-CG 3.99Å; R429-K431 PolarHBondContact O-N 3.41Å; K431-N433 PolarHBondContact O-N 3.04Å; K431-F434 PolarHBondContact N-O 2.88Å; K431-F434 PolarHBondContact O-N 2.86Å; K431-T436 HydrophobicContact CB-CG2 4Å
432	L	61.9	Low	61	Low	87 Å²	87	60.2 Å²	60.2	46%	0.455	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	38.4	-174.5	-57.3	175.4	0	0	0	112.3	L402 F434	L402-L432 HydrophobicContact CD2-CD1 3.7Å; L402-L432 HydrophobicContact CD2-CG 4.33Å; L432-F434 VanDerWaalsContact C-N 3.32Å; L432-F434 WeakPolarHBondContact O-CD2 3.27Å; L432-F434 WeakPolarHBondContact O-CE2 3.24Å; L432-F434 PolarHBondContact O-N 3.17Å
433	N	67.1	Low	60.2	Low	84 Å²	84	61.5 Å²	61.5	45%	0.449	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	15.8	-176.4	-54.2	-28	0	0	0	117	M417 C418 K431	M417-N433 CarbonylContact C-O 3.38Å; M417-N433 VanDerWaalsContact CA-O 3.23Å; M417-N433 WeakPolarHBondContact CA-O 3.3Å; M417-N433 HydrophobicContact CE-CB 4.23Å; C418-N433 PolarHBondContact N-O 2.92Å; C418-N433 CarbonylContact O-C 3.48Å; C418-N433 WeakPolarHBondContact O-CA 3.23Å; C418-N433 WeakPolarHBondContact O-CB 3.44Å; C418-N433 VanDerWaalsContact SG-C 3.56Å; K431-N433 PolarHBondContact O-N 3.04Å
434	F	65.8	Low	60.2	Low	78 Å²	78	62.7 Å²	62.7	34%	0.342	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.6	176.3	-62.9	-79.5	0	0	0	111.6	M417 C418 K431 L432 T436	M417-F434 HydrophobicContact CG-CE1 4.46Å; C418-F434 PolarHBondContact SG-N 2.85Å; C418-F434 PolarHBondContact SG-O 2.88Å; C418-F434 VanDerWaalsContact SG-O 3.35Å; K431-F434 PolarHBondContact N-O 2.88Å; K431-F434 PolarHBondContact O-N 2.86Å; L432-F434 VanDerWaalsContact C-N 3.32Å; L432-F434 WeakPolarHBondContact O-CD2 3.27Å; L432-F434 WeakPolarHBondContact O-CE2 3.24Å; L432-F434 PolarHBondContact O-N 3.17Å; F434-T436 WeakPolarHBondContact O-CG2 2.99Å; F434-T436 PolarHBondContact O-N 2.92Å
435	P	67.7	Low	60.9	Low	4 Å²	4	62.9 Å²	62.9	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	114.9	164.8	-18.8	30.3	0	0	0	108.5	S413 D416 C418 C424 D428	S413-P435 WeakPolarHBondContact CB-O 3.19Å; D416-P435 WeakPolarHBondContact O-CD 3.34Å; D416-P435 WeakPolarHBondContact O-CG 3.44Å; C418-P435 HydrophobicContact CB-CG 4.03Å; C418-P435 VanDerWaalsContact SG-N 3.36Å; C424-P435 HydrophobicContact CB-CB 4.31Å; D428-P435 HydrophobicContact CB-CB 4.2Å
436	T	59.5	Low	61.7	Low	2 Å²	2	63.8 Å²	63.8	1%	0.012	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	108	-178.2	55.5	0	0	0	0	108.2	L402 P411 D428 R429 K431 F434 F438	L402-T436 HydrophobicContact CD1-CG2 3.32Å; P411-T436 HydrophobicContact CB-CG2 3.87Å; P411-T436 HydrophobicContact CG-CG2 4.39Å; D428-T436 VanDerWaalsContact CA-O 3.29Å; D428-T436 WeakPolarHBondContact CA-O 3.49Å; R429-T436 PolarHBondContact N-O 2.02Å; R429-T436 PolarHBondContact O-N 2.9Å; R429-T436 PolarHBondContact O-OG1 3.3Å; K431-T436 HydrophobicContact CB-CG2 4Å; F434-T436 WeakPolarHBondContact O-CG2 2.99Å; F434-T436 PolarHBondContact O-N 2.92Å; T436-F438 PolarHBondContact O-N 2.96Å; T436-F438 VanDerWaalsContact O-N 3.1Å
437	Q	58.5	Low	62.8	Low	84 Å²	84	69.9 Å²	69.9	39%	0.393	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	110.7	162.1	-89.4	-177.1	21.5	0	0	106.8	D428 P439	D428-Q437 WeakPolarHBondContact OD1-CG 3.43Å; Q437-P439 WeakPolarHBondContact O-CD 3.16Å
438	F	52.3	Low	64	Low	56 Å²	56	66.7 Å²	66.7	25%	0.246	34%	0.341	C	S	.	.			trans	-75.6	107.6	168.6	-93.2	-89.3	0	0	0	107.6	R429 T436 F440 V442	R429-F438 HydrophobicContact CB-CD2 4.32Å; R429-F438 HydrophobicContact CB-CE2 4.17Å; R429-F438 HydrophobicContact CG-CD2 4.11Å; R429-F438 HydrophobicContact CG-CE2 4.26Å; T436-F438 PolarHBondContact O-N 2.96Å; T436-F438 VanDerWaalsContact O-N 3.1Å; F438-F440 PolarHBondContact O-N 3.29Å; F438-V442 HydrophobicContact CD1-CB 4.44Å; F438-V442 HydrophobicContact CD1-CG2 3.81Å; F438-V442 HydrophobicContact CE1-CG2 4.4Å; F438-V442 HydrophobicContact CG-CG2 4.44Å
439	P	42.7	Very low	64.7	Low	88 Å²	88	71.5 Å²	71.5	57%	0.571	37%	0.367	S	S	*	.	S	Bend	trans	-72.3	3.5	-166.5	-17	33	0	0	0	114.5	Q437	Q437-P439 WeakPolarHBondContact O-CD 3.16Å
440	F	40	Very low	65.5	Low	141 Å²	141	73.4 Å²	73.4	62%	0.618	38%	0.379	S	S	*	.	S	Bend	trans	-148.2	103.2	169.1	-77.1	-85.8	0	0	0	106.6	F438 V442	F438-F440 PolarHBondContact O-N 3.29Å; F440-V442 PolarHBondContact O-N 3.35Å
441	L	43	Very low	66	Low	138 Å²	138	72.5 Å²	72.5	72%	0.723	37%	0.373	S	S	*	.			trans	16.7	60.7	152.8	-126.7	97.3	0	0	0	115.2	T443 S444	L441-T443 WeakPolarHBondContact CD2-OG1 3.4Å; L441-T443 HydrophobicContact CG-CG2 4.05Å; L441-T443 WeakPolarHBondContact CG-OG1 3.3Å; L441-T443 PolarHBondContact O-N 3.16Å; L441-S444 PolarHBondContact O-N 2.92Å
442	V	50.8	Low	66.6	Low	67 Å²	67	70.7 Å²	70.7	41%	0.406	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	46.3	152.9	-160.8	0	0	0	0	106.5	F438 F440	F438-V442 HydrophobicContact CD1-CB 4.44Å; F438-V442 HydrophobicContact CD1-CG2 3.81Å; F438-V442 HydrophobicContact CE1-CG2 4.4Å; F438-V442 HydrophobicContact CG-CG2 4.44Å; F440-V442 PolarHBondContact O-N 3.35Å
443	T	55.4	Low	67.5	Low	40 Å²	40	68.8 Å²	68.8	25%	0.245	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-27.5	146.8	57.7	0	0	0	0	108.2	L441 C445 S460 T461 C462	L441-T443 WeakPolarHBondContact CD2-OG1 3.4Å; L441-T443 HydrophobicContact CG-CG2 4.05Å; L441-T443 WeakPolarHBondContact CG-OG1 3.3Å; L441-T443 PolarHBondContact O-N 3.16Å; T443-C445 PolarHBondContact O-N 2.97Å; T443-S460 CarbonylContact C-O 3.52Å; T443-S460 CarbonylContact O-C 3.47Å; T443-T461 HydrophobicContact CG2-CG2 4.04Å; T443-T461 CarbonylContact O-C 3.55Å; T443-T461 VanDerWaalsContact O-C 3.3Å; T443-T461 WeakPolarHBondContact O-CA 3.15Å; T443-T461 PolarHBondContact O-N 2.83Å; T443-C462 PolarHBondContact O-N 3.01Å
444	S	70.3	Confident	68.3	Low	74 Å²	74	64.8 Å²	64.8	52%	0.517	34%	0.34	S	S	.	.			trans	-55.3	116	174.3	73.1	0	0	0	0	111.3	L441 S460	L441-S444 PolarHBondContact O-N 2.92Å; S444-S460 WeakPolarHBondContact CA-O 3.48Å; S444-S460 PolarHBondContact N-O 2.73Å
445	C	84.4	Confident	69.2	Low	4 Å²	4	61 Å²	61	3%	0.027	32%	0.324	C	S	.	.			trans	-134.5	152.5	175.8	59.2	0	0	0	0	108.6	T443 D450 C457 S460 T461 C462	T443-C445 PolarHBondContact O-N 2.97Å; C445-D450 HydrophobicContact CB-CB 3.88Å; C445-C457 HydrophobicContact CB-CB 3.59Å; C445-C457 WeakPolarHBondContact CB-SG 3.03Å; C445-C457 PolarHBondContact O-SG 3.21Å; C445-C457 VanDerWaalsContact O-SG 3.41Å; C445-C457 WeakPolarHBondContact SG-CA 3.3Å; C445-C457 WeakPolarHBondContact SG-CB 3.02Å; C445-C457 CovalentContact SG-SG 2.01Å; C445-C457 PolarHBondContact SG-SG 2.76Å; C445-S460 VanDerWaalsContact O-CA 3.29Å; C445-S460 WeakPolarHBondContact O-CA 3.43Å; C445-S460 PolarHBondContact O-OG 2.76Å; C445-S460 VanDerWaalsContact SG-C 3.55Å; C445-T461 VanDerWaalsContact SG-C 3.53Å; C445-T461 PolarHBondContact SG-N 3.25Å; C445-C462 VanDerWaalsContact CB-SG 3.55Å
446	T	84.8	Confident	70.2	Confident	116 Å²	116	61 Å²	61	71%	0.712	32%	0.323	S	S	*	.	S	Bend	trans	-111.4	-26.9	172.5	63.5	0	0	0	0	111.2	D450	T446-D450 WeakPolarHBondContact CA-OD2 3.31Å; T446-D450 PolarHBondContact N-OD2 2.76Å; T446-D450 PolarHBondContact OG1-OD2 2.78Å
447	R	87.4	Confident	71.6	Confident	185 Å²	185	61.4 Å²	61.4	70%	0.698	33%	0.326	S	S	*	.	S	Bend	trans	-140.9	160	178.2	-55.7	-179.2	-163.9	-178.5	3.7	109.3	N449 D450 C457	R447-N449 PolarHBondContact O-N 2.76Å; R447-D450 PolarHBondContact N-OD2 3.31Å; R447-D450 VanDerWaalsContact O-CB 3.31Å; R447-D450 WeakPolarHBondContact O-CB 3.15Å; R447-D450 PolarHBondContact O-N 3.05Å; R447-C457 VanDerWaalsContact C-CB 3.48Å; R447-C457 WeakPolarHBondContact O-CB 3.32Å
448	H	86.8	Confident	72.9	Confident	25 Å²	25	60.2 Å²	60.2	12%	0.116	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-61.4	-27.4	178	-54.1	-45.9	0	0	0	113.6	D450 C451 C457 D475 C485 R486	H448-D450 PolarHBondContact O-N 3.03Å; H448-C451 VanDerWaalsContact O-CB 3.3Å; H448-C451 WeakPolarHBondContact O-CB 3.49Å; H448-C451 PolarHBondContact O-N 3.37Å; H448-C457 PolarHBondContact CE1-O 3.47Å; H448-C457 PolarHBondContact ND1-N 2.86Å; H448-C457 PolarHBondContact ND1-O 3.11Å; H448-C457 VanDerWaalsContact ND1-O 3.12Å; H448-D475 IonicContact CE1-OD1 2.72Å; H448-D475 PolarHBondContact CE1-OD1 3.32Å; H448-D475 IonicContact CE1-OD2 3.94Å; H448-D475 IonicContact NE2-OD1 3.14Å; H448-D475 PolarHBondContact NE2-OD1 3.41Å; H448-D475 IonicContact NE2-OD2 2.8Å; H448-C485 PolarHBondContact CD2-O 3.24Å; H448-C485 PolarHBondContact NE2-N 2.89Å; H448-C485 PolarHBondContact NE2-O 2.87Å; H448-C485 VanDerWaalsContact NE2-O 3.08Å; H448-R486 HydrophobicContact CB-CB 4.34Å; H448-R486 HydrophobicContact CB-CG 3.85Å; H448-R486 PolarHBondContact O-NH1 3.01Å; H448-R486 PolarHBondContact O-NH2 3.14Å
449	N	83.5	Confident	74.3	Confident	108 Å²	108	65.2 Å²	65.2	58%	0.578	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-68.6	-13.1	176.5	-68.2	12.9	0	0	0	113.3	R447 C451	R447-N449 PolarHBondContact O-N 2.76Å; N449-C451 PolarHBondContact O-N 3.23Å
450	D	80.8	Confident	76.2	Confident	77 Å²	77	64.6 Å²	64.6	41%	0.412	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-77	-11.9	170.7	-54	-28.7	0	0	0	111.5	C445 T446 R447 H448	C445-D450 HydrophobicContact CB-CB 3.88Å; T446-D450 WeakPolarHBondContact CA-OD2 3.31Å; T446-D450 PolarHBondContact N-OD2 2.76Å; T446-D450 PolarHBondContact OG1-OD2 2.78Å; R447-D450 PolarHBondContact N-OD2 3.31Å; R447-D450 VanDerWaalsContact O-CB 3.31Å; R447-D450 WeakPolarHBondContact O-CB 3.15Å; R447-D450 PolarHBondContact O-N 3.05Å; H448-D450 PolarHBondContact O-N 3.03Å
451	C	80.6	Confident	78.3	Confident	6 Å²	6	59.9 Å²	59.9	4%	0.041	32%	0.323	C	S	.	.	S	Bend	trans	-101.7	147.3	179.2	-53.9	0	0	0	0	111.3	H448 N449 C457 C462 R486	H448-C451 VanDerWaalsContact O-CB 3.3Å; H448-C451 WeakPolarHBondContact O-CB 3.49Å; H448-C451 PolarHBondContact O-N 3.37Å; N449-C451 PolarHBondContact O-N 3.23Å; C451-C457 VanDerWaalsContact SG-CA 3.58Å; C451-C457 PolarHBondContact SG-N 2.88Å; C451-C457 VanDerWaalsContact SG-N 3.4Å; C451-C462 WeakPolarHBondContact CA-SG 3.43Å; C451-C462 HydrophobicContact CB-CB 3.73Å; C451-C462 WeakPolarHBondContact CB-SG 3.3Å; C451-C462 WeakPolarHBondContact SG-CA 3.19Å; C451-C462 WeakPolarHBondContact SG-CB 3.42Å; C451-C462 CovalentContact SG-SG 2.04Å; C451-C462 PolarHBondContact SG-SG 2.85Å; C451-R486 PolarHBondContact O-NH1 3.22Å; C451-R486 PolarHBondContact O-NH2 2.86Å
452	G	75.9	Confident	80.2	Confident	20 Å²	20	53.8 Å²	53.8	21%	0.206	29%	0.292	C	S	.	.			trans	-66	171.5	176.5	0	0	0	0	0	113.2	D421 Y454 S455 R486	D421-G452 WeakPolarHBondContact OD2-CA 3.13Å; G452-Y454 VanDerWaalsContact C-N 3.32Å; G452-Y454 PolarHBondContact O-N 2.83Å; G452-S455 WeakPolarHBondContact O-CB 3.25Å; G452-S455 PolarHBondContact O-N 3.5Å; G452-R486 PolarHBondContact O-NH1 3.33Å
453	D	80.3	Confident	81.8	Confident	47 Å²	47	51.9 Å²	51.9	25%	0.251	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.5	-45.8	-156.3	-63.2	-20.2	0	0	0	115.6	R486 R574 P575	D453-R486 PolarHBondContact O-NH1 2.64Å; D453-R574 HydrophobicContact CB-CG 4.23Å; D453-R574 WeakPolarHBondContact OD2-CD 3.24Å; D453-R574 WeakPolarHBondContact OD2-CG 3.41Å; D453-P575 HydrophobicContact CB-CG 4.19Å; D453-P575 VanDerWaalsContact O-CG 3.27Å; D453-P575 WeakPolarHBondContact O-CG 3.23Å
454	Y	84	Confident	83.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	16.8	-175	-48.7	-69.7	0	0	0	114.5	T420 D421 L422 G452 G465 W491 Y562 L573 P575 W598	T420-Y454 VanDerWaalsContact CB-CE2 3.47Å; T420-Y454 WeakPolarHBondContact CB-OH 3.24Å; T420-Y454 HydrophobicContact CG2-CE2 4.31Å; T420-Y454 WeakPolarHBondContact CG2-OH 2.91Å; T420-Y454 WeakPolarHBondContact OG1-CE2 3.05Å; D421-Y454 HydrophobicContact CB-CD2 3.97Å; L422-Y454 HydrophobicContact CB-CD2 4.08Å; L422-Y454 HydrophobicContact CB-CE2 3.77Å; L422-Y454 HydrophobicContact CD1-CD2 3.88Å; L422-Y454 HydrophobicContact CD1-CE2 4.24Å; L422-Y454 HydrophobicContact CD1-CG 4.22Å; L422-Y454 HydrophobicContact CG-CE2 4.48Å; G452-Y454 VanDerWaalsContact C-N 3.32Å; G452-Y454 PolarHBondContact O-N 2.83Å; Y454-G465 PolarHBondContact O-N 3.41Å; Y454-W491 HydrophobicContact CD1-CH2 4.17Å; Y454-W491 HydrophobicContact CD1-CZ3 4.24Å; Y454-Y562 AromaticContact CD1-CD1 3.57Å; Y454-Y562 HydrophobicContact CD1-CD1 3.57Å; Y454-Y562 AromaticContact CD1-CE1 3.97Å; Y454-Y562 HydrophobicContact CD1-CE1 3.97Å; Y454-Y562 HydrophobicContact CD1-CG 4.36Å; Y454-Y562 AromaticContact CE1-CD1 3.93Å; Y454-Y562 HydrophobicContact CE1-CD1 3.93Å; Y454-Y562 HydrophobicContact CE1-CG 4.35Å; Y454-Y562 HydrophobicContact CG-CD1 4.26Å; Y454-Y562 HydrophobicContact CG-CE1 4.3Å; Y454-L573 WeakPolarHBondContact CE1-O 2.94Å; Y454-L573 PolarHBondContact OH-O 3.3Å; Y454-P575 HydrophobicContact CD1-CG 4.27Å; Y454-P575 HydrophobicContact CE1-CG 4.37Å; Y454-W598 HydrophobicContact CD1-CZ3 4.5Å; Y454-W598 HydrophobicContact CE1-CZ3 4.05Å
455	S	85.3	Confident	84	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	160.9	-175.1	-66	0	0	0	0	113.3	R429 G452 H463 R486	R429-S455 PolarHBondContact NH1-OG 2.03Å; G452-S455 WeakPolarHBondContact O-CB 3.25Å; G452-S455 PolarHBondContact O-N 3.5Å; S455-H463 CarbonylContact C-O 3.42Å; S455-H463 WeakPolarHBondContact CA-O 3.39Å; S455-H463 WeakPolarHBondContact CB-O 3.3Å; S455-R486 VanDerWaalsContact O-CD 3.23Å; S455-R486 WeakPolarHBondContact O-CD 3.01Å; S455-R486 PolarHBondContact O-NH1 2.8Å
456	V	88.4	Confident	84.1	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.6	169.2	-74.9	0	0	0	0	109.8	R458 C462 H463 R486 W491	V456-R458 PolarHBondContact O-N 3.04Å; V456-C462 WeakPolarHBondContact O-CA 3.39Å; V456-H463 PolarHBondContact N-O 3.25Å; V456-H463 PolarHBondContact O-N 3.27Å; V456-R486 HydrophobicContact CG1-CB 3.8Å; V456-W491 HydrophobicContact CG1-CB 3.54Å; V456-W491 HydrophobicContact CG1-CG 3.99Å; V456-W491 HydrophobicContact CG2-CB 4.42Å
457	C	88.2	Confident	84.3	Confident	10 Å²	10	44.7 Å²	44.7	7%	0.068	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.1	169.5	-176.8	0	0	0	0	110.7	C445 R447 H448 C451	C445-C457 HydrophobicContact CB-CB 3.59Å; C445-C457 WeakPolarHBondContact CB-SG 3.03Å; C445-C457 PolarHBondContact O-SG 3.21Å; C445-C457 VanDerWaalsContact O-SG 3.41Å; C445-C457 WeakPolarHBondContact SG-CA 3.3Å; C445-C457 WeakPolarHBondContact SG-CB 3.02Å; C445-C457 CovalentContact SG-SG 2.01Å; C445-C457 PolarHBondContact SG-SG 2.76Å; R447-C457 VanDerWaalsContact C-CB 3.48Å; R447-C457 WeakPolarHBondContact O-CB 3.32Å; H448-C457 PolarHBondContact CE1-O 3.47Å; H448-C457 PolarHBondContact ND1-N 2.86Å; H448-C457 PolarHBondContact ND1-O 3.11Å; H448-C457 VanDerWaalsContact ND1-O 3.12Å; C451-C457 VanDerWaalsContact SG-CA 3.58Å; C451-C457 PolarHBondContact SG-N 2.88Å; C451-C457 VanDerWaalsContact SG-N 3.4Å
458	R	85.8	Confident	84.2	Confident	59 Å²	59	37 Å²	37	22%	0.223	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	137.2	170.3	-168.6	163	176.7	-143.2	-5.4	110.9	V456 S460 T461 N482	V456-R458 PolarHBondContact O-N 3.04Å; R458-S460 PolarHBondContact O-N 3.34Å; R458-T461 PolarHBondContact N-O 3.49Å; R458-T461 CarbonylContact O-C 3.6Å; R458-T461 WeakPolarHBondContact O-CA 3.49Å; R458-T461 WeakPolarHBondContact O-CB 3.37Å; R458-T461 PolarHBondContact O-N 3.21Å; R458-N482 PolarHBondContact NH1-O 3.35Å; R458-N482 PolarHBondContact NH1-OD1 3.44Å; R458-N482 PolarHBondContact NH2-OD1 2.95Å
459	E	82.8	Confident	84	Confident	162 Å²	162	43 Å²	43	76%	0.757	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	40.9	-176.2	-63.5	174.2	-173.9	0	0	112.1	T461	E459-T461 PolarHBondContact O-N 2.99Å; E459-T461 VanDerWaalsContact O-N 3.14Å; E459-T461 PolarHBondContact O-OG1 2.83Å
460	S	82.9	Confident	84.2	Confident	75 Å²	75	43.1 Å²	43.1	52%	0.524	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	33.7	-173.5	-58.8	0	0	0	0	113.3	T443 S444 C445 R458	T443-S460 CarbonylContact C-O 3.52Å; T443-S460 CarbonylContact O-C 3.47Å; S444-S460 WeakPolarHBondContact CA-O 3.48Å; S444-S460 PolarHBondContact N-O 2.73Å; C445-S460 VanDerWaalsContact O-CA 3.29Å; C445-S460 WeakPolarHBondContact O-CA 3.43Å; C445-S460 PolarHBondContact O-OG 2.76Å; C445-S460 VanDerWaalsContact SG-C 3.55Å; R458-S460 PolarHBondContact O-N 3.34Å
461	T	82.5	Confident	84.6	Confident	42 Å²	42	45 Å²	45	26%	0.258	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	122.3	178.4	-56.6	0	0	0	0	109.1	T443 C445 R458 E459 H463	T443-T461 HydrophobicContact CG2-CG2 4.04Å; T443-T461 CarbonylContact O-C 3.55Å; T443-T461 VanDerWaalsContact O-C 3.3Å; T443-T461 WeakPolarHBondContact O-CA 3.15Å; T443-T461 PolarHBondContact O-N 2.83Å; C445-T461 VanDerWaalsContact SG-C 3.53Å; C445-T461 PolarHBondContact SG-N 3.25Å; R458-T461 PolarHBondContact N-O 3.49Å; R458-T461 CarbonylContact O-C 3.6Å; R458-T461 WeakPolarHBondContact O-CA 3.49Å; R458-T461 WeakPolarHBondContact O-CB 3.37Å; R458-T461 PolarHBondContact O-N 3.21Å; E459-T461 PolarHBondContact O-N 2.99Å; E459-T461 VanDerWaalsContact O-N 3.14Å; E459-T461 PolarHBondContact O-OG1 2.83Å; T461-H463 WeakPolarHBondContact CG2-CE1 3.47Å; T461-H463 PolarHBondContact O-CD2 3.24Å; T461-H463 PolarHBondContact O-N 3.22Å
462	C	83.8	Confident	85.2	Confident	10 Å²	10	45.5 Å²	45.5	7%	0.068	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	123.5	172	-68.7	0	0	0	0	110.8	T443 C445 C451 V456	T443-C462 PolarHBondContact O-N 3.01Å; C445-C462 VanDerWaalsContact CB-SG 3.55Å; C451-C462 WeakPolarHBondContact CA-SG 3.43Å; C451-C462 HydrophobicContact CB-CB 3.73Å; C451-C462 WeakPolarHBondContact CB-SG 3.3Å; C451-C462 WeakPolarHBondContact SG-CA 3.19Å; C451-C462 WeakPolarHBondContact SG-CB 3.42Å; C451-C462 CovalentContact SG-SG 2.04Å; C451-C462 PolarHBondContact SG-SG 2.85Å; V456-C462 WeakPolarHBondContact O-CA 3.39Å
463	H	84.8	Confident	85.8	Confident	27 Å²	27	52.7 Å²	52.7	13%	0.125	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.1	178.1	-63	-68.5	0	0	0	110.9	S455 V456 T461 G465 R493	S455-H463 CarbonylContact C-O 3.42Å; S455-H463 WeakPolarHBondContact CA-O 3.39Å; S455-H463 WeakPolarHBondContact CB-O 3.3Å; V456-H463 PolarHBondContact N-O 3.25Å; V456-H463 PolarHBondContact O-N 3.27Å; T461-H463 WeakPolarHBondContact CG2-CE1 3.47Å; T461-H463 PolarHBondContact O-CD2 3.24Å; T461-H463 PolarHBondContact O-N 3.22Å; H463-G465 PolarHBondContact O-N 2.73Å; H463-R493 HydrophobicContact CB-CG 4.02Å; H463-R493 PolarHBondContact CE1-NH1 2.03Å; H463-R493 VanDerWaalsContact CE1-NH1 3.3Å; H463-R493 PolarHBondContact ND1-NE 3.1Å
464	L	83.8	Confident	86.3	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.042	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	132.7	167.8	-95.3	154	0	0	0	109.7	L422 R493 L494 F513	L422-L464 HydrophobicContact CD1-CD2 4.32Å; L464-R493 WeakPolarHBondContact O-CA 3.36Å; L464-L494 HydrophobicContact CB-CB 4.46Å; L464-L494 PolarHBondContact O-N 3.34Å; L464-F513 HydrophobicContact CB-CD1 4.48Å; L464-F513 HydrophobicContact CB-CE1 4.14Å; L464-F513 HydrophobicContact CB-CE2 4.26Å; L464-F513 HydrophobicContact CB-CZ 4.02Å; L464-F513 HydrophobicContact CD1-CD2 3.59Å; L464-F513 HydrophobicContact CD1-CE1 4.47Å; L464-F513 HydrophobicContact CD1-CE2 3.13Å; L464-F513 HydrophobicContact CD1-CG 4.4Å; L464-F513 HydrophobicContact CD1-CZ 3.67Å; L464-F513 HydrophobicContact CG-CE2 4.25Å; L464-F513 HydrophobicContact CG-CZ 4.39Å
465	G	86.4	Confident	86.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	156.2	-175.2	0	0	0	0	0	112.4	Y454 H463 W491 S492 L494 Y562	Y454-G465 PolarHBondContact O-N 3.41Å; H463-G465 PolarHBondContact O-N 2.73Å; G465-W491 VanDerWaalsContact O-CE3 3.24Å; G465-W491 WeakPolarHBondContact O-CZ3 3.27Å; G465-S492 CarbonylContact C-O 3.36Å; G465-S492 WeakPolarHBondContact CA-O 3.43Å; G465-L494 WeakPolarHBondContact O-CD1 3.42Å; G465-Y562 WeakPolarHBondContact O-CE1 3.04Å; G465-Y562 PolarHBondContact O-OH 3.42Å
466	R	86.9	Confident	86.9	Confident	73 Å²	73	64.5 Å²	64.5	28%	0.275	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122.6	173.4	173.2	176.7	-73.1	172.9	-9.4	107.7	T468 W491 S492 L494 T516 E561	R466-T468 PolarHBondContact O-N 3.25Å; R466-W491 CarbonylContact O-C 3.55Å; R466-W491 WeakPolarHBondContact O-CA 3.13Å; R466-S492 PolarHBondContact N-O 2.83Å; R466-S492 PolarHBondContact O-N 2.81Å; R466-S492 PolarHBondContact O-OG 3.3Å; R466-L494 HydrophobicContact CB-CD1 3.83Å; R466-L494 VanDerWaalsContact N-CD1 3.28Å; R466-T516 PolarHBondContact NH2-OG1 3.04Å; R466-E561 HydrophobicContact CG-CB 4.03Å; R466-E561 HydrophobicContact CG-CG 3.9Å; R466-E561 IonicContact CZ-OE1 2.9Å; R466-E561 IonicContact CZ-OE2 3.04Å; R466-E561 IonicContact NE-OE1 2.61Å; R466-E561 PolarHBondContact NE-OE1 3.43Å; R466-E561 IonicContact NE-OE2 3.84Å; R466-E561 IonicContact NH2-OE1 2.67Å; R466-E561 PolarHBondContact NH2-OE1 2.87Å; R466-E561 IonicContact NH2-OE2 2.62Å; R466-E561 PolarHBondContact NH2-OE2 3.27Å
467	P	88.8	Confident	87.1	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	126.9	177	27	-33.1	0	0	0	109.7	V489 W491 E561 R594 I596 W598	P467-V489 HydrophobicContact CB-CG2 4.49Å; P467-W491 HydrophobicContact CB-CD2 4.14Å; P467-W491 HydrophobicContact CB-CE3 4.49Å; P467-W491 HydrophobicContact CB-CH2 4.33Å; P467-W491 HydrophobicContact CB-CZ2 4Å; P467-W491 HydrophobicContact CG-CH2 4.23Å; P467-W491 HydrophobicContact CG-CZ2 4.37Å; P467-W491 HydrophobicContact CG-CZ3 4.39Å; P467-E561 HydrophobicContact CG-CB 4.5Å; P467-E561 WeakPolarHBondContact CG-O 3.12Å; P467-R594 PolarHBondContact O-NH1 2.98Å; P467-I596 HydrophobicContact CB-CD1 3.65Å; P467-I596 HydrophobicContact CG-CD1 4.44Å; P467-W598 HydrophobicContact CG-CH2 4.24Å; P467-W598 HydrophobicContact CG-CZ2 4.26Å
468	T	86.6	Confident	87.3	Confident	23 Å²	23	68.1 Å²	68.1	14%	0.141	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	176	175.1	72.4	0	0	0	0	110.6	R466 H470 M481 C490	R466-T468 PolarHBondContact O-N 3.25Å; T468-H470 VanDerWaalsContact C-N 3.28Å; T468-H470 PolarHBondContact OG1-N 2.78Å; T468-M481 HydrophobicContact CG2-SD 4.43Å; T468-C490 WeakPolarHBondContact CB-O 2.93Å; T468-C490 VanDerWaalsContact CG2-O 3.32Å; T468-C490 WeakPolarHBondContact CG2-O 3.29Å; T468-C490 PolarHBondContact N-O 2.79Å; T468-C490 WeakPolarHBondContact OG1-CB 3.03Å; T468-C490 PolarHBondContact OG1-O 3.07Å
469	K	82.9	Confident	87.2	Confident	153 Å²	153	69.9 Å²	69.9	67%	0.665	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	-1.9	171.5	-64	-174.4	178.3	-174.3	0	112.9
470	H	87.8	Confident	87.3	Confident	110 Å²	110	70.9 Å²	70.9	51%	0.509	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	117.3	-177	-64.6	-75.3	0	0	0	110.3	T468 M481 V489 C490	T468-H470 VanDerWaalsContact C-N 3.28Å; T468-H470 PolarHBondContact OG1-N 2.78Å; H470-M481 HydrophobicContact CB-CE 3.76Å; H470-M481 HydrophobicContact CB-SD 4.43Å; H470-M481 PolarHBondContact CD2-SD 3.34Å; H470-V489 CarbonylContact O-C 3.3Å; H470-V489 VanDerWaalsContact O-CA 3.31Å; H470-V489 WeakPolarHBondContact O-CA 3.36Å; H470-C490 HydrophobicContact CB-CB 4.34Å; H470-C490 PolarHBondContact O-N 2.87Å
471	L	89	Confident	87.3	Confident	117 Å²	117	70.2 Å²	70.2	61%	0.613	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	146.9	170.6	-66.7	167.6	0	0	0	110	G488 V489 N595	L471-G488 WeakPolarHBondContact CA-O 3.49Å; L471-V489 HydrophobicContact CD2-CG1 4.02Å; L471-N595 HydrophobicContact CD2-CB 3.71Å
472	C	91.8	Very high	87.4	Confident	16 Å²	16	72.5 Å²	72.5	11%	0.108	35%	0.351	C	S	.	.			trans	-144.4	154.4	177.4	61.8	0	0	0	0	110.2	D477 C478 C485 G488 V489	C472-D477 HydrophobicContact CB-CB 3.69Å; C472-C478 VanDerWaalsContact CB-SG 3.52Å; C472-C485 HydrophobicContact CB-CB 3.73Å; C472-C485 WeakPolarHBondContact CB-SG 3.42Å; C472-C485 PolarHBondContact O-SG 2.77Å; C472-C485 WeakPolarHBondContact SG-CA 3.36Å; C472-C485 WeakPolarHBondContact SG-CB 3.24Å; C472-C485 CovalentContact SG-SG 2.02Å; C472-C485 PolarHBondContact SG-SG 2.81Å; C472-G488 PolarHBondContact N-O 2.85Å; C472-G488 CarbonylContact O-C 3.46Å; C472-G488 WeakPolarHBondContact O-CA 3.36Å; C472-G488 VanDerWaalsContact SG-C 3.51Å; C472-V489 VanDerWaalsContact SG-CA 3.52Å; C472-V489 PolarHBondContact SG-N 3.02Å; C472-V489 VanDerWaalsContact SG-N 3.41Å; C472-V489 PolarHBondContact SG-O 3.04Å; C472-V489 VanDerWaalsContact SG-O 3.32Å
473	H	89.7	Confident	87.7	Confident	171 Å²	171	72.1 Å²	72.1	79%	0.792	35%	0.348	S	S	*	.	S	Bend	trans	-102.8	-34.6	169.7	-166.8	39.1	0	0	0	111.5	D477	H473-D477 PolarHBondContact N-OD2 3.23Å
474	D	90.2	Very high	87.9	Confident	48 Å²	48	70.8 Å²	70.8	26%	0.257	34%	0.342	S	S	.	.	S	Bend	trans	-147.6	175.6	173.3	67.3	63	0	0	0	112.1	R476 D477 C485	D474-R476 PolarHBondContact O-N 3.19Å; D474-R476 VanDerWaalsContact O-N 3.09Å; D474-R476 WeakPolarHBondContact OD1-CB 3.46Å; D474-R476 VanDerWaalsContact OD1-CG 3.31Å; D474-R476 WeakPolarHBondContact OD1-CG 3.34Å; D474-R476 IonicContact OD1-CZ 2.69Å; D474-R476 PolarHBondContact OD1-N 2.75Å; D474-R476 IonicContact OD1-NE 3.93Å; D474-R476 PolarHBondContact OD1-NE 2.87Å; D474-R476 IonicContact OD1-NH2 3.43Å; D474-R476 IonicContact OD2-CZ 3.13Å; D474-R476 IonicContact OD2-NE 3.93Å; D474-R476 PolarHBondContact OD2-NE 2.62Å; D474-R476 IonicContact OD2-NH2 3.81Å; D474-R476 PolarHBondContact OD2-NH2 3.31Å; D474-D477 PolarHBondContact N-OD2 3.24Å; D474-D477 WeakPolarHBondContact O-CB 3.44Å; D474-D477 PolarHBondContact O-N 3.23Å; D474-D477 VanDerWaalsContact O-N 3.16Å; D474-C485 VanDerWaalsContact O-CB 3.24Å; D474-C485 WeakPolarHBondContact O-CB 3.45Å
475	D	90.7	Very high	88.3	Confident	66 Å²	66	71.1 Å²	71.1	35%	0.353	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-55.2	-28	-175.9	-80.9	-25.2	0	0	0	114.1	H448 D477 C478 D479 G484 C485	H448-D475 IonicContact CE1-OD1 2.72Å; H448-D475 PolarHBondContact CE1-OD1 3.32Å; H448-D475 IonicContact CE1-OD2 3.94Å; H448-D475 IonicContact NE2-OD1 3.14Å; H448-D475 PolarHBondContact NE2-OD1 3.41Å; H448-D475 IonicContact NE2-OD2 2.8Å; D475-D477 VanDerWaalsContact C-N 3.25Å; D475-D477 PolarHBondContact O-N 3.5Å; D475-C478 WeakPolarHBondContact O-CA 3.21Å; D475-C478 WeakPolarHBondContact O-CB 3.45Å; D475-C478 PolarHBondContact O-N 3.46Å; D475-D479 PolarHBondContact O-N 2.01Å; D475-G484 VanDerWaalsContact OD1-CA 3.23Å; D475-G484 WeakPolarHBondContact OD1-CA 3.34Å; D475-C485 PolarHBondContact OD1-N 3.25Å
476	R	91.3	Very high	88.5	Confident	181 Å²	181	72 Å²	72	68%	0.683	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-68.6	-28.5	-176.5	-58.7	173.1	-71.2	-176.7	-1.5	112.1	D474 C478 D479	D474-R476 PolarHBondContact O-N 3.19Å; D474-R476 VanDerWaalsContact O-N 3.09Å; D474-R476 WeakPolarHBondContact OD1-CB 3.46Å; D474-R476 VanDerWaalsContact OD1-CG 3.31Å; D474-R476 WeakPolarHBondContact OD1-CG 3.34Å; D474-R476 IonicContact OD1-CZ 2.69Å; D474-R476 PolarHBondContact OD1-N 2.75Å; D474-R476 IonicContact OD1-NE 3.93Å; D474-R476 PolarHBondContact OD1-NE 2.87Å; D474-R476 IonicContact OD1-NH2 3.43Å; D474-R476 IonicContact OD2-CZ 3.13Å; D474-R476 IonicContact OD2-NE 3.93Å; D474-R476 PolarHBondContact OD2-NE 2.62Å; D474-R476 IonicContact OD2-NH2 3.81Å; D474-R476 PolarHBondContact OD2-NH2 3.31Å; R476-C478 PolarHBondContact O-N 2.75Å; R476-D479 PolarHBondContact O-N 3.39Å
477	D	92.4	Very high	88.6	Confident	89 Å²	89	69.6 Å²	69.6	48%	0.476	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-66.5	-15.4	174.5	-59.5	-37.3	0	0	0	111.8	C472 H473 D474 D475	C472-D477 HydrophobicContact CB-CB 3.69Å; H473-D477 PolarHBondContact N-OD2 3.23Å; D474-D477 PolarHBondContact N-OD2 3.24Å; D474-D477 WeakPolarHBondContact O-CB 3.44Å; D474-D477 PolarHBondContact O-N 3.23Å; D474-D477 VanDerWaalsContact O-N 3.16Å; D475-D477 VanDerWaalsContact C-N 3.25Å; D475-D477 PolarHBondContact O-N 3.5Å
478	C	91.9	Very high	88.5	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-108.6	-0.8	-175.3	-56	0	0	0	0	114.1	C472 D475 R476 L480 M481 N482 A483 C490	C472-C478 VanDerWaalsContact CB-SG 3.52Å; D475-C478 WeakPolarHBondContact O-CA 3.21Å; D475-C478 WeakPolarHBondContact O-CB 3.45Å; D475-C478 PolarHBondContact O-N 3.46Å; R476-C478 PolarHBondContact O-N 2.75Å; C478-L480 VanDerWaalsContact C-N 3.31Å; C478-L480 PolarHBondContact O-N 3.3Å; C478-M481 PolarHBondContact O-N 3.42Å; C478-N482 PolarHBondContact O-N 2.84Å; C478-A483 HydrophobicContact CB-CB 3.83Å; C478-A483 WeakPolarHBondContact CB-O 3.03Å; C478-A483 PolarHBondContact O-N 2.92Å; C478-C490 WeakPolarHBondContact CA-SG 3.29Å; C478-C490 HydrophobicContact CB-CB 3.79Å; C478-C490 WeakPolarHBondContact CB-SG 3.31Å; C478-C490 WeakPolarHBondContact SG-CA 3.3Å; C478-C490 WeakPolarHBondContact SG-CB 3.33Å; C478-C490 CovalentContact SG-SG 2.03Å; C478-C490 PolarHBondContact SG-SG 3.25Å
479	D	85.2	Confident	88.7	Confident	96 Å²	96	69.3 Å²	69.3	51%	0.513	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-57.2	-41.5	-173	-82	-23.9	0	0	0	112.9	D475 R476 M481 N482	D475-D479 PolarHBondContact O-N 2.01Å; R476-D479 PolarHBondContact O-N 3.39Å; D479-M481 PolarHBondContact O-N 2.94Å; D479-M481 VanDerWaalsContact O-N 3.1Å; D479-N482 PolarHBondContact O-N 2.83Å; D479-N482 VanDerWaalsContact O-N 3.17Å
480	L	84.7	Confident	89.2	Confident	182 Å²	182	62 Å²	62	95%	0.953	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-61.8	-21.2	-179.4	-66.7	176.4	0	0	0	113.5	C478	C478-L480 VanDerWaalsContact C-N 3.31Å; C478-L480 PolarHBondContact O-N 3.3Å
481	M	82.2	Confident	89.3	Confident	61 Å²	61	56.8 Å²	56.8	30%	0.3	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-107.5	5.7	-176.4	-63.1	-179.6	-73.4	0	0	113.1	T468 H470 C478 D479 A483 C490	T468-M481 HydrophobicContact CG2-SD 4.43Å; H470-M481 HydrophobicContact CB-CE 3.76Å; H470-M481 HydrophobicContact CB-SD 4.43Å; H470-M481 PolarHBondContact CD2-SD 3.34Å; C478-M481 PolarHBondContact O-N 3.42Å; D479-M481 PolarHBondContact O-N 2.94Å; D479-M481 VanDerWaalsContact O-N 3.1Å; M481-A483 HydrophobicContact CB-CB 3.97Å; M481-A483 PolarHBondContact O-N 2.04Å; M481-C490 HydrophobicContact CE-CB 3.47Å; M481-C490 VanDerWaalsContact CE-CB 3.47Å; M481-C490 WeakPolarHBondContact CE-SG 3.03Å
482	N	84.4	Confident	89.4	Confident	90 Å²	90	52.8 Å²	52.8	48%	0.481	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	40.8	-174.6	-156.8	49.2	0	0	0	111.1	R458 C478 D479	R458-N482 PolarHBondContact NH1-O 3.35Å; R458-N482 PolarHBondContact NH1-OD1 3.44Å; R458-N482 PolarHBondContact NH2-OD1 2.95Å; C478-N482 PolarHBondContact O-N 2.84Å; D479-N482 PolarHBondContact O-N 2.83Å; D479-N482 VanDerWaalsContact O-N 3.17Å
483	A	89.3	Confident	89.2	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.017	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	167	-170.4	0	0	0	0	0	111.8	C478 M481 C490 W491	C478-A483 HydrophobicContact CB-CB 3.83Å; C478-A483 WeakPolarHBondContact CB-O 3.03Å; C478-A483 PolarHBondContact O-N 2.92Å; M481-A483 HydrophobicContact CB-CB 3.97Å; M481-A483 PolarHBondContact O-N 2.04Å; A483-C490 HydrophobicContact CB-CB 4.1Å; A483-W491 WeakPolarHBondContact CA-O 3.41Å; A483-W491 VanDerWaalsContact CB-C 3.49Å; A483-W491 WeakPolarHBondContact CB-O 3.5Å
484	G	90.6	Very high	88.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	150.7	171.2	0	0	0	0	0	111.6	D475 R486 C490 W491	D475-G484 VanDerWaalsContact OD1-CA 3.23Å; D475-G484 WeakPolarHBondContact OD1-CA 3.34Å; G484-R486 PolarHBondContact O-N 2.86Å; G484-C490 WeakPolarHBondContact O-CA 3.32Å; G484-W491 PolarHBondContact N-O 3.48Å; G484-W491 VanDerWaalsContact N-O 3.08Å; G484-W491 PolarHBondContact O-N 3.12Å
485	C	91.9	Very high	88.7	Confident	15 Å²	15	50.7 Å²	50.7	10%	0.101	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	96.5	-177.6	-176.1	0	0	0	0	111.8	H448 C472 D474 D475	H448-C485 PolarHBondContact CD2-O 3.24Å; H448-C485 PolarHBondContact NE2-N 2.89Å; H448-C485 PolarHBondContact NE2-O 2.87Å; H448-C485 VanDerWaalsContact NE2-O 3.08Å; C472-C485 HydrophobicContact CB-CB 3.73Å; C472-C485 WeakPolarHBondContact CB-SG 3.42Å; C472-C485 PolarHBondContact O-SG 2.77Å; C472-C485 WeakPolarHBondContact SG-CA 3.36Å; C472-C485 WeakPolarHBondContact SG-CB 3.24Å; C472-C485 CovalentContact SG-SG 2.02Å; C472-C485 PolarHBondContact SG-SG 2.81Å; D474-C485 VanDerWaalsContact O-CB 3.24Å; D474-C485 WeakPolarHBondContact O-CB 3.45Å; D475-C485 PolarHBondContact OD1-N 3.25Å
486	R	90.1	Very high	88.4	Confident	17 Å²	17	51.4 Å²	51.4	6%	0.064	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.4	-179.5	-162.7	-175.4	-177.6	169.3	0.6	110.5	H448 C451 G452 D453 S455 V456 G484 G488 V489 W491	H448-R486 HydrophobicContact CB-CB 4.34Å; H448-R486 HydrophobicContact CB-CG 3.85Å; H448-R486 PolarHBondContact O-NH1 3.01Å; H448-R486 PolarHBondContact O-NH2 3.14Å; C451-R486 PolarHBondContact O-NH1 3.22Å; C451-R486 PolarHBondContact O-NH2 2.86Å; G452-R486 PolarHBondContact O-NH1 3.33Å; D453-R486 PolarHBondContact O-NH1 2.64Å; S455-R486 VanDerWaalsContact O-CD 3.23Å; S455-R486 WeakPolarHBondContact O-CD 3.01Å; S455-R486 PolarHBondContact O-NH1 2.8Å; V456-R486 HydrophobicContact CG1-CB 3.8Å; G484-R486 PolarHBondContact O-N 2.86Å; R486-G488 PolarHBondContact O-N 2.92Å; R486-V489 PolarHBondContact N-O 2.9Å; R486-V489 PolarHBondContact O-N 3.21Å; R486-W491 HydrophobicContact CB-CG 4.4Å; R486-W491 PolarHBondContact O-NE1 3.49Å
487	F	88.9	Confident	88.2	Confident	23 Å²	23	43.2 Å²	43.2	10%	0.101	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	27.9	-176.6	-47.6	-65	0	0	0	113.5	V489 W491 P575 D577 S579 I596	F487-V489 VanDerWaalsContact C-N 3.3Å; F487-V489 PolarHBondContact O-N 3.32Å; F487-W491 AromaticContact CD2-CZ2 3.87Å; F487-W491 HydrophobicContact CD2-CZ2 3.87Å; F487-W491 HydrophobicContact CE2-CZ2 4.2Å; F487-P575 HydrophobicContact CD2-CB 3.95Å; F487-P575 HydrophobicContact CE2-CB 3.59Å; F487-P575 HydrophobicContact CE2-CG 3.76Å; F487-P575 HydrophobicContact CZ-CB 4.04Å; F487-P575 HydrophobicContact CZ-CG 4.18Å; F487-D577 VanDerWaalsContact CE1-OD1 3.24Å; F487-D577 WeakPolarHBondContact CE1-OD1 3.37Å; F487-S579 WeakPolarHBondContact O-CA 3.18Å; F487-I596 HydrophobicContact CB-CG1 4.04Å; F487-I596 HydrophobicContact CB-CG2 3.98Å; F487-I596 HydrophobicContact CD2-CG2 4.35Å; F487-I596 HydrophobicContact CG-CG2 4.24Å
488	G	87.9	Confident	87.9	Confident	19 Å²	19	48.2 Å²	48.2	20%	0.196	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	11	-179.6	0	0	0	0	0	115.3	L471 C472 R486	L471-G488 WeakPolarHBondContact CA-O 3.49Å; C472-G488 PolarHBondContact N-O 2.85Å; C472-G488 CarbonylContact O-C 3.46Å; C472-G488 WeakPolarHBondContact O-CA 3.36Å; C472-G488 VanDerWaalsContact SG-C 3.51Å; R486-G488 PolarHBondContact O-N 2.92Å
489	V	90	Very high	87.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	153.8	171.4	-64.9	0	0	0	0	111.7	P467 H470 L471 C472 R486 F487 W491 N595 I596	P467-V489 HydrophobicContact CB-CG2 4.49Å; H470-V489 CarbonylContact O-C 3.3Å; H470-V489 VanDerWaalsContact O-CA 3.31Å; H470-V489 WeakPolarHBondContact O-CA 3.36Å; L471-V489 HydrophobicContact CD2-CG1 4.02Å; C472-V489 VanDerWaalsContact SG-CA 3.52Å; C472-V489 PolarHBondContact SG-N 3.02Å; C472-V489 VanDerWaalsContact SG-N 3.41Å; C472-V489 PolarHBondContact SG-O 3.04Å; C472-V489 VanDerWaalsContact SG-O 3.32Å; R486-V489 PolarHBondContact N-O 2.9Å; R486-V489 PolarHBondContact O-N 3.21Å; F487-V489 VanDerWaalsContact C-N 3.3Å; F487-V489 PolarHBondContact O-N 3.32Å; V489-W491 VanDerWaalsContact O-CD1 3.25Å; V489-N595 HydrophobicContact CG1-CB 3.74Å; V489-I596 HydrophobicContact CG1-CG1 4.47Å; V489-I596 HydrophobicContact CG2-CD1 3.37Å; V489-I596 HydrophobicContact CG2-CG1 3.43Å; V489-I596 VanDerWaalsContact CG2-CG1 3.43Å
490	C	92.3	Very high	87.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	129.5	175.4	-64.8	0	0	0	0	110.7	T468 H470 C478 M481 A483 G484	T468-C490 WeakPolarHBondContact CB-O 2.93Å; T468-C490 VanDerWaalsContact CG2-O 3.32Å; T468-C490 WeakPolarHBondContact CG2-O 3.29Å; T468-C490 PolarHBondContact N-O 2.79Å; T468-C490 WeakPolarHBondContact OG1-CB 3.03Å; T468-C490 PolarHBondContact OG1-O 3.07Å; H470-C490 HydrophobicContact CB-CB 4.34Å; H470-C490 PolarHBondContact O-N 2.87Å; C478-C490 WeakPolarHBondContact CA-SG 3.29Å; C478-C490 HydrophobicContact CB-CB 3.79Å; C478-C490 WeakPolarHBondContact CB-SG 3.31Å; C478-C490 WeakPolarHBondContact SG-CA 3.3Å; C478-C490 WeakPolarHBondContact SG-CB 3.33Å; C478-C490 CovalentContact SG-SG 2.03Å; C478-C490 PolarHBondContact SG-SG 3.25Å; M481-C490 HydrophobicContact CE-CB 3.47Å; M481-C490 VanDerWaalsContact CE-CB 3.47Å; M481-C490 WeakPolarHBondContact CE-SG 3.03Å; A483-C490 HydrophobicContact CB-CB 4.1Å; G484-C490 WeakPolarHBondContact O-CA 3.32Å
491	W	90.9	Very high	87.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	108.2	173.7	-71.9	66.2	0	0	0	110	Y454 V456 G465 R466 P467 A483 G484 R486 F487 V489 Y562 P575 I596 W598	Y454-W491 HydrophobicContact CD1-CH2 4.17Å; Y454-W491 HydrophobicContact CD1-CZ3 4.24Å; V456-W491 HydrophobicContact CG1-CB 3.54Å; V456-W491 HydrophobicContact CG1-CG 3.99Å; V456-W491 HydrophobicContact CG2-CB 4.42Å; G465-W491 VanDerWaalsContact O-CE3 3.24Å; G465-W491 WeakPolarHBondContact O-CZ3 3.27Å; R466-W491 CarbonylContact O-C 3.55Å; R466-W491 WeakPolarHBondContact O-CA 3.13Å; P467-W491 HydrophobicContact CB-CD2 4.14Å; P467-W491 HydrophobicContact CB-CE3 4.49Å; P467-W491 HydrophobicContact CB-CH2 4.33Å; P467-W491 HydrophobicContact CB-CZ2 4Å; P467-W491 HydrophobicContact CG-CH2 4.23Å; P467-W491 HydrophobicContact CG-CZ2 4.37Å; P467-W491 HydrophobicContact CG-CZ3 4.39Å; A483-W491 WeakPolarHBondContact CA-O 3.41Å; A483-W491 VanDerWaalsContact CB-C 3.49Å; A483-W491 WeakPolarHBondContact CB-O 3.5Å; G484-W491 PolarHBondContact N-O 3.48Å; G484-W491 VanDerWaalsContact N-O 3.08Å; G484-W491 PolarHBondContact O-N 3.12Å; R486-W491 HydrophobicContact CB-CG 4.4Å; R486-W491 PolarHBondContact O-NE1 3.49Å; F487-W491 AromaticContact CD2-CZ2 3.87Å; F487-W491 HydrophobicContact CD2-CZ2 3.87Å; F487-W491 HydrophobicContact CE2-CZ2 4.2Å; V489-W491 VanDerWaalsContact O-CD1 3.25Å; W491-Y562 AromaticContact CZ3-CE1 3.99Å; W491-Y562 HydrophobicContact CZ3-CE1 3.99Å; W491-P575 HydrophobicContact CH2-CB 4.49Å; W491-P575 HydrophobicContact CH2-CG 4.22Å; W491-P575 HydrophobicContact CZ2-CB 4.39Å; W491-I596 HydrophobicContact CZ2-CD1 3.52Å; W491-W598 HydrophobicContact CH2-CH2 4.03Å; W491-W598 HydrophobicContact CZ2-CH2 4.4Å
492	S	90.1	Very high	88.1	Confident	32 Å²	32	50.9 Å²	50.9	22%	0.224	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	133	178.3	60.4	0	0	0	0	110.7	G465 R466 L494	G465-S492 CarbonylContact C-O 3.36Å; G465-S492 WeakPolarHBondContact CA-O 3.43Å; R466-S492 PolarHBondContact N-O 2.83Å; R466-S492 PolarHBondContact O-N 2.81Å; R466-S492 PolarHBondContact O-OG 3.3Å; S492-L494 PolarHBondContact O-N 2.04Å
493	R	88.3	Confident	88.2	Confident	110 Å²	110	46.9 Å²	46.9	42%	0.415	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	132.8	179.8	175.7	170.2	172.9	-175	-1.9	112.1	H463 L464	H463-R493 HydrophobicContact CB-CG 4.02Å; H463-R493 PolarHBondContact CE1-NH1 2.03Å; H463-R493 VanDerWaalsContact CE1-NH1 3.3Å; H463-R493 PolarHBondContact ND1-NE 3.1Å; L464-R493 WeakPolarHBondContact O-CA 3.36Å
494	L	84.5	Confident	88.1	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.021	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-68.8	136	172.3	-92.8	71.2	0	0	0	110.1	L464 G465 R466 S492 T496 F513 R515 Y562	L464-L494 HydrophobicContact CB-CB 4.46Å; L464-L494 PolarHBondContact O-N 3.34Å; G465-L494 WeakPolarHBondContact O-CD1 3.42Å; R466-L494 HydrophobicContact CB-CD1 3.83Å; R466-L494 VanDerWaalsContact N-CD1 3.28Å; S492-L494 PolarHBondContact O-N 2.04Å; L494-T496 PolarHBondContact O-N 2.77Å; L494-F513 HydrophobicContact CB-CB 4.38Å; L494-F513 HydrophobicContact CB-CD1 3.91Å; L494-F513 HydrophobicContact CB-CG 4.43Å; L494-F513 HydrophobicContact CD2-CB 4.11Å; L494-R515 HydrophobicContact CD2-CG 4.01Å; L494-Y562 VanDerWaalsContact CD1-OH 3.23Å; L494-Y562 WeakPolarHBondContact CD1-OH 3.42Å
495	P	85.1	Confident	87.7	Confident	77 Å²	77	54.4 Å²	54.4	50%	0.5	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-60.7	129.6	170.4	-19.7	31.5	0	0	0	110.3	F513 C514	P495-F513 WeakPolarHBondContact O-CA 3.02Å; P495-C514 HydrophobicContact CB-CB 4.18Å; P495-C514 HydrophobicContact CG-CB 4.48Å; P495-C514 PolarHBondContact O-N 2.87Å
496	T	85.2	Confident	87.3	Confident	82 Å²	82	59.7 Å²	59.7	50%	0.503	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-78.8	148.4	170.7	51.7	0	0	0	0	109.8	L494 G512 F513	L494-T496 PolarHBondContact O-N 2.77Å; T496-G512 CarbonylContact C-O 3.4Å; T496-G512 VanDerWaalsContact CA-O 3.28Å; T496-G512 WeakPolarHBondContact CA-O 3.32Å; T496-F513 HydrophobicContact CG2-CD1 3.96Å; T496-F513 HydrophobicContact CG2-CE1 3.63Å
497	C	87.3	Confident	87	Confident	9 Å²	9	59.9 Å²	59.9	6%	0.061	31%	0.314	C	S	.	.			trans	-143.1	157	177.6	58.2	0	0	0	0	111.4	E502 C509 G512 F513	C497-E502 WeakPolarHBondContact CA-OE2 3.49Å; C497-E502 HydrophobicContact CB-CB 4Å; C497-C509 HydrophobicContact CB-CB 3.75Å; C497-C509 WeakPolarHBondContact CB-SG 3.31Å; C497-C509 PolarHBondContact O-SG 2.8Å; C497-C509 VanDerWaalsContact O-SG 3.37Å; C497-C509 WeakPolarHBondContact SG-CA 3.02Å; C497-C509 WeakPolarHBondContact SG-CB 3.34Å; C497-C509 CovalentContact SG-SG 2.03Å; C497-C509 PolarHBondContact SG-SG 3.41Å; C497-G512 PolarHBondContact N-O 2.93Å; C497-G512 CarbonylContact O-C 3.48Å; C497-G512 VanDerWaalsContact O-CA 3.3Å; C497-G512 WeakPolarHBondContact O-CA 3.35Å; C497-F513 PolarHBondContact SG-N 3.06Å; C497-F513 VanDerWaalsContact SG-N 3.42Å
498	K	85.1	Confident	86.9	Confident	193 Å²	193	58.9 Å²	58.9	84%	0.839	31%	0.31	S	S	*	.	S	Bend	trans	-103.8	-24.5	166.4	-64.8	-178.8	179	178.8	0	113.1	E502	K498-E502 PolarHBondContact N-OE2 3.23Å
499	E	86.3	Confident	86.8	Confident	70 Å²	70	58.5 Å²	58.5	33%	0.327	30%	0.304	S	S	.	.	S	Bend	trans	-152.9	156.3	-172	54.1	-173.8	169.2	0	0	110.1	R501 E502 C509	E499-R501 HydrophobicContact CG-CG 3.66Å; E499-R501 PolarHBondContact O-N 3.11Å; E499-R501 VanDerWaalsContact O-N 3.09Å; E499-R501 IonicContact OE1-CZ 3.49Å; E499-R501 IonicContact OE1-NE 3.52Å; E499-R501 PolarHBondContact OE1-NE 3.17Å; E499-R501 IonicContact OE1-NH2 3.5Å; E499-R501 PolarHBondContact OE1-NH2 2.87Å; E499-R501 IonicContact OE2-CZ 3.31Å; E499-R501 IonicContact OE2-NE 2.59Å; E499-R501 PolarHBondContact OE2-NE 3.4Å; E499-R501 IonicContact OE2-NH1 3.96Å; E499-R501 IonicContact OE2-NH2 3.07Å; E499-R501 PolarHBondContact OE2-NH2 2.04Å; E499-E502 HydrophobicContact CG-CG 3.86Å; E499-E502 WeakPolarHBondContact O-CB 3.37Å; E499-E502 PolarHBondContact O-N 3.04Å; E499-E502 VanDerWaalsContact O-N 3.08Å; E499-C509 VanDerWaalsContact C-CB 3.46Å
500	H	86.3	Confident	86.4	Confident	36 Å²	36	59.4 Å²	59.4	17%	0.167	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-63.1	-21.9	-171.1	-56.1	-47	0	0	0	114.9	E502 C503 C509 C539 R540	H500-E502 PolarHBondContact O-N 3.35Å; H500-C503 PolarHBondContact O-N 3.24Å; H500-C509 PolarHBondContact CE1-O 3.12Å; H500-C509 WeakPolarHBondContact ND1-CB 3.34Å; H500-C509 PolarHBondContact ND1-N 3.33Å; H500-C509 PolarHBondContact ND1-O 3.5Å; H500-C539 PolarHBondContact CD2-O 2.8Å; H500-R540 HydrophobicContact CB-CB 4.26Å; H500-R540 HydrophobicContact CB-CG 3.88Å; H500-R540 PolarHBondContact O-NE 2.73Å
501	R	86.2	Confident	85.6	Confident	200 Å²	200	61.2 Å²	61.2	76%	0.755	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-71.3	-16.9	177.6	63	174.6	-175.9	-144	-13.6	113.7	E499 C503	E499-R501 HydrophobicContact CG-CG 3.66Å; E499-R501 PolarHBondContact O-N 3.11Å; E499-R501 VanDerWaalsContact O-N 3.09Å; E499-R501 IonicContact OE1-CZ 3.49Å; E499-R501 IonicContact OE1-NE 3.52Å; E499-R501 PolarHBondContact OE1-NE 3.17Å; E499-R501 IonicContact OE1-NH2 3.5Å; E499-R501 PolarHBondContact OE1-NH2 2.87Å; E499-R501 IonicContact OE2-CZ 3.31Å; E499-R501 IonicContact OE2-NE 2.59Å; E499-R501 PolarHBondContact OE2-NE 3.4Å; E499-R501 IonicContact OE2-NH1 3.96Å; E499-R501 IonicContact OE2-NH2 3.07Å; E499-R501 PolarHBondContact OE2-NH2 2.04Å; R501-C503 VanDerWaalsContact C-N 3.25Å
502	E	89.2	Confident	85.2	Confident	89 Å²	89	62 Å²	62	42%	0.416	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-78.5	-12.6	175.2	-63.7	177.4	-163.9	0	0	112.2	C497 K498 E499 H500	C497-E502 WeakPolarHBondContact CA-OE2 3.49Å; C497-E502 HydrophobicContact CB-CB 4Å; K498-E502 PolarHBondContact N-OE2 3.23Å; E499-E502 HydrophobicContact CG-CG 3.86Å; E499-E502 WeakPolarHBondContact O-CB 3.37Å; E499-E502 PolarHBondContact O-N 3.04Å; E499-E502 VanDerWaalsContact O-N 3.08Å; H500-E502 PolarHBondContact O-N 3.35Å
503	C	87.4	Confident	84.9	Confident	7 Å²	7	61.2 Å²	61.2	5%	0.047	32%	0.318	C	S	.	.	S	Bend	trans	-97.6	134.6	-178.4	-59.4	0	0	0	0	112.4	H500 R501 D507 C509 C514 R540	H500-C503 PolarHBondContact O-N 3.24Å; R501-C503 VanDerWaalsContact C-N 3.25Å; C503-D507 HydrophobicContact CB-CB 3.81Å; C503-D507 WeakPolarHBondContact CB-O 2.99Å; C503-C509 PolarHBondContact SG-N 3.34Å; C503-C514 WeakPolarHBondContact CA-SG 3.26Å; C503-C514 HydrophobicContact CB-CB 3.72Å; C503-C514 WeakPolarHBondContact CB-SG 3.36Å; C503-C514 WeakPolarHBondContact SG-CA 3.04Å; C503-C514 WeakPolarHBondContact SG-CB 2.91Å; C503-C514 CovalentContact SG-SG 2.05Å; C503-C514 PolarHBondContact SG-SG 3.14Å; C503-R540 PolarHBondContact O-NH2 2.76Å
504	S	86.3	Confident	84.9	Confident	94 Å²	94	56 Å²	56	66%	0.657	30%	0.299	S	S	*	.			trans	-86.2	152.4	-179.6	55.8	0	0	0	0	112.8	Q506 D507	S504-Q506 PolarHBondContact O-N 3.19Å; S504-D507 WeakPolarHBondContact O-CB 3.23Å; S504-D507 PolarHBondContact O-N 3.33Å
505	G	82.9	Confident	84.8	Confident	65 Å²	65	56.1 Å²	56.1	67%	0.67	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	-134.8	173.3	0	0	0	0	0	112.8	D507 R540	G505-D507 VanDerWaalsContact C-N 3.26Å; G505-D507 PolarHBondContact O-N 2.01Å; G505-R540 PolarHBondContact O-NH1 3.49Å; G505-R540 PolarHBondContact O-NH2 3.4Å
506	Q	82.1	Confident	84.7	Confident	127 Å²	127	54.1 Å²	54.1	59%	0.593	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	8.3	179.8	-68.9	178.8	-15.4	0	0	113.4	S504 A517 W545	S504-Q506 PolarHBondContact O-N 3.19Å; Q506-A517 PolarHBondContact O-N 2.91Å; Q506-W545 HydrophobicContact CB-CZ3 4.17Å; Q506-W545 HydrophobicContact CG-CZ3 4.33Å
507	D	85.6	Confident	84.6	Confident	21 Å²	21	50.2 Å²	50.2	11%	0.112	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	140.5	-178.1	-67.6	-3.4	0	0	0	111.9	C503 S504 G505 C514 R515 T516 R540	C503-D507 HydrophobicContact CB-CB 3.81Å; C503-D507 WeakPolarHBondContact CB-O 2.99Å; S504-D507 WeakPolarHBondContact O-CB 3.23Å; S504-D507 PolarHBondContact O-N 3.33Å; G505-D507 VanDerWaalsContact C-N 3.26Å; G505-D507 PolarHBondContact O-N 2.01Å; D507-C514 HydrophobicContact CB-CB 4.09Å; D507-R515 CarbonylContact C-O 3.56Å; D507-R515 WeakPolarHBondContact CA-O 3.15Å; D507-T516 VanDerWaalsContact OD1-CA 3.29Å; D507-T516 WeakPolarHBondContact OD1-CA 2.93Å; D507-T516 PolarHBondContact OD1-N 3.23Å; D507-R540 PolarHBondContact O-NE 2.9Å; D507-R540 PolarHBondContact O-NH1 3.46Å; D507-R540 PolarHBondContact O-NH2 3.46Å
508	I	85.6	Confident	84.2	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	148.9	167.9	64.4	-179.2	0	0	0	109.6	Y510 C514 R515 A517 M538 R540 W545 L547	I508-Y510 HydrophobicContact CD1-CD2 4.47Å; I508-Y510 PolarHBondContact O-N 3.33Å; I508-C514 WeakPolarHBondContact O-CA 3.39Å; I508-R515 PolarHBondContact N-O 2.91Å; I508-R515 PolarHBondContact O-N 3.26Å; I508-A517 HydrophobicContact CB-CB 4.23Å; I508-A517 HydrophobicContact CD1-CB 3.6Å; I508-A517 HydrophobicContact CG1-CB 3.64Å; I508-A517 HydrophobicContact CG2-CB 3.75Å; I508-M538 HydrophobicContact CD1-CB 4.3Å; I508-M538 HydrophobicContact CD1-SD 4.02Å; I508-R540 HydrophobicContact CG2-CB 4.32Å; I508-W545 HydrophobicContact CD1-CB 4.29Å; I508-W545 HydrophobicContact CG2-CB 3.71Å; I508-W545 HydrophobicContact CG2-CD2 4.29Å; I508-W545 HydrophobicContact CG2-CG 3.89Å; I508-L547 HydrophobicContact CD1-CD2 4.29Å; I508-L547 HydrophobicContact CG1-CD2 4.42Å
509	C	86.3	Confident	84.2	Confident	11 Å²	11	45.8 Å²	45.8	7%	0.074	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	96.2	166.5	-167.8	0	0	0	0	111	C497 E499 H500 C503 M538	C497-C509 HydrophobicContact CB-CB 3.75Å; C497-C509 WeakPolarHBondContact CB-SG 3.31Å; C497-C509 PolarHBondContact O-SG 2.8Å; C497-C509 VanDerWaalsContact O-SG 3.37Å; C497-C509 WeakPolarHBondContact SG-CA 3.02Å; C497-C509 WeakPolarHBondContact SG-CB 3.34Å; C497-C509 CovalentContact SG-SG 2.03Å; C497-C509 PolarHBondContact SG-SG 3.41Å; E499-C509 VanDerWaalsContact C-CB 3.46Å; H500-C509 PolarHBondContact CE1-O 3.12Å; H500-C509 WeakPolarHBondContact ND1-CB 3.34Å; H500-C509 PolarHBondContact ND1-N 3.33Å; H500-C509 PolarHBondContact ND1-O 3.5Å; C503-C509 PolarHBondContact SG-N 3.34Å; C509-M538 VanDerWaalsContact O-SD 3.39Å
510	Y	82.3	Confident	83.8	Confident	19 Å²	19	43.9 Å²	43.9	8%	0.075	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	120.4	178.5	-172.4	-87.4	0	0	0	109.3	I508 G512 F513 R515 M538 L547	I508-Y510 HydrophobicContact CD1-CD2 4.47Å; I508-Y510 PolarHBondContact O-N 3.33Å; Y510-G512 PolarHBondContact O-N 2.84Å; Y510-F513 PolarHBondContact N-O 3.28Å; Y510-F513 PolarHBondContact O-N 3.31Å; Y510-F513 VanDerWaalsContact O-O 3.12Å; Y510-R515 VanDerWaalsContact CD1-NH1 3.28Å; Y510-M538 HydrophobicContact CD2-CE 3.36Å; Y510-M538 HydrophobicContact CD2-SD 3.62Å; Y510-M538 HydrophobicContact CE2-CE 3.79Å; Y510-M538 HydrophobicContact CE2-SD 4.44Å; Y510-M538 HydrophobicContact CG-CE 4.1Å; Y510-M538 HydrophobicContact CG-SD 4.35Å; Y510-L547 HydrophobicContact CD1-CD1 3.69Å; Y510-L547 HydrophobicContact CD1-CD2 4.37Å; Y510-L547 HydrophobicContact CD1-CG 4.38Å; Y510-L547 HydrophobicContact CD2-CD1 3.87Å; Y510-L547 HydrophobicContact CD2-CD2 4.1Å; Y510-L547 HydrophobicContact CD2-CG 3.85Å; Y510-L547 HydrophobicContact CE1-CD1 3.59Å; Y510-L547 HydrophobicContact CE2-CD1 3.8Å; Y510-L547 HydrophobicContact CE2-CG 4.09Å; Y510-L547 HydrophobicContact CG-CD1 3.81Å; Y510-L547 HydrophobicContact CG-CD2 3.86Å; Y510-L547 HydrophobicContact CG-CG 4Å
511	N	74.3	Confident	83	Confident	38 Å²	38	45.2 Å²	45.2	20%	0.203	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	28.1	177.7	-82.9	-7.9	0	0	0	114.4	E423 C424 K425 S426	E423-N511 PolarHBondContact O-ND2 2.04Å; C424-N511 VanDerWaalsContact O-CB 3.23Å; C424-N511 WeakPolarHBondContact O-CB 3.29Å; C424-N511 PolarHBondContact O-ND2 3.25Å; K425-N511 CarbonylContact C-O 3.53Å; S426-N511 WeakPolarHBondContact CA-O 3.14Å; S426-N511 WeakPolarHBondContact CB-O 3.34Å; S426-N511 PolarHBondContact N-O 3.29Å
512	G	82.5	Confident	82.3	Confident	17 Å²	17	38.3 Å²	38.3	18%	0.175	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	7.6	179.5	0	0	0	0	0	115.4	T496 C497 Y510	T496-G512 CarbonylContact C-O 3.4Å; T496-G512 VanDerWaalsContact CA-O 3.28Å; T496-G512 WeakPolarHBondContact CA-O 3.32Å; C497-G512 PolarHBondContact N-O 2.93Å; C497-G512 CarbonylContact O-C 3.48Å; C497-G512 VanDerWaalsContact O-CA 3.3Å; C497-G512 WeakPolarHBondContact O-CA 3.35Å; Y510-G512 PolarHBondContact O-N 2.84Å
513	F	84.6	Confident	81.9	Confident	15 Å²	15	39.6 Å²	39.6	7%	0.066	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	146	172.9	-61.7	-80.5	0	0	0	112.3	S426 L464 L494 P495 T496 C497 Y510 R515	S426-F513 VanDerWaalsContact CA-CE2 3.47Å; S426-F513 VanDerWaalsContact CB-CE2 3.47Å; L464-F513 HydrophobicContact CB-CD1 4.48Å; L464-F513 HydrophobicContact CB-CE1 4.14Å; L464-F513 HydrophobicContact CB-CE2 4.26Å; L464-F513 HydrophobicContact CB-CZ 4.02Å; L464-F513 HydrophobicContact CD1-CD2 3.59Å; L464-F513 HydrophobicContact CD1-CE1 4.47Å; L464-F513 HydrophobicContact CD1-CE2 3.13Å; L464-F513 HydrophobicContact CD1-CG 4.4Å; L464-F513 HydrophobicContact CD1-CZ 3.67Å; L464-F513 HydrophobicContact CG-CE2 4.25Å; L464-F513 HydrophobicContact CG-CZ 4.39Å; L494-F513 HydrophobicContact CB-CB 4.38Å; L494-F513 HydrophobicContact CB-CD1 3.91Å; L494-F513 HydrophobicContact CB-CG 4.43Å; L494-F513 HydrophobicContact CD2-CB 4.11Å; P495-F513 WeakPolarHBondContact O-CA 3.02Å; T496-F513 HydrophobicContact CG2-CD1 3.96Å; T496-F513 HydrophobicContact CG2-CE1 3.63Å; C497-F513 PolarHBondContact SG-N 3.06Å; C497-F513 VanDerWaalsContact SG-N 3.42Å; Y510-F513 PolarHBondContact N-O 3.28Å; Y510-F513 PolarHBondContact O-N 3.31Å; Y510-F513 VanDerWaalsContact O-O 3.12Å; F513-R515 HydrophobicContact CB-CG 4.48Å; F513-R515 PolarHBondContact O-N 3.42Å
514	C	87.2	Confident	81.5	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.014	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	120.8	171.5	-64.3	0	0	0	0	109.9	P495 C503 D507 I508	P495-C514 HydrophobicContact CB-CB 4.18Å; P495-C514 HydrophobicContact CG-CB 4.48Å; P495-C514 PolarHBondContact O-N 2.87Å; C503-C514 WeakPolarHBondContact CA-SG 3.26Å; C503-C514 HydrophobicContact CB-CB 3.72Å; C503-C514 WeakPolarHBondContact CB-SG 3.36Å; C503-C514 WeakPolarHBondContact SG-CA 3.04Å; C503-C514 WeakPolarHBondContact SG-CB 2.91Å; C503-C514 CovalentContact SG-SG 2.05Å; C503-C514 PolarHBondContact SG-SG 3.14Å; D507-C514 HydrophobicContact CB-CB 4.09Å; I508-C514 WeakPolarHBondContact O-CA 3.39Å
515	R	83.1	Confident	80.5	Confident	5 Å²	5	35.9 Å²	35.9	2%	0.019	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.1	-178.5	-66.5	-172.5	-178.9	166.4	2	111.6	L422 L494 D507 I508 Y510 F513 A517 L547	L422-R515 PolarHBondContact O-NH1 3.31Å; L422-R515 PolarHBondContact O-NH2 3.48Å; L494-R515 HydrophobicContact CD2-CG 4.01Å; D507-R515 CarbonylContact C-O 3.56Å; D507-R515 WeakPolarHBondContact CA-O 3.15Å; I508-R515 PolarHBondContact N-O 2.91Å; I508-R515 PolarHBondContact O-N 3.26Å; Y510-R515 VanDerWaalsContact CD1-NH1 3.28Å; F513-R515 HydrophobicContact CB-CG 4.48Å; F513-R515 PolarHBondContact O-N 3.42Å; R515-A517 PolarHBondContact O-N 3.3Å; R515-L547 HydrophobicContact CB-CD2 3.63Å; R515-L547 HydrophobicContact CG-CD2 4.49Å
516	T	83.6	Confident	79.6	Confident	36 Å²	36	41.4 Å²	41.4	22%	0.221	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	126.1	178.2	-44.6	0	0	0	0	110.2	R466 D507 S548	R466-T516 PolarHBondContact NH2-OG1 3.04Å; D507-T516 VanDerWaalsContact OD1-CA 3.29Å; D507-T516 WeakPolarHBondContact OD1-CA 2.93Å; D507-T516 PolarHBondContact OD1-N 3.23Å; T516-S548 WeakPolarHBondContact O-CB 2.98Å; T516-S548 PolarHBondContact O-N 2.03Å
517	A	82	Confident	78.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	157.4	178	0	0	0	0	0	111.4	Q506 I508 R515 W545 K546	Q506-A517 PolarHBondContact O-N 2.91Å; I508-A517 HydrophobicContact CB-CB 4.23Å; I508-A517 HydrophobicContact CD1-CB 3.6Å; I508-A517 HydrophobicContact CG1-CB 3.64Å; I508-A517 HydrophobicContact CG2-CB 3.75Å; R515-A517 PolarHBondContact O-N 3.3Å; A517-W545 HydrophobicContact CB-CB 4.05Å; A517-W545 HydrophobicContact CB-CE3 4.02Å; A517-K546 CarbonylContact C-O 3.5Å; A517-K546 VanDerWaalsContact CA-O 3.24Å; A517-K546 WeakPolarHBondContact CA-O 3.41Å; A517-K546 VanDerWaalsContact CB-O 3.23Å; A517-K546 WeakPolarHBondContact CB-O 3.43Å
518	E	79.1	Confident	76.9	Confident	38 Å²	38	49.1 Å²	49.1	18%	0.178	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	144.1	174.4	66	-178.6	-173	0	0	110.2	S520 W545 K546	E518-S520 PolarHBondContact O-N 3.02Å; E518-W545 WeakPolarHBondContact O-CA 3.3Å; E518-K546 HydrophobicContact CG-CD 4.35Å; E518-K546 HydrophobicContact CG-CG 3.69Å; E518-K546 PolarHBondContact N-O 3.09Å; E518-K546 PolarHBondContact O-N 3.02Å; E518-K546 WeakPolarHBondContact OE1-CE 3.4Å; E518-K546 IonicContact OE1-NZ 2.87Å; E518-K546 PolarHBondContact OE1-NZ 2.88Å
519	P	85	Confident	75.7	Confident	70 Å²	70	50.7 Å²	50.7	46%	0.455	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	126.9	176.1	27.3	-33.1	0	0	0	109.7	I543 C544	P519-I543 HydrophobicContact CB-CG2 3.66Å; P519-C544 CarbonylContact C-O 3.53Å; P519-C544 WeakPolarHBondContact CA-O 3.28Å
520	S	77.8	Confident	74.9	Confident	31 Å²	31	54 Å²	54	22%	0.217	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-11.6	172	64.6	0	0	0	0	112.3	E518 E537 C544	E518-S520 PolarHBondContact O-N 3.02Å; S520-E537 VanDerWaalsContact CB-CD 3.45Å; S520-E537 WeakPolarHBondContact CB-OE1 3.02Å; S520-E537 WeakPolarHBondContact CB-OE2 3.3Å; S520-E537 VanDerWaalsContact OG-CD 3.26Å; S520-E537 PolarHBondContact OG-OE1 2.92Å; S520-E537 PolarHBondContact OG-OE2 3.35Å; S520-C544 PolarHBondContact N-O 3.26Å; S520-C544 WeakPolarHBondContact OG-CB 2.98Å; S520-C544 PolarHBondContact OG-O 3.15Å; S520-C544 VanDerWaalsContact OG-O 3.12Å
521	G	69	Low	74.3	Confident	64 Å²	64	62 Å²	62	66%	0.66	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	89.4	1.1	169.7	0	0	0	0	0	115.2
522	T	72.1	Confident	74.4	Confident	54 Å²	54	63.9 Å²	63.9	33%	0.331	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	131	169.9	44.8	0	0	0	0	110	C524 C544	T522-C524 PolarHBondContact O-N 2.67Å; T522-C544 PolarHBondContact O-N 3.08Å; T522-C544 WeakPolarHBondContact OG1-CB 3.24Å; T522-C544 PolarHBondContact OG1-SG 3.15Å
523	D	80.4	Confident	74.2	Confident	117 Å²	117	63.7 Å²	63.7	63%	0.626	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	124	172	-168.1	-25.6	0	0	0	108	Q532 N542	D523-Q532 PolarHBondContact O-OE1 2.91Å; D523-N542 WeakPolarHBondContact CA-O 3.03Å
524	C	79.8	Confident	74	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.376	C	S	.	.			trans	-102.5	99.5	169.5	50	0	0	0	0	106.5	T522 Q532 C539 N542 I543	T522-C524 PolarHBondContact O-N 2.67Å; C524-Q532 VanDerWaalsContact CA-OE1 3.27Å; C524-Q532 HydrophobicContact CB-CB 4.27Å; C524-C539 HydrophobicContact CB-CB 3.64Å; C524-C539 WeakPolarHBondContact CB-SG 3.03Å; C524-C539 PolarHBondContact O-SG 3.31Å; C524-C539 WeakPolarHBondContact SG-CA 3.03Å; C524-C539 WeakPolarHBondContact SG-CB 3.5Å; C524-C539 CovalentContact SG-SG 2.01Å; C524-C539 PolarHBondContact SG-SG 2.79Å; C524-N542 PolarHBondContact N-O 3.4Å; C524-N542 VanDerWaalsContact N-O 3.15Å; C524-N542 VanDerWaalsContact O-CA 3.23Å; C524-N542 WeakPolarHBondContact O-CA 3.48Å; C524-I543 PolarHBondContact SG-N 3.1Å; C524-I543 PolarHBondContact SG-O 3.17Å; C524-I543 VanDerWaalsContact SG-O 3.34Å
525	G	66.3	Low	73.3	Confident	23 Å²	23	76 Å²	76	24%	0.237	42%	0.416	C	S	.	.			trans	-56	159.1	-172.3	0	0	0	0	0	112.9	E527 E528	G525-E527 PolarHBondContact O-N 3.42Å; G525-E528 PolarHBondContact O-N 3.24Å
526	F	62.4	Low	72.6	Confident	181 Å²	181	81.4 Å²	81.4	79%	0.794	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-22.1	-176.1	-69.8	-87.8	0	0	0	115.2	N542	F526-N542 WeakPolarHBondContact CE1-ND2 3.32Å; F526-N542 WeakPolarHBondContact CZ-ND2 3.32Å
527	E	57.2	Low	72.5	Confident	190 Å²	190	80.9 Å²	80.9	89%	0.888	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-16.4	-167.1	-61.1	-171	167.7	0	0	114.4	G525	G525-E527 PolarHBondContact O-N 3.42Å
528	E	53.7	Low	72.4	Confident	120 Å²	120	82.4 Å²	82.4	56%	0.561	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	8.9	-170.2	-68.1	-176.5	179.1	0	0	114.6	G525 E531 Q532	G525-E528 PolarHBondContact O-N 3.24Å; E528-E531 PolarHBondContact O-N 2.87Å; E528-Q532 HydrophobicContact CB-CG 3.73Å; E528-Q532 PolarHBondContact OE2-NE2 2.02Å
529	G	61.7	Low	72.7	Confident	33 Å²	33	81.6 Å²	81.6	34%	0.34	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	53.4	-144.7	161.8	0	0	0	0	0	115.7	E531	G529-E531 PolarHBondContact O-N 3.44Å
530	D	67.9	Low	72.6	Confident	82 Å²	82	79.2 Å²	79.2	44%	0.439	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-67.2	-17.3	-176.9	-64.7	-22.5	0	0	0	113.6	Q532 C533 C539	D530-Q532 PolarHBondContact O-N 3.43Å; D530-C533 WeakPolarHBondContact O-CB 3.21Å; D530-C533 PolarHBondContact O-N 3.36Å; D530-C539 VanDerWaalsContact OD1-CB 3.29Å; D530-C539 WeakPolarHBondContact OD1-CB 3.39Å; D530-C539 PolarHBondContact OD1-N 2.76Å
531	E	70.7	Confident	72.7	Confident	185 Å²	185	84.2 Å²	84.2	86%	0.864	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-68.9	-22.9	-175.3	-61.7	-172	173.9	0	0	113.1	E528 G529 C533	E528-E531 PolarHBondContact O-N 2.87Å; G529-E531 PolarHBondContact O-N 3.44Å; E531-C533 VanDerWaalsContact C-N 3.28Å
532	Q	75.7	Confident	73.4	Confident	78 Å²	78	83.5 Å²	83.5	36%	0.364	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-79.7	-13.2	174.2	-64.4	-167.4	-15.7	0	0	113.1	D523 C524 E528 D530	D523-Q532 PolarHBondContact O-OE1 2.91Å; C524-Q532 VanDerWaalsContact CA-OE1 3.27Å; C524-Q532 HydrophobicContact CB-CB 4.27Å; E528-Q532 HydrophobicContact CB-CG 3.73Å; E528-Q532 PolarHBondContact OE2-NE2 2.02Å; D530-Q532 PolarHBondContact O-N 3.43Å
533	C	79.8	Confident	74.1	Confident	14 Å²	14	84.2 Å²	84.2	10%	0.095	42%	0.424	C	S	.	.	S	Bend	trans	-86.4	153.2	179	-58.1	0	0	0	0	110.8	D530 E531 E537 C544	D530-C533 WeakPolarHBondContact O-CB 3.21Å; D530-C533 PolarHBondContact O-N 3.36Å; E531-C533 VanDerWaalsContact C-N 3.28Å; C533-E537 HydrophobicContact CB-CB 3.68Å; C533-C544 WeakPolarHBondContact CA-SG 2.92Å; C533-C544 HydrophobicContact CB-CB 3.75Å; C533-C544 WeakPolarHBondContact CB-SG 3.23Å; C533-C544 WeakPolarHBondContact SG-CA 3.26Å; C533-C544 WeakPolarHBondContact SG-CB 2.95Å; C533-C544 CovalentContact SG-SG 2.04Å; C533-C544 PolarHBondContact SG-SG 2.87Å
534	K	79.1	Confident	74.4	Confident	136 Å²	136	78.6 Å²	78.6	59%	0.591	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-64.6	161.7	177.4	-61.7	173.1	-174.9	164.8	0	110	K536 E537	K534-K536 PolarHBondContact O-N 2.61Å; K534-E537 HydrophobicContact CB-CG 3.98Å; K534-E537 PolarHBondContact N-OE2 2.9Å; K534-E537 VanDerWaalsContact O-CB 3.28Å; K534-E537 WeakPolarHBondContact O-CB 3.16Å; K534-E537 PolarHBondContact O-N 2.7Å
535	T	72	Confident	74.6	Confident	139 Å²	139	79.7 Å²	79.7	85%	0.853	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	129.2	174.9	-44	0	0	0	0	110.8	E537	T535-E537 VanDerWaalsContact C-N 3.34Å
536	K	68.8	Low	75.4	Confident	119 Å²	119	81 Å²	81	52%	0.517	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	9.2	-173.2	-52.3	-171.7	176.3	-169.7	0	116.4	E423 K534	E423-K536 IonicContact OE2-NZ 3.52Å; E423-K536 PolarHBondContact OE2-NZ 2.77Å; K534-K536 PolarHBondContact O-N 2.61Å
537	E	82.2	Confident	76.1	Confident	25 Å²	25	73.9 Å²	73.9	12%	0.117	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	157.3	169	-55	-169.6	168.6	0	0	110.8	S520 C533 K534 T535 W545 K546	S520-E537 VanDerWaalsContact CB-CD 3.45Å; S520-E537 WeakPolarHBondContact CB-OE1 3.02Å; S520-E537 WeakPolarHBondContact CB-OE2 3.3Å; S520-E537 VanDerWaalsContact OG-CD 3.26Å; S520-E537 PolarHBondContact OG-OE1 2.92Å; S520-E537 PolarHBondContact OG-OE2 3.35Å; C533-E537 HydrophobicContact CB-CB 3.68Å; K534-E537 HydrophobicContact CB-CG 3.98Å; K534-E537 PolarHBondContact N-OE2 2.9Å; K534-E537 VanDerWaalsContact O-CB 3.28Å; K534-E537 WeakPolarHBondContact O-CB 3.16Å; K534-E537 PolarHBondContact O-N 2.7Å; T535-E537 VanDerWaalsContact C-N 3.34Å; E537-W545 CarbonylContact C-O 3.51Å; E537-W545 VanDerWaalsContact CA-O 3.26Å; E537-W545 WeakPolarHBondContact CA-O 3.45Å; E537-K546 HydrophobicContact CG-CB 3.98Å
538	M	80.4	Confident	76.8	Confident	32 Å²	32	65.4 Å²	65.4	16%	0.158	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.1	-176.5	-67.2	171.2	171	0	0	111.1	I508 C509 Y510 C544 W545	I508-M538 HydrophobicContact CD1-CB 4.3Å; I508-M538 HydrophobicContact CD1-SD 4.02Å; C509-M538 VanDerWaalsContact O-SD 3.39Å; Y510-M538 HydrophobicContact CD2-CE 3.36Å; Y510-M538 HydrophobicContact CD2-SD 3.62Å; Y510-M538 HydrophobicContact CE2-CE 3.79Å; Y510-M538 HydrophobicContact CE2-SD 4.44Å; Y510-M538 HydrophobicContact CG-CE 4.1Å; Y510-M538 HydrophobicContact CG-SD 4.35Å; M538-C544 CarbonylContact O-C 3.57Å; M538-W545 PolarHBondContact N-O 2.71Å; M538-W545 PolarHBondContact O-N 2.75Å
539	C	84.9	Confident	77.2	Confident	20 Å²	20	61.9 Å²	61.9	14%	0.135	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	119.5	-178.4	-173.6	0	0	0	0	111.5	H500 C524 D530	H500-C539 PolarHBondContact CD2-O 2.8Å; C524-C539 HydrophobicContact CB-CB 3.64Å; C524-C539 WeakPolarHBondContact CB-SG 3.03Å; C524-C539 PolarHBondContact O-SG 3.31Å; C524-C539 WeakPolarHBondContact SG-CA 3.03Å; C524-C539 WeakPolarHBondContact SG-CB 3.5Å; C524-C539 CovalentContact SG-SG 2.01Å; C524-C539 PolarHBondContact SG-SG 2.79Å; D530-C539 VanDerWaalsContact OD1-CB 3.29Å; D530-C539 WeakPolarHBondContact OD1-CB 3.39Å; D530-C539 PolarHBondContact OD1-N 2.76Å
540	R	81.9	Confident	77.1	Confident	21 Å²	21	65.2 Å²	65.2	8%	0.079	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	128.5	171.6	-176.6	-175	-177.7	-131	3.5	109.9	H500 C503 G505 D507 I508 N542 I543 W545	H500-R540 HydrophobicContact CB-CB 4.26Å; H500-R540 HydrophobicContact CB-CG 3.88Å; H500-R540 PolarHBondContact O-NE 2.73Å; C503-R540 PolarHBondContact O-NH2 2.76Å; G505-R540 PolarHBondContact O-NH1 3.49Å; G505-R540 PolarHBondContact O-NH2 3.4Å; D507-R540 PolarHBondContact O-NE 2.9Å; D507-R540 PolarHBondContact O-NH1 3.46Å; D507-R540 PolarHBondContact O-NH2 3.46Å; I508-R540 HydrophobicContact CG2-CB 4.32Å; R540-N542 VanDerWaalsContact C-N 3.25Å; R540-N542 PolarHBondContact O-N 3.16Å; R540-I543 PolarHBondContact N-O 2.71Å; R540-I543 PolarHBondContact O-N 2.96Å; R540-I543 VanDerWaalsContact O-O 3.11Å; R540-W545 HydrophobicContact CB-CG 4.41Å; R540-W545 PolarHBondContact O-NE1 3.41Å
541	H	81.5	Confident	76.8	Confident	136 Å²	136	67.2 Å²	67.2	63%	0.63	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	40.6	-175.7	-52	129.4	0	0	0	113.3	I543	H541-I543 PolarHBondContact O-N 3.4Å
542	N	83.7	Confident	77	Confident	49 Å²	49	64.5 Å²	64.5	26%	0.262	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	21.8	-178.8	-46.9	-33.8	0	0	0	115	D523 C524 F526 R540	D523-N542 WeakPolarHBondContact CA-O 3.03Å; C524-N542 PolarHBondContact N-O 3.4Å; C524-N542 VanDerWaalsContact N-O 3.15Å; C524-N542 VanDerWaalsContact O-CA 3.23Å; C524-N542 WeakPolarHBondContact O-CA 3.48Å; F526-N542 WeakPolarHBondContact CE1-ND2 3.32Å; F526-N542 WeakPolarHBondContact CZ-ND2 3.32Å; R540-N542 VanDerWaalsContact C-N 3.25Å; R540-N542 PolarHBondContact O-N 3.16Å
543	I	85.1	Confident	77.4	Confident	68 Å²	68	61.1 Å²	61.1	35%	0.349	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	137.8	174.2	-58.9	169.1	0	0	0	106.1	P519 C524 R540 H541 W545	P519-I543 HydrophobicContact CB-CG2 3.66Å; C524-I543 PolarHBondContact SG-N 3.1Å; C524-I543 PolarHBondContact SG-O 3.17Å; C524-I543 VanDerWaalsContact SG-O 3.34Å; R540-I543 PolarHBondContact N-O 2.71Å; R540-I543 PolarHBondContact O-N 2.96Å; R540-I543 VanDerWaalsContact O-O 3.11Å; H541-I543 PolarHBondContact O-N 3.4Å; I543-W545 PolarHBondContact O-NE1 2.72Å
544	C	86.8	Confident	77.6	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.6	169.1	-66.4	0	0	0	0	109.6	P519 S520 T522 C533 M538	P519-C544 CarbonylContact C-O 3.53Å; P519-C544 WeakPolarHBondContact CA-O 3.28Å; S520-C544 PolarHBondContact N-O 3.26Å; S520-C544 WeakPolarHBondContact OG-CB 2.98Å; S520-C544 PolarHBondContact OG-O 3.15Å; S520-C544 VanDerWaalsContact OG-O 3.12Å; T522-C544 PolarHBondContact O-N 3.08Å; T522-C544 WeakPolarHBondContact OG1-CB 3.24Å; T522-C544 PolarHBondContact OG1-SG 3.15Å; C533-C544 WeakPolarHBondContact CA-SG 2.92Å; C533-C544 HydrophobicContact CB-CB 3.75Å; C533-C544 WeakPolarHBondContact CB-SG 3.23Å; C533-C544 WeakPolarHBondContact SG-CA 3.26Å; C533-C544 WeakPolarHBondContact SG-CB 2.95Å; C533-C544 CovalentContact SG-SG 2.04Å; C533-C544 PolarHBondContact SG-SG 2.87Å; M538-C544 CarbonylContact O-C 3.57Å
545	W	85.1	Confident	77.8	Confident	23 Å²	23	69 Å²	69	9%	0.087	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	135.9	178.5	-64	76	0	0	0	108.7	Q506 I508 A517 E518 E537 M538 R540 I543	Q506-W545 HydrophobicContact CB-CZ3 4.17Å; Q506-W545 HydrophobicContact CG-CZ3 4.33Å; I508-W545 HydrophobicContact CD1-CB 4.29Å; I508-W545 HydrophobicContact CG2-CB 3.71Å; I508-W545 HydrophobicContact CG2-CD2 4.29Å; I508-W545 HydrophobicContact CG2-CG 3.89Å; A517-W545 HydrophobicContact CB-CB 4.05Å; A517-W545 HydrophobicContact CB-CE3 4.02Å; E518-W545 WeakPolarHBondContact O-CA 3.3Å; E537-W545 CarbonylContact C-O 3.51Å; E537-W545 VanDerWaalsContact CA-O 3.26Å; E537-W545 WeakPolarHBondContact CA-O 3.45Å; M538-W545 PolarHBondContact N-O 2.71Å; M538-W545 PolarHBondContact O-N 2.75Å; R540-W545 HydrophobicContact CB-CG 4.41Å; R540-W545 PolarHBondContact O-NE1 3.41Å; I543-W545 PolarHBondContact O-NE1 2.72Å
546	K	81.9	Confident	78.2	Confident	51 Å²	51	65.1 Å²	65.1	22%	0.222	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	149	168.2	59.7	-176.4	171.7	134.2	0	108.7	A517 E518 E537 S548	A517-K546 CarbonylContact C-O 3.5Å; A517-K546 VanDerWaalsContact CA-O 3.24Å; A517-K546 WeakPolarHBondContact CA-O 3.41Å; A517-K546 VanDerWaalsContact CB-O 3.23Å; A517-K546 WeakPolarHBondContact CB-O 3.43Å; E518-K546 HydrophobicContact CG-CD 4.35Å; E518-K546 HydrophobicContact CG-CG 3.69Å; E518-K546 PolarHBondContact N-O 3.09Å; E518-K546 PolarHBondContact O-N 3.02Å; E518-K546 WeakPolarHBondContact OE1-CE 3.4Å; E518-K546 IonicContact OE1-NZ 2.87Å; E518-K546 PolarHBondContact OE1-NZ 2.88Å; E537-K546 HydrophobicContact CG-CB 3.98Å; K546-S548 PolarHBondContact O-N 3.09Å
547	L	77.9	Confident	78.9	Confident	31 Å²	31	64.9 Å²	64.9	16%	0.162	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	136.8	170.4	-73	177.4	0	0	0	109.5	I508 Y510 R515 T549	I508-L547 HydrophobicContact CD1-CD2 4.29Å; I508-L547 HydrophobicContact CG1-CD2 4.42Å; Y510-L547 HydrophobicContact CD1-CD1 3.69Å; Y510-L547 HydrophobicContact CD1-CD2 4.37Å; Y510-L547 HydrophobicContact CD1-CG 4.38Å; Y510-L547 HydrophobicContact CD2-CD1 3.87Å; Y510-L547 HydrophobicContact CD2-CD2 4.1Å; Y510-L547 HydrophobicContact CD2-CG 3.85Å; Y510-L547 HydrophobicContact CE1-CD1 3.59Å; Y510-L547 HydrophobicContact CE2-CD1 3.8Å; Y510-L547 HydrophobicContact CE2-CG 4.09Å; Y510-L547 HydrophobicContact CG-CD1 3.81Å; Y510-L547 HydrophobicContact CG-CD2 3.86Å; Y510-L547 HydrophobicContact CG-CG 4Å; R515-L547 HydrophobicContact CB-CD2 3.63Å; R515-L547 HydrophobicContact CG-CD2 4.49Å; L547-T549 PolarHBondContact O-N 3.44Å
548	S	71.8	Confident	78.7	Confident	12 Å²	12	65.4 Å²	65.4	8%	0.084	31%	0.312	C	S	.	.			trans	-75.7	71.6	-169.7	-166.8	0	0	0	0	111.5	T516 K546 R550 D560	T516-S548 WeakPolarHBondContact O-CB 2.98Å; T516-S548 PolarHBondContact O-N 2.03Å; K546-S548 PolarHBondContact O-N 3.09Å; S548-R550 PolarHBondContact O-N 2.84Å; S548-D560 WeakPolarHBondContact O-CB 3.4Å
549	T	63	Low	78.6	Confident	45 Å²	45	64.4 Å²	64.4	28%	0.276	31%	0.308	S	S	.	.			trans	-91.3	42.3	172.9	64.9	0	0	0	0	109.9	L547 Q551 C570	L547-T549 PolarHBondContact O-N 3.44Å; T549-Q551 WeakPolarHBondContact O-CA 3.43Å; T549-Q551 PolarHBondContact O-N 2.04Å; T549-C570 WeakPolarHBondContact O-CB 3.32Å
550	R	57.8	Low	78.2	Confident	103 Å²	103	64.1 Å²	64.1	39%	0.389	31%	0.305	S	S	.	.			trans	-24	100.5	-160.8	-72	-154	-163.7	146.4	2.6	111.4	S548 L552 D558 C570	S548-R550 PolarHBondContact O-N 2.84Å; R550-L552 CarbonylContact O-C 3.55Å; R550-L552 PolarHBondContact O-N 3.24Å; R550-D558 WeakPolarHBondContact CB-O 3.09Å; R550-D558 WeakPolarHBondContact CD-O 3.34Å; R550-D558 WeakPolarHBondContact CG-O 3.18Å; R550-D558 PolarHBondContact NE-O 3.22Å; R550-D558 VanDerWaalsContact NH1-CA 3.29Å; R550-D558 PolarHBondContact NH1-O 3.2Å; R550-D558 IonicContact NH1-OD1 2.71Å; R550-D558 PolarHBondContact NH1-OD1 3.03Å; R550-C570 VanDerWaalsContact O-CB 3.24Å; R550-C570 WeakPolarHBondContact O-CB 3.27Å; R550-C570 PolarHBondContact O-N 3.05Å; R550-C570 PolarHBondContact O-SG 3.47Å
551	Q	61.7	Low	78	Confident	125 Å²	125	63.8 Å²	63.8	58%	0.584	31%	0.305	S	S	*	.	S	Bend	trans	-61.3	-20.6	-169.5	-75.8	-157.3	-10.9	0	0	112.1	T549 H569	T549-Q551 WeakPolarHBondContact O-CA 3.43Å; T549-Q551 PolarHBondContact O-N 2.04Å; Q551-H569 VanDerWaalsContact O-CA 3.29Å; Q551-H569 WeakPolarHBondContact O-CA 2.93Å; Q551-H569 PolarHBondContact O-CD2 3.02Å
552	L	74.8	Confident	78	Confident	128 Å²	128	57.5 Å²	57.5	67%	0.67	28%	0.275	S	S	*	.	S	Bend	trans	-116.7	126.3	169.4	-70	163.2	0	0	0	110.6	R550 K568	R550-L552 CarbonylContact O-C 3.55Å; R550-L552 PolarHBondContact O-N 3.24Å; L552-K568 CarbonylContact C-O 3.52Å; L552-K568 WeakPolarHBondContact CA-O 3.39Å; L552-K568 HydrophobicContact CD2-CB 4.42Å
553	C	84.1	Confident	77.8	Confident	6 Å²	6	55.2 Å²	55.2	4%	0.041	26%	0.263	C	S	.	.			trans	-131.3	154.1	178	64	0	0	0	0	110.5	D558 C565 K568 H569	C553-D558 HydrophobicContact CB-CB 3.79Å; C553-C565 HydrophobicContact CB-CB 3.63Å; C553-C565 WeakPolarHBondContact CB-SG 3.36Å; C553-C565 WeakPolarHBondContact SG-CA 3.29Å; C553-C565 WeakPolarHBondContact SG-CB 3.4Å; C553-C565 CovalentContact SG-SG 2.02Å; C553-C565 PolarHBondContact SG-SG 3.15Å; C553-K568 PolarHBondContact N-O 2.82Å; C553-K568 WeakPolarHBondContact O-CA 3.02Å; C553-H569 PolarHBondContact SG-N 2.92Å; C553-H569 VanDerWaalsContact SG-N 3.36Å; C553-H569 PolarHBondContact SG-O 3.35Å
554	R	84.8	Confident	77.5	Confident	237 Å²	237	52.1 Å²	52.1	89%	0.894	25%	0.247	S	C	*	.	S	Bend	trans	-106.8	-31	170.7	-60.5	179.7	177.2	177.4	0.1	111.2	D558	R554-D558 WeakPolarHBondContact CA-OD2 3.45Å; R554-D558 WeakPolarHBondContact CB-OD2 3.44Å; R554-D558 PolarHBondContact N-OD2 3.43Å
555	N	84	Confident	77.3	Confident	80 Å²	80	53.2 Å²	53.2	43%	0.428	26%	0.255	S	S	.	.	S	Bend	trans	-150.8	173.2	176	58.8	43.8	0	0	0	109.6	D557 D558 C565	N555-D557 PolarHBondContact O-N 2.79Å; N555-D557 WeakPolarHBondContact OD1-CB 3.34Å; N555-D557 PolarHBondContact OD1-N 2.89Å; N555-D557 VanDerWaalsContact OD1-N 3.14Å; N555-D558 PolarHBondContact N-OD2 2.76Å; N555-D558 WeakPolarHBondContact O-CB 3.44Å; N555-D558 PolarHBondContact O-N 2.93Å; N555-D558 PolarHBondContact OD1-N 2.8Å; N555-C565 VanDerWaalsContact O-CB 3.26Å; N555-C565 WeakPolarHBondContact O-CB 3.02Å
556	D	80.5	Confident	77.1	Confident	57 Å²	57	53.3 Å²	53.3	31%	0.305	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-65.3	-24.2	-175.8	-55.2	-31.5	0	0	0	113.6	D558 C559 C565 Y593	D556-D558 PolarHBondContact O-N 3.3Å; D556-C559 WeakPolarHBondContact O-CB 3.36Å; D556-C559 PolarHBondContact O-N 3.17Å; D556-C565 WeakPolarHBondContact OD1-CB 3.3Å; D556-C565 PolarHBondContact OD1-N 3.46Å; D556-Y593 HydrophobicContact CB-CD2 3.77Å; D556-Y593 HydrophobicContact CB-CE2 3.32Å; D556-Y593 PolarHBondContact O-OH 2.89Å
557	D	82	Confident	77.1	Confident	114 Å²	114	57.2 Å²	57.2	61%	0.61	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-68.5	-15	175.5	-66.7	-43.2	0	0	0	112.1	N555 C559	N555-D557 PolarHBondContact O-N 2.79Å; N555-D557 WeakPolarHBondContact OD1-CB 3.34Å; N555-D557 PolarHBondContact OD1-N 2.89Å; N555-D557 VanDerWaalsContact OD1-N 3.14Å; D557-C559 VanDerWaalsContact C-N 3.27Å
558	D	78.7	Confident	77.3	Confident	35 Å²	35	62.9 Å²	62.9	19%	0.187	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-77.1	-14.3	171.1	-67.1	-42.4	0	0	0	112.8	R550 C553 R554 N555 D556	R550-D558 WeakPolarHBondContact CB-O 3.09Å; R550-D558 WeakPolarHBondContact CD-O 3.34Å; R550-D558 WeakPolarHBondContact CG-O 3.18Å; R550-D558 PolarHBondContact NE-O 3.22Å; R550-D558 VanDerWaalsContact NH1-CA 3.29Å; R550-D558 PolarHBondContact NH1-O 3.2Å; R550-D558 IonicContact NH1-OD1 2.71Å; R550-D558 PolarHBondContact NH1-OD1 3.03Å; C553-D558 HydrophobicContact CB-CB 3.79Å; R554-D558 WeakPolarHBondContact CA-OD2 3.45Å; R554-D558 WeakPolarHBondContact CB-OD2 3.44Å; R554-D558 PolarHBondContact N-OD2 3.43Å; N555-D558 PolarHBondContact N-OD2 2.76Å; N555-D558 WeakPolarHBondContact O-CB 3.44Å; N555-D558 PolarHBondContact O-N 2.93Å; N555-D558 PolarHBondContact OD1-N 2.8Å; D556-D558 PolarHBondContact O-N 3.3Å
559	C	78.1	Confident	77.8	Confident	11 Å²	11	66.9 Å²	66.9	7%	0.074	32%	0.32	C	S	.	.	S	Bend	trans	-96.4	162	-177.2	-59.1	0	0	0	0	112.6	D556 D557 S563 C565 C570	D556-C559 WeakPolarHBondContact O-CB 3.36Å; D556-C559 PolarHBondContact O-N 3.17Å; D557-C559 VanDerWaalsContact C-N 3.27Å; C559-S563 VanDerWaalsContact CB-O 3.3Å; C559-S563 WeakPolarHBondContact CB-O 3.28Å; C559-C565 PolarHBondContact SG-N 3.35Å; C559-C570 WeakPolarHBondContact CA-SG 2.98Å; C559-C570 HydrophobicContact CB-CB 3.76Å; C559-C570 WeakPolarHBondContact CB-SG 3.27Å; C559-C570 WeakPolarHBondContact SG-CA 3.4Å; C559-C570 WeakPolarHBondContact SG-CB 3.38Å; C559-C570 CovalentContact SG-SG 2.03Å; C559-C570 PolarHBondContact SG-SG 3.03Å
560	D	77.4	Confident	78.6	Confident	15 Å²	15	65.5 Å²	65.5	8%	0.08	31%	0.312	C	S	.	.			trans	-62.4	170.7	169.9	64.9	40.8	0	0	0	112.1	S548 Y562 S563	S548-D560 WeakPolarHBondContact O-CB 3.4Å; D560-Y562 PolarHBondContact O-N 2.72Å; D560-Y562 WeakPolarHBondContact OD1-CA 3.29Å; D560-Y562 PolarHBondContact OD1-N 2.71Å; D560-S563 PolarHBondContact O-N 2.02Å; D560-S563 WeakPolarHBondContact OD1-CB 3.48Å; D560-S563 PolarHBondContact OD1-N 3.46Å; D560-S563 PolarHBondContact OD1-OG 2.8Å; D560-S563 PolarHBondContact OD2-OG 3.34Å
561	E	78.2	Confident	79.6	Confident	14 Å²	14	62.9 Å²	62.9	7%	0.065	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-10.7	-179.9	57.8	-101.3	-146.8	0	0	116.4	R466 P467	R466-E561 HydrophobicContact CG-CB 4.03Å; R466-E561 HydrophobicContact CG-CG 3.9Å; R466-E561 IonicContact CZ-OE1 2.9Å; R466-E561 IonicContact CZ-OE2 3.04Å; R466-E561 IonicContact NE-OE1 2.61Å; R466-E561 PolarHBondContact NE-OE1 3.43Å; R466-E561 IonicContact NE-OE2 3.84Å; R466-E561 IonicContact NH2-OE1 2.67Å; R466-E561 PolarHBondContact NH2-OE1 2.87Å; R466-E561 IonicContact NH2-OE2 2.62Å; R466-E561 PolarHBondContact NH2-OE2 3.27Å; P467-E561 HydrophobicContact CG-CB 4.5Å; P467-E561 WeakPolarHBondContact CG-O 3.12Å
562	Y	81.4	Confident	80.4	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.016	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	4.2	-177.7	-50.5	-68.1	0	0	0	112.8	L422 Y454 G465 W491 L494 D560 T572 L573 W598	L422-Y562 HydrophobicContact CD1-CD2 3.72Å; L422-Y562 HydrophobicContact CD1-CE1 4.39Å; L422-Y562 HydrophobicContact CD1-CE2 3.54Å; L422-Y562 HydrophobicContact CD1-CG 4.22Å; L422-Y562 HydrophobicContact CD2-CD2 3.48Å; L422-Y562 VanDerWaalsContact CD2-CD2 3.48Å; L422-Y562 HydrophobicContact CD2-CE2 4.08Å; L422-Y562 HydrophobicContact CD2-CG 4.03Å; L422-Y562 HydrophobicContact CG-CD2 4.25Å; L422-Y562 HydrophobicContact CG-CE2 4.42Å; Y454-Y562 AromaticContact CD1-CD1 3.57Å; Y454-Y562 HydrophobicContact CD1-CD1 3.57Å; Y454-Y562 AromaticContact CD1-CE1 3.97Å; Y454-Y562 HydrophobicContact CD1-CE1 3.97Å; Y454-Y562 HydrophobicContact CD1-CG 4.36Å; Y454-Y562 AromaticContact CE1-CD1 3.93Å; Y454-Y562 HydrophobicContact CE1-CD1 3.93Å; Y454-Y562 HydrophobicContact CE1-CG 4.35Å; Y454-Y562 HydrophobicContact CG-CD1 4.26Å; Y454-Y562 HydrophobicContact CG-CE1 4.3Å; G465-Y562 WeakPolarHBondContact O-CE1 3.04Å; G465-Y562 PolarHBondContact O-OH 3.42Å; W491-Y562 AromaticContact CZ3-CE1 3.99Å; W491-Y562 HydrophobicContact CZ3-CE1 3.99Å; L494-Y562 VanDerWaalsContact CD1-OH 3.23Å; L494-Y562 WeakPolarHBondContact CD1-OH 3.42Å; D560-Y562 PolarHBondContact O-N 2.72Å; D560-Y562 WeakPolarHBondContact OD1-CA 3.29Å; D560-Y562 PolarHBondContact OD1-N 2.71Å; Y562-T572 WeakPolarHBondContact O-CA 3.43Å; Y562-L573 PolarHBondContact O-N 3.04Å; Y562-W598 HydrophobicContact CD1-CH2 4.47Å
563	S	79.8	Confident	80.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	150.4	-172.5	-55.3	0	0	0	0	111.3	C559 D560 I571 T572 Y593	C559-S563 VanDerWaalsContact CB-O 3.3Å; C559-S563 WeakPolarHBondContact CB-O 3.28Å; D560-S563 PolarHBondContact O-N 2.02Å; D560-S563 WeakPolarHBondContact OD1-CB 3.48Å; D560-S563 PolarHBondContact OD1-N 3.46Å; D560-S563 PolarHBondContact OD1-OG 2.8Å; D560-S563 PolarHBondContact OD2-OG 3.34Å; S563-I571 CarbonylContact C-O 3.59Å; S563-I571 WeakPolarHBondContact CA-O 3.34Å; S563-I571 WeakPolarHBondContact CB-O 3.32Å; S563-T572 VanDerWaalsContact OG-CA 3.3Å; S563-T572 WeakPolarHBondContact OG-CA 3.4Å; S563-T572 PolarHBondContact OG-N 3.35Å; S563-T572 PolarHBondContact OG-OG1 3.19Å; S563-Y593 WeakPolarHBondContact O-CE1 2.99Å
564	I	78.5	Confident	80.6	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	159.9	173.8	64.8	162	0	0	0	110.8	C570 I571 L573 K591 Y593	I564-C570 CarbonylContact O-C 3.58Å; I564-C570 VanDerWaalsContact O-CA 3.3Å; I564-C570 WeakPolarHBondContact O-CA 3.46Å; I564-I571 PolarHBondContact N-O 3.08Å; I564-I571 PolarHBondContact O-N 3.24Å; I564-L573 HydrophobicContact CB-CD1 4.2Å; I564-L573 HydrophobicContact CD1-CD1 3.52Å; I564-L573 HydrophobicContact CD1-CD2 4.47Å; I564-L573 HydrophobicContact CD1-CG 4.35Å; I564-L573 HydrophobicContact CG1-CD1 3.49Å; I564-L573 VanDerWaalsContact CG1-CD1 3.49Å; I564-L573 HydrophobicContact CG1-CD2 4.24Å; I564-L573 HydrophobicContact CG1-CG 3.91Å; I564-L573 HydrophobicContact CG2-CD1 3.71Å; I564-L573 HydrophobicContact CG2-CG 4.46Å; I564-K591 HydrophobicContact CD1-CB 4.22Å; I564-K591 HydrophobicContact CD1-CD 3.2Å; I564-K591 HydrophobicContact CD1-CG 4.34Å; I564-Y593 HydrophobicContact CG2-CD1 3.57Å; I564-Y593 HydrophobicContact CG2-CD2 4.3Å; I564-Y593 HydrophobicContact CG2-CE1 4.24Å; I564-Y593 HydrophobicContact CG2-CG 3.59Å
565	C	82.5	Confident	80.6	Confident	23 Å²	23	46.5 Å²	46.5	16%	0.155	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	118.2	175.1	-173.8	0	0	0	0	111.4	C553 N555 D556 C559	C553-C565 HydrophobicContact CB-CB 3.63Å; C553-C565 WeakPolarHBondContact CB-SG 3.36Å; C553-C565 WeakPolarHBondContact SG-CA 3.29Å; C553-C565 WeakPolarHBondContact SG-CB 3.4Å; C553-C565 CovalentContact SG-SG 2.02Å; C553-C565 PolarHBondContact SG-SG 3.15Å; N555-C565 VanDerWaalsContact O-CB 3.26Å; N555-C565 WeakPolarHBondContact O-CB 3.02Å; D556-C565 WeakPolarHBondContact OD1-CB 3.3Å; D556-C565 PolarHBondContact OD1-N 3.46Å; C559-C565 PolarHBondContact SG-N 3.35Å
566	E	79.8	Confident	80.5	Confident	26 Å²	26	44.2 Å²	44.2	12%	0.121	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	130	178.9	-178	156.4	-134	0	0	111.2	K568 H569 I571 K591 R600	E566-K568 PolarHBondContact O-N 2.67Å; E566-K568 VanDerWaalsContact O-N 3.1Å; E566-H569 PolarHBondContact N-O 3.27Å; E566-H569 PolarHBondContact O-N 2.69Å; E566-I571 HydrophobicContact CB-CD1 3.73Å; E566-I571 HydrophobicContact CB-CG1 4.25Å; E566-I571 HydrophobicContact CG-CD1 4.04Å; E566-K591 VanDerWaalsContact OE1-CE 3.31Å; E566-K591 WeakPolarHBondContact OE1-CE 3.32Å; E566-K591 IonicContact OE1-NZ 3.97Å; E566-K591 PolarHBondContact OE1-NZ 3.1Å; E566-K591 IonicContact OE2-NZ 2.8Å; E566-R600 IonicContact OE1-CZ 3.02Å; E566-R600 IonicContact OE1-NE 2.67Å; E566-R600 IonicContact OE1-NH2 3.46Å; E566-R600 PolarHBondContact OE1-NH2 3.32Å; E566-R600 IonicContact OE2-CZ 2.69Å; E566-R600 IonicContact OE2-NE 3.21Å; E566-R600 PolarHBondContact OE2-NE 2.86Å; E566-R600 IonicContact OE2-NH2 3.07Å; E566-R600 PolarHBondContact OE2-NH2 3.43Å
567	D	82.3	Confident	80.2	Confident	133 Å²	133	46.7 Å²	46.7	71%	0.711	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.5	38.1	-174.1	-62.1	-36.9	0	0	0	113	H569	D567-H569 PolarHBondContact O-CE1 3.18Å; D567-H569 PolarHBondContact O-N 2.85Å; D567-H569 PolarHBondContact O-ND1 3.04Å
568	K	83.1	Confident	79.7	Confident	150 Å²	150	42.8 Å²	42.8	65%	0.652	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	16.2	-174.9	-53.3	175.8	-179.9	172.9	0	114.7	L552 C553 E566	L552-K568 CarbonylContact C-O 3.52Å; L552-K568 WeakPolarHBondContact CA-O 3.39Å; L552-K568 HydrophobicContact CD2-CB 4.42Å; C553-K568 PolarHBondContact N-O 2.82Å; C553-K568 WeakPolarHBondContact O-CA 3.02Å; E566-K568 PolarHBondContact O-N 2.67Å; E566-K568 VanDerWaalsContact O-N 3.1Å
569	H	81.4	Confident	79.8	Confident	96 Å²	96	44.6 Å²	44.6	44%	0.444	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141.8	175	-59.4	82.2	0	0	0	111	Q551 C553 E566 D567 I571	Q551-H569 VanDerWaalsContact O-CA 3.29Å; Q551-H569 WeakPolarHBondContact O-CA 2.93Å; Q551-H569 PolarHBondContact O-CD2 3.02Å; C553-H569 PolarHBondContact SG-N 2.92Å; C553-H569 VanDerWaalsContact SG-N 3.36Å; C553-H569 PolarHBondContact SG-O 3.35Å; E566-H569 PolarHBondContact N-O 3.27Å; E566-H569 PolarHBondContact O-N 2.69Å; D567-H569 PolarHBondContact O-CE1 3.18Å; D567-H569 PolarHBondContact O-N 2.85Å; D567-H569 PolarHBondContact O-ND1 3.04Å; H569-I571 PolarHBondContact O-N 3.13Å
570	C	80.3	Confident	80.3	Confident	15 Å²	15	44.4 Å²	44.4	10%	0.101	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	119.7	170.3	-67.7	0	0	0	0	110.2	T549 R550 C559 I564	T549-C570 WeakPolarHBondContact O-CB 3.32Å; R550-C570 VanDerWaalsContact O-CB 3.24Å; R550-C570 WeakPolarHBondContact O-CB 3.27Å; R550-C570 PolarHBondContact O-N 3.05Å; R550-C570 PolarHBondContact O-SG 3.47Å; C559-C570 WeakPolarHBondContact CA-SG 2.98Å; C559-C570 HydrophobicContact CB-CB 3.76Å; C559-C570 WeakPolarHBondContact CB-SG 3.27Å; C559-C570 WeakPolarHBondContact SG-CA 3.4Å; C559-C570 WeakPolarHBondContact SG-CB 3.38Å; C559-C570 CovalentContact SG-SG 2.03Å; C559-C570 PolarHBondContact SG-SG 3.03Å; I564-C570 CarbonylContact O-C 3.58Å; I564-C570 VanDerWaalsContact O-CA 3.3Å; I564-C570 WeakPolarHBondContact O-CA 3.46Å
571	I	78.1	Confident	80.8	Confident	49 Å²	49	47.5 Å²	47.5	25%	0.251	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	119.8	179.4	-52.2	-174.8	0	0	0	107.8	S563 I564 E566 H569 L573	S563-I571 CarbonylContact C-O 3.59Å; S563-I571 WeakPolarHBondContact CA-O 3.34Å; S563-I571 WeakPolarHBondContact CB-O 3.32Å; I564-I571 PolarHBondContact N-O 3.08Å; I564-I571 PolarHBondContact O-N 3.24Å; E566-I571 HydrophobicContact CB-CD1 3.73Å; E566-I571 HydrophobicContact CB-CG1 4.25Å; E566-I571 HydrophobicContact CG-CD1 4.04Å; H569-I571 PolarHBondContact O-N 3.13Å; I571-L573 HydrophobicContact CB-CD2 4.36Å; I571-L573 HydrophobicContact CG2-CD2 3.93Å; I571-L573 PolarHBondContact O-N 3.14Å
572	T	78.4	Confident	81.3	Confident	37 Å²	37	50.7 Å²	50.7	23%	0.227	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	128	173	-53.5	0	0	0	0	109.1	Y562 S563	Y562-T572 WeakPolarHBondContact O-CA 3.43Å; S563-T572 VanDerWaalsContact OG-CA 3.3Å; S563-T572 WeakPolarHBondContact OG-CA 3.4Å; S563-T572 PolarHBondContact OG-N 3.35Å; S563-T572 PolarHBondContact OG-OG1 3.19Å
573	L	80.9	Confident	81.5	Confident	2 Å²	2	55 Å²	55	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	153.6	-177	-56.1	-171.8	0	0	0	111.4	Y454 Y562 I564 I571 W598 D599 R600	Y454-L573 WeakPolarHBondContact CE1-O 2.94Å; Y454-L573 PolarHBondContact OH-O 3.3Å; Y562-L573 PolarHBondContact O-N 3.04Å; I564-L573 HydrophobicContact CB-CD1 4.2Å; I564-L573 HydrophobicContact CD1-CD1 3.52Å; I564-L573 HydrophobicContact CD1-CD2 4.47Å; I564-L573 HydrophobicContact CD1-CG 4.35Å; I564-L573 HydrophobicContact CG1-CD1 3.49Å; I564-L573 VanDerWaalsContact CG1-CD1 3.49Å; I564-L573 HydrophobicContact CG1-CD2 4.24Å; I564-L573 HydrophobicContact CG1-CG 3.91Å; I564-L573 HydrophobicContact CG2-CD1 3.71Å; I564-L573 HydrophobicContact CG2-CG 4.46Å; I571-L573 HydrophobicContact CB-CD2 4.36Å; I571-L573 HydrophobicContact CG2-CD2 3.93Å; I571-L573 PolarHBondContact O-N 3.14Å; L573-W598 HydrophobicContact CB-CB 3.6Å; L573-W598 HydrophobicContact CB-CD2 4.23Å; L573-W598 HydrophobicContact CB-CE3 3.85Å; L573-W598 HydrophobicContact CB-CG 4.18Å; L573-W598 HydrophobicContact CD1-CB 3.24Å; L573-W598 HydrophobicContact CD1-CG 4.01Å; L573-W598 HydrophobicContact CG-CB 4.09Å; L573-W598 WeakPolarHBondContact O-CZ3 3.18Å; L573-D599 WeakPolarHBondContact CA-O 3.32Å; L573-D599 WeakPolarHBondContact CB-O 3.18Å; L573-R600 HydrophobicContact CD2-CB 4.32Å; L573-R600 HydrophobicContact CD2-CG 3.81Å
574	R	83.3	Confident	81.9	Confident	105 Å²	105	58.4 Å²	58.4	40%	0.396	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.2	172.5	178.6	176.1	64.4	-170.5	-3.6	109.7	D453 W598 D599 V601	D453-R574 HydrophobicContact CB-CG 4.23Å; D453-R574 WeakPolarHBondContact OD2-CD 3.24Å; D453-R574 WeakPolarHBondContact OD2-CG 3.41Å; R574-W598 CarbonylContact O-C 3.45Å; R574-W598 WeakPolarHBondContact O-CA 3.37Å; R574-D599 IonicContact CZ-OD2 3.86Å; R574-D599 PolarHBondContact N-O 3.14Å; R574-D599 IonicContact NE-OD2 3.3Å; R574-D599 IonicContact NH2-OD2 3.72Å; R574-D599 PolarHBondContact NH2-OD2 3.46Å; R574-D599 PolarHBondContact O-N 3.15Å; R574-V601 HydrophobicContact CB-CG2 3.88Å
575	P	85	Confident	82.4	Confident	7 Å²	7	62.5 Å²	62.5	5%	0.045	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	141.5	174.7	29.8	-35.1	0	0	0	110.3	D453 Y454 F487 W491 I596 W598	D453-P575 HydrophobicContact CB-CG 4.19Å; D453-P575 VanDerWaalsContact O-CG 3.27Å; D453-P575 WeakPolarHBondContact O-CG 3.23Å; Y454-P575 HydrophobicContact CD1-CG 4.27Å; Y454-P575 HydrophobicContact CE1-CG 4.37Å; F487-P575 HydrophobicContact CD2-CB 3.95Å; F487-P575 HydrophobicContact CE2-CB 3.59Å; F487-P575 HydrophobicContact CE2-CG 3.76Å; F487-P575 HydrophobicContact CZ-CB 4.04Å; F487-P575 HydrophobicContact CZ-CG 4.18Å; W491-P575 HydrophobicContact CH2-CB 4.49Å; W491-P575 HydrophobicContact CH2-CG 4.22Å; W491-P575 HydrophobicContact CZ2-CB 4.39Å; P575-I596 HydrophobicContact CB-CG2 3.81Å; P575-W598 HydrophobicContact CB-CE3 3.99Å; P575-W598 HydrophobicContact CB-CH2 4.33Å; P575-W598 HydrophobicContact CB-CZ3 3.89Å; P575-W598 HydrophobicContact CG-CZ3 4.14Å
576	V	81.8	Confident	82.6	Confident	33 Å²	33	62.1 Å²	62.1	20%	0.2	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.6	179.8	-167.5	0	0	0	0	108.2	G578 C597 D599	V576-G578 PolarHBondContact O-N 3.48Å; V576-G578 VanDerWaalsContact O-N 3.15Å; V576-C597 HydrophobicContact CB-CB 4.39Å; V576-C597 PolarHBondContact N-O 2.9Å; V576-D599 HydrophobicContact CG2-CB 3.4Å
577	D	73.6	Confident	82.9	Confident	108 Å²	108	63.9 Å²	63.9	58%	0.578	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-49.6	121.8	175.6	-83.9	-23.2	0	0	0	111.8	F487	F487-D577 VanDerWaalsContact CE1-OD1 3.24Å; F487-D577 WeakPolarHBondContact CE1-OD1 3.37Å
578	G	70.9	Confident	82.9	Confident	32 Å²	32	67.5 Å²	67.5	33%	0.33	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.3	133.7	175.5	0	0	0	0	0	113.5	V576 C597	V576-G578 PolarHBondContact O-N 3.48Å; V576-G578 VanDerWaalsContact O-N 3.15Å; G578-C597 PolarHBondContact O-N 3.14Å
579	S	82	Confident	82.8	Confident	73 Å²	73	63.5 Å²	63.5	51%	0.51	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	146.8	162.2	59.7	0	0	0	0	109.7	F487 N595	F487-S579 WeakPolarHBondContact O-CA 3.18Å; S579-N595 CarbonylContact C-O 3.49Å; S579-N595 VanDerWaalsContact CA-O 3.24Å; S579-N595 WeakPolarHBondContact CA-O 3.34Å
580	C	88.5	Confident	83	Confident	8 Å²	8	60.7 Å²	60.7	5%	0.054	37%	0.374	C	S	.	.			trans	-135.8	155.1	178.1	62.3	0	0	0	0	111.4	D585 C586 C592 N595 I596	C580-D585 HydrophobicContact CB-CB 3.8Å; C580-C586 VanDerWaalsContact CB-SG 3.51Å; C580-C592 HydrophobicContact CB-CB 3.67Å; C580-C592 WeakPolarHBondContact CB-SG 3.33Å; C580-C592 WeakPolarHBondContact SG-CA 3.33Å; C580-C592 WeakPolarHBondContact SG-CB 3.43Å; C580-C592 CovalentContact SG-SG 2.02Å; C580-C592 PolarHBondContact SG-SG 2.68Å; C580-N595 PolarHBondContact N-O 2.04Å; C580-N595 WeakPolarHBondContact O-CA 2.96Å; C580-N595 VanDerWaalsContact O-CB 3.32Å; C580-N595 WeakPolarHBondContact O-CB 3.49Å; C580-I596 PolarHBondContact SG-N 3.48Å; C580-I596 PolarHBondContact SG-O 2.69Å
581	A	87.6	Confident	83.3	Confident	80 Å²	80	62.9 Å²	62.9	66%	0.661	38%	0.382	S	S	*	.	S	Bend	trans	-107.7	-28.6	165.3	0	0	0	0	0	111	D585	A581-D585 WeakPolarHBondContact CA-OD2 3.15Å; A581-D585 PolarHBondContact N-OD2 2.73Å
582	T	88.3	Confident	83.8	Confident	81 Å²	81	61.6 Å²	61.6	50%	0.497	38%	0.377	S	S	.	.	S	Bend	trans	-139.5	162.9	-179.2	71.8	0	0	0	0	110.6	G584 D585 C592	T582-G584 PolarHBondContact O-N 3.36Å; T582-G584 VanDerWaalsContact O-N 3.08Å; T582-G584 PolarHBondContact OG1-N 2.82Å; T582-D585 PolarHBondContact N-OD2 2.9Å; T582-D585 WeakPolarHBondContact O-CB 3.42Å; T582-D585 PolarHBondContact O-N 3.1Å; T582-D585 PolarHBondContact OG1-OD2 3.49Å; T582-C592 VanDerWaalsContact O-CB 3.3Å; T582-C592 WeakPolarHBondContact O-CB 3.38Å
583	N	86	Confident	84.1	Confident	95 Å²	95	60.7 Å²	60.7	51%	0.508	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-57.2	-23.9	174.3	-67.3	-18.9	0	0	0	113	D585 C586 C592	N583-D585 VanDerWaalsContact C-N 3.26Å; N583-D585 PolarHBondContact O-N 2.93Å; N583-C586 PolarHBondContact O-N 2.83Å; N583-C592 PolarHBondContact OD1-N 2.92Å
584	G	86.8	Confident	84.1	Confident	71 Å²	71	63.5 Å²	63.5	73%	0.732	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-71.8	-18.5	177.8	0	0	0	0	0	114	T582 C586	T582-G584 PolarHBondContact O-N 3.36Å; T582-G584 VanDerWaalsContact O-N 3.08Å; T582-G584 PolarHBondContact OG1-N 2.82Å; G584-C586 VanDerWaalsContact C-N 3.25Å
585	D	90	Very high	84.3	Confident	89 Å²	89	60.7 Å²	60.7	48%	0.476	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-81	-11.2	176.5	-52.8	-43.4	0	0	0	111.9	C580 A581 T582 N583	C580-D585 HydrophobicContact CB-CB 3.8Å; A581-D585 WeakPolarHBondContact CA-OD2 3.15Å; A581-D585 PolarHBondContact N-OD2 2.73Å; T582-D585 PolarHBondContact N-OD2 2.9Å; T582-D585 WeakPolarHBondContact O-CB 3.42Å; T582-D585 PolarHBondContact O-N 3.1Å; T582-D585 PolarHBondContact OG1-OD2 3.49Å; N583-D585 VanDerWaalsContact C-N 3.26Å; N583-D585 PolarHBondContact O-N 2.93Å
586	C	87.7	Confident	84.4	Confident	15 Å²	15	60.3 Å²	60.3	10%	0.101	37%	0.37	C	S	.	.	S	Bend	trans	-96.5	152.3	-177	-63.7	0	0	0	0	112.8	C580 N583 G584 H590 C597	C580-C586 VanDerWaalsContact CB-SG 3.51Å; N583-C586 PolarHBondContact O-N 2.83Å; G584-C586 VanDerWaalsContact C-N 3.25Å; C586-H590 HydrophobicContact CB-CB 3.95Å; C586-C597 WeakPolarHBondContact CA-SG 2.95Å; C586-C597 HydrophobicContact CB-CB 3.74Å; C586-C597 WeakPolarHBondContact CB-SG 3.32Å; C586-C597 WeakPolarHBondContact SG-CA 3.01Å; C586-C597 WeakPolarHBondContact SG-CB 3.44Å; C586-C597 CovalentContact SG-SG 2.04Å; C586-C597 PolarHBondContact SG-SG 2.88Å
587	P	85.4	Confident	84.8	Confident	63 Å²	63	58.8 Å²	58.8	41%	0.409	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-52.8	146.4	170.3	-22.2	31.4	0	0	0	111.1	G589 H590	P587-G589 PolarHBondContact O-N 3.3Å; P587-H590 WeakPolarHBondContact O-CB 3.29Å; P587-H590 PolarHBondContact O-N 2.66Å
588	K	81.2	Confident	85.4	Confident	208 Å²	208	53.8 Å²	53.8	90%	0.904	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	124.9	-175	-171.5	-178.5	179.4	-174.9	0	111
589	G	81.2	Confident	86.1	Confident	67 Å²	67	54 Å²	54	69%	0.691	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.3	-16.6	-178.9	0	0	0	0	0	114.2	P587	P587-G589 PolarHBondContact O-N 3.3Å
590	H	86.2	Confident	85.8	Confident	37 Å²	37	56.4 Å²	56.4	17%	0.171	33%	0.326	C	S	.	.			trans	-88.1	154.7	175.9	-57.6	166.9	0	0	0	111	C586 P587 W598 D599	C586-H590 HydrophobicContact CB-CB 3.95Å; P587-H590 WeakPolarHBondContact O-CB 3.29Å; P587-H590 PolarHBondContact O-N 2.66Å; H590-W598 CarbonylContact C-O 3.53Å; H590-W598 WeakPolarHBondContact CA-O 3.28Å; H590-W598 VanDerWaalsContact CB-O 3.23Å; H590-W598 WeakPolarHBondContact CB-O 3.45Å; H590-D599 IonicContact CD2-OD1 2.89Å; H590-D599 IonicContact NE2-OD1 2.91Å; H590-D599 PolarHBondContact NE2-OD1 2.8Å
591	K	85.8	Confident	84.7	Confident	61 Å²	61	57.9 Å²	57.9	27%	0.265	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139.7	178.9	-75.1	178.1	173	-175.1	0	110.9	I564 E566 W598	I564-K591 HydrophobicContact CD1-CB 4.22Å; I564-K591 HydrophobicContact CD1-CD 3.2Å; I564-K591 HydrophobicContact CD1-CG 4.34Å; E566-K591 VanDerWaalsContact OE1-CE 3.31Å; E566-K591 WeakPolarHBondContact OE1-CE 3.32Å; E566-K591 IonicContact OE1-NZ 3.97Å; E566-K591 PolarHBondContact OE1-NZ 3.1Å; E566-K591 IonicContact OE2-NZ 2.8Å; K591-W598 PolarHBondContact N-O 2.76Å; K591-W598 PolarHBondContact O-N 2.74Å
592	C	88.5	Confident	83	Confident	21 Å²	21	62.4 Å²	62.4	14%	0.142	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.5	172.8	-175.5	0	0	0	0	109.7	C580 T582 N583 I596	C580-C592 HydrophobicContact CB-CB 3.67Å; C580-C592 WeakPolarHBondContact CB-SG 3.33Å; C580-C592 WeakPolarHBondContact SG-CA 3.33Å; C580-C592 WeakPolarHBondContact SG-CB 3.43Å; C580-C592 CovalentContact SG-SG 2.02Å; C580-C592 PolarHBondContact SG-SG 2.68Å; T582-C592 VanDerWaalsContact O-CB 3.3Å; T582-C592 WeakPolarHBondContact O-CB 3.38Å; N583-C592 PolarHBondContact OD1-N 2.92Å; C592-I596 WeakPolarHBondContact CA-O 3.25Å
593	Y	84.8	Confident	82.7	Confident	18 Å²	18	61.5 Å²	61.5	7%	0.071	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	135.6	174.1	175.4	-117.8	0	0	0	109.4	D556 S563 I564 N595 I596 W598	D556-Y593 HydrophobicContact CB-CD2 3.77Å; D556-Y593 HydrophobicContact CB-CE2 3.32Å; D556-Y593 PolarHBondContact O-OH 2.89Å; S563-Y593 WeakPolarHBondContact O-CE1 2.99Å; I564-Y593 HydrophobicContact CG2-CD1 3.57Å; I564-Y593 HydrophobicContact CG2-CD2 4.3Å; I564-Y593 HydrophobicContact CG2-CE1 4.24Å; I564-Y593 HydrophobicContact CG2-CG 3.59Å; Y593-N595 PolarHBondContact O-N 2.02Å; Y593-N595 VanDerWaalsContact O-N 3.11Å; Y593-I596 PolarHBondContact N-O 2.96Å; Y593-I596 PolarHBondContact O-N 3.45Å; Y593-I596 VanDerWaalsContact O-O 3.1Å; Y593-W598 AromaticContact CD1-NE1 3.96Å; Y593-W598 PolarHBondContact O-NE1 2.7Å
594	R	81.7	Confident	82.5	Confident	61 Å²	61	59.7 Å²	59.7	23%	0.23	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	39.3	-173.4	-60.9	-174.3	175.8	-163.2	5.2	113.8	P467 I596	P467-R594 PolarHBondContact O-NH1 2.98Å; R594-I596 PolarHBondContact O-N 3.3Å
595	N	87.8	Confident	82.3	Confident	46 Å²	46	59.1 Å²	59.1	25%	0.246	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	17.5	-177.4	-42.7	-55.5	0	0	0	116	L471 V489 S579 C580 Y593	L471-N595 HydrophobicContact CD2-CB 3.71Å; V489-N595 HydrophobicContact CG1-CB 3.74Å; S579-N595 CarbonylContact C-O 3.49Å; S579-N595 VanDerWaalsContact CA-O 3.24Å; S579-N595 WeakPolarHBondContact CA-O 3.34Å; C580-N595 PolarHBondContact N-O 2.04Å; C580-N595 WeakPolarHBondContact O-CA 2.96Å; C580-N595 VanDerWaalsContact O-CB 3.32Å; C580-N595 WeakPolarHBondContact O-CB 3.49Å; Y593-N595 PolarHBondContact O-N 2.02Å; Y593-N595 VanDerWaalsContact O-N 3.11Å
596	I	87.2	Confident	81.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.1	173.8	-58.9	158.2	0	0	0	108.2	P467 F487 V489 W491 P575 C580 C592 Y593 R594 W598	P467-I596 HydrophobicContact CB-CD1 3.65Å; P467-I596 HydrophobicContact CG-CD1 4.44Å; F487-I596 HydrophobicContact CB-CG1 4.04Å; F487-I596 HydrophobicContact CB-CG2 3.98Å; F487-I596 HydrophobicContact CD2-CG2 4.35Å; F487-I596 HydrophobicContact CG-CG2 4.24Å; V489-I596 HydrophobicContact CG1-CG1 4.47Å; V489-I596 HydrophobicContact CG2-CD1 3.37Å; V489-I596 HydrophobicContact CG2-CG1 3.43Å; V489-I596 VanDerWaalsContact CG2-CG1 3.43Å; W491-I596 HydrophobicContact CZ2-CD1 3.52Å; P575-I596 HydrophobicContact CB-CG2 3.81Å; C580-I596 PolarHBondContact SG-N 3.48Å; C580-I596 PolarHBondContact SG-O 2.69Å; C592-I596 WeakPolarHBondContact CA-O 3.25Å; Y593-I596 PolarHBondContact N-O 2.96Å; Y593-I596 PolarHBondContact O-N 3.45Å; Y593-I596 VanDerWaalsContact O-O 3.1Å; R594-I596 PolarHBondContact O-N 3.3Å; I596-W598 HydrophobicContact CB-CZ2 4.11Å; I596-W598 HydrophobicContact CD1-CH2 4.35Å; I596-W598 HydrophobicContact CD1-CZ2 3.66Å; I596-W598 HydrophobicContact CG2-CD2 4.36Å; I596-W598 HydrophobicContact CG2-CZ2 4.28Å; I596-W598 PolarHBondContact O-NE1 2.87Å
597	C	88.9	Confident	81.5	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.007	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129.2	168.1	-67.2	0	0	0	0	110.3	V576 G578 C586	V576-C597 HydrophobicContact CB-CB 4.39Å; V576-C597 PolarHBondContact N-O 2.9Å; G578-C597 PolarHBondContact O-N 3.14Å; C586-C597 WeakPolarHBondContact CA-SG 2.95Å; C586-C597 HydrophobicContact CB-CB 3.74Å; C586-C597 WeakPolarHBondContact CB-SG 3.32Å; C586-C597 WeakPolarHBondContact SG-CA 3.01Å; C586-C597 WeakPolarHBondContact SG-CB 3.44Å; C586-C597 CovalentContact SG-SG 2.04Å; C586-C597 PolarHBondContact SG-SG 2.88Å
598	W	87	Confident	81.2	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.3	-177	-60.2	89.4	0	0	0	111.5	Y454 P467 W491 Y562 L573 R574 P575 H590 K591 Y593 I596	Y454-W598 HydrophobicContact CD1-CZ3 4.5Å; Y454-W598 HydrophobicContact CE1-CZ3 4.05Å; P467-W598 HydrophobicContact CG-CH2 4.24Å; P467-W598 HydrophobicContact CG-CZ2 4.26Å; W491-W598 HydrophobicContact CH2-CH2 4.03Å; W491-W598 HydrophobicContact CZ2-CH2 4.4Å; Y562-W598 HydrophobicContact CD1-CH2 4.47Å; L573-W598 HydrophobicContact CB-CB 3.6Å; L573-W598 HydrophobicContact CB-CD2 4.23Å; L573-W598 HydrophobicContact CB-CE3 3.85Å; L573-W598 HydrophobicContact CB-CG 4.18Å; L573-W598 HydrophobicContact CD1-CB 3.24Å; L573-W598 HydrophobicContact CD1-CG 4.01Å; L573-W598 HydrophobicContact CG-CB 4.09Å; L573-W598 WeakPolarHBondContact O-CZ3 3.18Å; R574-W598 CarbonylContact O-C 3.45Å; R574-W598 WeakPolarHBondContact O-CA 3.37Å; P575-W598 HydrophobicContact CB-CE3 3.99Å; P575-W598 HydrophobicContact CB-CH2 4.33Å; P575-W598 HydrophobicContact CB-CZ3 3.89Å; P575-W598 HydrophobicContact CG-CZ3 4.14Å; H590-W598 CarbonylContact C-O 3.53Å; H590-W598 WeakPolarHBondContact CA-O 3.28Å; H590-W598 VanDerWaalsContact CB-O 3.23Å; H590-W598 WeakPolarHBondContact CB-O 3.45Å; K591-W598 PolarHBondContact N-O 2.76Å; K591-W598 PolarHBondContact O-N 2.74Å; Y593-W598 AromaticContact CD1-NE1 3.96Å; Y593-W598 PolarHBondContact O-NE1 2.7Å; I596-W598 HydrophobicContact CB-CZ2 4.11Å; I596-W598 HydrophobicContact CD1-CH2 4.35Å; I596-W598 HydrophobicContact CD1-CZ2 3.66Å; I596-W598 HydrophobicContact CG2-CD2 4.36Å; I596-W598 HydrophobicContact CG2-CZ2 4.28Å; I596-W598 PolarHBondContact O-NE1 2.87Å
599	D	86	Confident	81.2	Confident	38 Å²	38	49.1 Å²	49.1	20%	0.203	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	142.3	175.1	-176.1	22.1	0	0	0	110.1	L573 R574 V576 H590 V601	L573-D599 WeakPolarHBondContact CA-O 3.32Å; L573-D599 WeakPolarHBondContact CB-O 3.18Å; R574-D599 IonicContact CZ-OD2 3.86Å; R574-D599 PolarHBondContact N-O 3.14Å; R574-D599 IonicContact NE-OD2 3.3Å; R574-D599 IonicContact NH2-OD2 3.72Å; R574-D599 PolarHBondContact NH2-OD2 3.46Å; R574-D599 PolarHBondContact O-N 3.15Å; V576-D599 HydrophobicContact CG2-CB 3.4Å; H590-D599 IonicContact CD2-OD1 2.89Å; H590-D599 IonicContact NE2-OD1 2.91Å; H590-D599 PolarHBondContact NE2-OD1 2.8Å; D599-V601 PolarHBondContact O-N 3.28Å
600	R	75.6	Confident	81.2	Confident	122 Å²	122	47.8 Å²	47.8	46%	0.46	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	125.1	172.5	-78.1	-166.4	-174.4	-178.5	12.5	108	E566 L573 S602	E566-R600 IonicContact OE1-CZ 3.02Å; E566-R600 IonicContact OE1-NE 2.67Å; E566-R600 IonicContact OE1-NH2 3.46Å; E566-R600 PolarHBondContact OE1-NH2 3.32Å; E566-R600 IonicContact OE2-CZ 2.69Å; E566-R600 IonicContact OE2-NE 3.21Å; E566-R600 PolarHBondContact OE2-NE 2.86Å; E566-R600 IonicContact OE2-NH2 3.07Å; E566-R600 PolarHBondContact OE2-NH2 3.43Å; L573-R600 HydrophobicContact CD2-CB 4.32Å; L573-R600 HydrophobicContact CD2-CG 3.81Å; R600-S602 PolarHBondContact O-N 2.87Å; R600-S602 VanDerWaalsContact O-N 3.12Å
601	V	65.1	Low	80.8	Confident	39 Å²	39	48.7 Å²	48.7	24%	0.236	26%	0.258	C	S	.	.			trans	-68.5	111.9	170.6	-168.6	0	0	0	0	106.8	T420 R574 D599	T420-V601 HydrophobicContact CG2-CB 4.33Å; T420-V601 HydrophobicContact CG2-CG1 3.92Å; T420-V601 HydrophobicContact CG2-CG2 3.58Å; R574-V601 HydrophobicContact CB-CG2 3.88Å; D599-V601 PolarHBondContact O-N 3.28Å
602	S	51.5	Low	80.4	Confident	175 Å²	175	47.5 Å²	47.5	100%	1.224	26%	0.257	S	S	*	.			trans	-69.6	0	-178.2	60.7	0	0	0	0	112.9	R600	R600-S602 PolarHBondContact O-N 2.87Å; R600-S602 VanDerWaalsContact O-N 3.12Å

Retrieved 602 of 602 residues in 310.6 ms (Link to these results)

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