A0A077Z8Y1_TRITR Loading...

WAP domain containing protein, SLPI-like

AlphaFold DB , UniProt , Accession A0A077Z8Y1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 787 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.7	Very low	59.3	Low	238 Å²	238	114.7 Å²	114.7	100%	1.172	64%	0.644	S	S	*	*				0	111.1	0	-72.1	171.1	179.2	0	0	107.2	I3	M1-I3 PolarHBondContact O-N 3.04Å
2	A	43.4	Very low	60.7	Low	111 Å²	111	114.4 Å²	114.4	92%	0.917	64%	0.639	S	S	*	*			trans	-81.6	99.9	-173.7	0	0	0	0	0	109.3	S4	A2-S4 PolarHBondContact O-N 3.31Å
3	I	48.5	Very low	61.8	Low	133 Å²	133	117.2 Å²	117.2	68%	0.682	64%	0.64	S	S	*	*			trans	-73.2	125.3	172.1	-63.3	173.3	0	0	0	107	M1 D7	M1-I3 PolarHBondContact O-N 3.04Å; I3-D7 HydrophobicContact CG2-CB 3.49Å; I3-D7 VanDerWaalsContact CG2-CB 3.49Å
4	S	56.4	Low	62.7	Low	66 Å²	66	119.4 Å²	119.4	46%	0.462	64%	0.635	S	S	.	*			trans	-56.3	143.6	-179.6	169.4	0	0	0	0	110.8	A2 A6 D7 A8	A2-S4 PolarHBondContact O-N 3.31Å; S4-A6 PolarHBondContact O-N 3.1Å; S4-A6 PolarHBondContact OG-N 3.02Å; S4-D7 PolarHBondContact O-N 3.37Å; S4-A8 PolarHBondContact O-N 2.77Å
5	K	59.5	Low	63.5	Low	190 Å²	190	117.7 Å²	117.7	83%	0.826	63%	0.625	S	S	*	*	H	α-helix	trans	-52.3	-23.7	173.9	-77	-178.1	175.4	178.6	0	112.8	M9	K5-M9 PolarHBondContact O-N 2.89Å
6	A	59.3	Low	64.4	Low	51 Å²	51	116.1 Å²	116.1	42%	0.421	62%	0.616	S	S	.	*	H	α-helix	trans	-71	-35.2	175.8	0	0	0	0	0	113.2	S4 K10	S4-A6 PolarHBondContact O-N 3.1Å; S4-A6 PolarHBondContact OG-N 3.02Å; A6-K10 WeakPolarHBondContact O-CG 3.45Å; A6-K10 PolarHBondContact O-N 3.31Å
7	D	62.5	Low	64.9	Low	75 Å²	75	112.5 Å²	112.5	40%	0.401	60%	0.601	S	S	.	*	H	α-helix	trans	-78.6	-33	179.9	-65.4	-42.7	0	0	0	111.4	I3 S4 M9 K10 V11	I3-D7 HydrophobicContact CG2-CB 3.49Å; I3-D7 VanDerWaalsContact CG2-CB 3.49Å; S4-D7 PolarHBondContact O-N 3.37Å; D7-M9 VanDerWaalsContact C-N 3.32Å; D7-M9 PolarHBondContact O-N 3.27Å; D7-K10 PolarHBondContact O-N 2.04Å; D7-V11 WeakPolarHBondContact O-CG2 3.01Å; D7-V11 PolarHBondContact O-N 2.87Å; D7-V11 VanDerWaalsContact O-N 3.08Å
8	A	65.8	Low	65.2	Low	59 Å²	59	111.9 Å²	111.9	49%	0.488	60%	0.597	S	S	.	*	H	α-helix	trans	-62.1	-38.5	172.4	0	0	0	0	0	112.3	S4 L12	S4-A8 PolarHBondContact O-N 2.77Å; A8-L12 WeakPolarHBondContact O-CB 3.45Å; A8-L12 PolarHBondContact O-N 2.77Å; A8-L12 VanDerWaalsContact O-N 3.07Å
9	M	70.9	Confident	65.4	Low	137 Å²	137	112.1 Å²	112.1	68%	0.675	60%	0.597	S	S	*	*	H	α-helix	trans	-68.7	-37.8	175.3	-95.1	-155	-72.4	0	0	112.7	K5 D7 L12 F13	K5-M9 PolarHBondContact O-N 2.89Å; D7-M9 VanDerWaalsContact C-N 3.32Å; D7-M9 PolarHBondContact O-N 3.27Å; M9-L12 PolarHBondContact O-N 2.03Å; M9-F13 WeakPolarHBondContact O-CB 3.17Å; M9-F13 PolarHBondContact O-N 3.42Å
10	K	69.9	Low	65.5	Low	109 Å²	109	113.6 Å²	113.6	47%	0.474	61%	0.605	S	S	.	*	H	α-helix	trans	-65.4	-38.7	177	-69.6	-178.1	-166.6	-171.6	0	112.1	A6 D7 R14 F786	A6-K10 WeakPolarHBondContact O-CG 3.45Å; A6-K10 PolarHBondContact O-N 3.31Å; D7-K10 PolarHBondContact O-N 2.04Å; K10-R14 WeakPolarHBondContact O-CG 3.47Å; K10-R14 PolarHBondContact O-N 2.79Å; K10-R14 VanDerWaalsContact O-N 3.09Å; K10-F786 HydrophobicContact CD-CE1 4.09Å; K10-F786 HydrophobicContact CG-CE1 4.21Å
11	V	75.1	Confident	65.2	Low	93 Å²	93	112.2 Å²	112.2	56%	0.564	60%	0.604	S	S	*	*	H	α-helix	trans	-68	-42.4	176.7	174.7	0	0	0	0	111.2	D7 F13 R14 L15	D7-V11 WeakPolarHBondContact O-CG2 3.01Å; D7-V11 PolarHBondContact O-N 2.87Å; D7-V11 VanDerWaalsContact O-N 3.08Å; V11-F13 VanDerWaalsContact C-N 3.34Å; V11-F13 PolarHBondContact O-N 2.84Å; V11-R14 PolarHBondContact O-N 3.06Å; V11-L15 HydrophobicContact CG1-CD1 4.17Å; V11-L15 PolarHBondContact O-N 2.91Å
12	L	76.7	Confident	66.2	Low	111 Å²	111	105.4 Å²	105.4	58%	0.581	57%	0.571	S	S	*	*	H	α-helix	trans	-63.5	-39.5	177.3	-163.6	74.1	0	0	0	111.9	A8 M9 L15 L16	A8-L12 WeakPolarHBondContact O-CB 3.45Å; A8-L12 PolarHBondContact O-N 2.77Å; A8-L12 VanDerWaalsContact O-N 3.07Å; M9-L12 PolarHBondContact O-N 2.03Å; L12-L15 PolarHBondContact O-N 3.22Å; L12-L16 PolarHBondContact O-N 2.99Å
13	F	75.1	Confident	66.7	Low	151 Å²	151	105.5 Å²	105.5	66%	0.662	56%	0.563	S	S	*	*	H	α-helix	trans	-69.3	-38.2	178.5	-141.4	-92.2	0	0	0	112.2	M9 V11 L16 C17	M9-F13 WeakPolarHBondContact O-CB 3.17Å; M9-F13 PolarHBondContact O-N 3.42Å; V11-F13 VanDerWaalsContact C-N 3.34Å; V11-F13 PolarHBondContact O-N 2.84Å; F13-L16 PolarHBondContact O-N 3.07Å; F13-C17 PolarHBondContact O-N 3.28Å; F13-C17 VanDerWaalsContact O-N 3.1Å; F13-C17 PolarHBondContact O-SG 2.93Å
14	R	74.1	Confident	66.7	Low	148 Å²	148	104.7 Å²	104.7	56%	0.558	57%	0.569	S	S	*	*	H	α-helix	trans	-65.2	-39	173.6	-72.7	-142	-177.5	-151.9	1.2	112.5	K10 V11 C17 I18	K10-R14 WeakPolarHBondContact O-CG 3.47Å; K10-R14 PolarHBondContact O-N 2.79Å; K10-R14 VanDerWaalsContact O-N 3.09Å; V11-R14 PolarHBondContact O-N 3.06Å; R14-C17 PolarHBondContact O-N 3.38Å; R14-I18 WeakPolarHBondContact O-CD1 3.45Å; R14-I18 VanDerWaalsContact O-CG1 3.23Å; R14-I18 WeakPolarHBondContact O-CG1 3.39Å; R14-I18 PolarHBondContact O-N 2.76Å; R14-I18 VanDerWaalsContact O-N 3.13Å
15	L	75.3	Confident	66.3	Low	94 Å²	94	109.2 Å²	109.2	49%	0.492	59%	0.587	S	S	.	*	H	α-helix	trans	-63.7	-41.2	174.6	-92.2	155.5	0	0	0	112.4	V11 L12 I18 L19	V11-L15 HydrophobicContact CG1-CD1 4.17Å; V11-L15 PolarHBondContact O-N 2.91Å; L12-L15 PolarHBondContact O-N 3.22Å; L15-I18 PolarHBondContact O-N 2.93Å; L15-L19 VanDerWaalsContact O-CG 3.29Å; L15-L19 WeakPolarHBondContact O-CG 3.35Å; L15-L19 PolarHBondContact O-N 3.18Å
16	L	77.7	Confident	65.7	Low	92 Å²	92	104.1 Å²	104.1	48%	0.482	58%	0.581	S	S	.	*	H	α-helix	trans	-65.4	-39.8	177.2	-114.2	137.2	0	0	0	112.5	L12 F13 L19 L20	L12-L16 PolarHBondContact O-N 2.99Å; F13-L16 PolarHBondContact O-N 3.07Å; L16-L19 PolarHBondContact O-N 3.26Å; L16-L20 HydrophobicContact CD2-CD1 4.17Å; L16-L20 WeakPolarHBondContact O-CB 3.31Å; L16-L20 VanDerWaalsContact O-CG 3.27Å; L16-L20 WeakPolarHBondContact O-CG 3.15Å; L16-L20 PolarHBondContact O-N 3.46Å
17	C	71.7	Confident	65.2	Low	54 Å²	54	111.5 Å²	111.5	37%	0.365	60%	0.598	S	S	.	*	H	α-helix	trans	-66.2	-35.2	174.8	-70.5	0	0	0	0	113	F13 R14 S21	F13-C17 PolarHBondContact O-N 3.28Å; F13-C17 VanDerWaalsContact O-N 3.1Å; F13-C17 PolarHBondContact O-SG 2.93Å; R14-C17 PolarHBondContact O-N 3.38Å; C17-S21 PolarHBondContact O-N 3.47Å; C17-S21 PolarHBondContact O-OG 3.28Å
18	I	71.8	Confident	64.8	Low	102 Å²	102	112.1 Å²	112.1	52%	0.523	61%	0.613	S	S	.	*	H	α-helix	trans	-68.9	-40.8	175.6	-65.5	162.8	0	0	0	110.3	R14 L15 L20 S21 I22	R14-I18 WeakPolarHBondContact O-CD1 3.45Å; R14-I18 VanDerWaalsContact O-CG1 3.23Å; R14-I18 WeakPolarHBondContact O-CG1 3.39Å; R14-I18 PolarHBondContact O-N 2.76Å; R14-I18 VanDerWaalsContact O-N 3.13Å; L15-I18 PolarHBondContact O-N 2.93Å; I18-L20 PolarHBondContact O-N 3.13Å; I18-S21 WeakPolarHBondContact CA-OG 3Å; I18-S21 PolarHBondContact O-N 2.74Å; I18-S21 PolarHBondContact O-OG 3.17Å; I18-S21 VanDerWaalsContact O-OG 3.06Å; I18-I22 WeakPolarHBondContact O-CG1 3.25Å
19	L	68.4	Low	64.4	Low	115 Å²	115	110 Å²	110	60%	0.602	60%	0.597	S	S	*	*	H	α-helix	trans	-68.3	-32	177.7	-70.3	168	0	0	0	113.3	L15 L16 S21 I22	L15-L19 VanDerWaalsContact O-CG 3.29Å; L15-L19 WeakPolarHBondContact O-CG 3.35Å; L15-L19 PolarHBondContact O-N 3.18Å; L16-L19 PolarHBondContact O-N 3.26Å; L19-S21 VanDerWaalsContact C-N 3.32Å; L19-I22 HydrophobicContact CD2-CD1 4.38Å
20	L	66.8	Low	64.3	Low	142 Å²	142	109.2 Å²	109.2	74%	0.743	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-8.3	177.7	-69	170.8	0	0	0	113.9	L16 I18	L16-L20 HydrophobicContact CD2-CD1 4.17Å; L16-L20 WeakPolarHBondContact O-CB 3.31Å; L16-L20 VanDerWaalsContact O-CG 3.27Å; L16-L20 WeakPolarHBondContact O-CG 3.15Å; L16-L20 PolarHBondContact O-N 3.46Å; I18-L20 PolarHBondContact O-N 3.13Å
21	S	59.8	Low	64.6	Low	85 Å²	85	104.3 Å²	104.3	59%	0.594	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	2.3	178.7	45	0	0	0	0	114.1	C17 I18 L19 P23	C17-S21 PolarHBondContact O-N 3.47Å; C17-S21 PolarHBondContact O-OG 3.28Å; I18-S21 WeakPolarHBondContact CA-OG 3Å; I18-S21 PolarHBondContact O-N 2.74Å; I18-S21 PolarHBondContact O-OG 3.17Å; I18-S21 VanDerWaalsContact O-OG 3.06Å; L19-S21 VanDerWaalsContact C-N 3.32Å; S21-P23 WeakPolarHBondContact O-CD 3.1Å
22	I	61.4	Low	64.5	Low	95 Å²	95	104.5 Å²	104.5	49%	0.487	58%	0.577	S	S	.	*	S	Bend	trans	-82.6	112.6	172.3	-60.7	164.8	0	0	0	108.2	I18 L19 S24	I18-I22 WeakPolarHBondContact O-CG1 3.25Å; L19-I22 HydrophobicContact CD2-CD1 4.38Å; I22-S24 PolarHBondContact O-N 3.35Å
23	P	53.4	Low	64.3	Low	113 Å²	113	103 Å²	103	73%	0.734	57%	0.569	S	S	*	*			trans	-60.8	127.2	172.2	-12.7	27.8	0	0	0	108	S21 L25	S21-P23 WeakPolarHBondContact O-CD 3.1Å; P23-L25 PolarHBondContact O-N 3.14Å
24	S	48.7	Very low	64.1	Low	117 Å²	117	98.6 Å²	98.6	82%	0.818	57%	0.567	S	S	*	*			trans	-47.1	126.9	-178	-52.3	0	0	0	0	111.6	I22 A26	I22-S24 PolarHBondContact O-N 3.35Å; S24-A26 PolarHBondContact O-N 3.04Å
25	L	47.5	Very low	64.1	Low	161 Å²	161	93.4 Å²	93.4	84%	0.843	56%	0.556	S	S	*	*			trans	-51.8	105.3	177.2	-77.8	89.1	0	0	0	110.4	P23	P23-L25 PolarHBondContact O-N 3.14Å
26	A	47.2	Very low	64.2	Low	83 Å²	83	96.2 Å²	96.2	69%	0.686	57%	0.571	S	S	*	*			trans	-70.4	129.7	168.8	0	0	0	0	0	108.8	S24 A28	S24-A26 PolarHBondContact O-N 3.04Å; A26-A28 PolarHBondContact O-N 2.01Å; A26-A28 VanDerWaalsContact O-N 3.15Å
27	W	49.8	Very low	64.1	Low	206 Å²	206	93.3 Å²	93.3	78%	0.78	56%	0.557	S	S	*	*			trans	-55.8	115.7	172.3	-76.5	-15.9	0	0	0	110.1	G29	W27-G29 PolarHBondContact O-N 3.3Å
28	A	54.5	Low	64.5	Low	88 Å²	88	94.7 Å²	94.7	73%	0.727	56%	0.56	S	S	*	*			trans	-66.5	97.3	168.7	0	0	0	0	0	108.9	A26 I30	A26-A28 PolarHBondContact O-N 2.01Å; A26-A28 VanDerWaalsContact O-N 3.15Å; A28-I30 PolarHBondContact O-N 2.8Å
29	G	56.6	Low	65.1	Low	15 Å²	15	93.9 Å²	93.9	16%	0.155	56%	0.556	C	S	.	*			trans	-69.6	111	-179.3	0	0	0	0	0	111.2	W27 P37 S56	W27-G29 PolarHBondContact O-N 3.3Å; G29-P37 WeakPolarHBondContact O-CD 3.19Å; G29-P37 WeakPolarHBondContact O-CG 3.17Å; G29-S56 PolarHBondContact O-OG 3.07Å
30	I	68.6	Low	65.7	Low	120 Å²	120	93.7 Å²	93.7	62%	0.615	56%	0.555	S	S	*	*			trans	-70.8	135.7	171.6	-59	166.7	0	0	0	108.5	A28	A28-I30 PolarHBondContact O-N 2.8Å
31	C	77.4	Confident	66.4	Low	5 Å²	5	87.3 Å²	87.3	3%	0.034	52%	0.523	C	S	.	.			trans	-64.8	152.1	176	-64.7	0	0	0	0	111.5	D33 G34 A35 C58	C31-D33 WeakPolarHBondContact CB-OD1 3.24Å; C31-D33 PolarHBondContact O-N 2.76Å; C31-G34 WeakPolarHBondContact O-CA 3.41Å; C31-G34 PolarHBondContact O-N 3.47Å; C31-A35 HydrophobicContact CB-CB 4.31Å; C31-A35 VanDerWaalsContact CB-O 3.3Å; C31-A35 WeakPolarHBondContact CB-O 3.42Å; C31-A35 PolarHBondContact N-O 3.35Å; C31-C58 WeakPolarHBondContact CA-SG 3.34Å; C31-C58 HydrophobicContact CB-CB 3.64Å; C31-C58 WeakPolarHBondContact CB-SG 3.01Å; C31-C58 WeakPolarHBondContact SG-CA 3.02Å; C31-C58 WeakPolarHBondContact SG-CB 3Å; C31-C58 CovalentContact SG-SG 2.03Å; C31-C58 PolarHBondContact SG-SG 2.89Å
32	P	71.6	Confident	67	Low	98 Å²	98	90.1 Å²	90.1	64%	0.636	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.6	-176.4	25.2	-35.4	0	0	0	114.4	G34 E53	P32-G34 VanDerWaalsContact C-N 3.32Å; P32-E53 WeakPolarHBondContact CD-OE2 3.32Å; P32-E53 VanDerWaalsContact CG-CD 3.49Å; P32-E53 VanDerWaalsContact CG-OE2 3.23Å; P32-E53 WeakPolarHBondContact CG-OE2 3.38Å
33	D	73.4	Confident	67.3	Low	78 Å²	78	89.9 Å²	89.9	42%	0.417	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	1.6	172.3	61.6	-7.2	0	0	0	113.5	C31 A35	C31-D33 WeakPolarHBondContact CB-OD1 3.24Å; C31-D33 PolarHBondContact O-N 2.76Å; D33-A35 PolarHBondContact O-N 2.8Å; D33-A35 VanDerWaalsContact OD1-CB 3.23Å; D33-A35 WeakPolarHBondContact OD1-CB 3.46Å; D33-A35 PolarHBondContact OD1-N 2.79Å
34	G	69.5	Low	67.7	Low	59 Å²	59	91.1 Å²	91.1	61%	0.608	54%	0.54	S	S	*	.	S	Bend	trans	79.5	2	-175.3	0	0	0	0	0	114.1	C31 P32	C31-G34 WeakPolarHBondContact O-CA 3.41Å; C31-G34 PolarHBondContact O-N 3.47Å; P32-G34 VanDerWaalsContact C-N 3.32Å
35	A	75.9	Confident	68.8	Low	40 Å²	40	92.9 Å²	92.9	33%	0.331	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-73	152.2	176	0	0	0	0	0	111.3	C31 D33	C31-A35 HydrophobicContact CB-CB 4.31Å; C31-A35 VanDerWaalsContact CB-O 3.3Å; C31-A35 WeakPolarHBondContact CB-O 3.42Å; C31-A35 PolarHBondContact N-O 3.35Å; D33-A35 PolarHBondContact O-N 2.8Å; D33-A35 VanDerWaalsContact OD1-CB 3.23Å; D33-A35 WeakPolarHBondContact OD1-CB 3.46Å; D33-A35 PolarHBondContact OD1-N 2.79Å
36	L	77	Confident	70.4	Confident	153 Å²	153	86.2 Å²	86.2	80%	0.801	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-72.3	134.4	170.2	-74.9	162.3	0	0	0	109
37	P	75.9	Confident	71.8	Confident	31 Å²	31	85 Å²	85	20%	0.201	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-65.8	146.6	174.6	34.7	-40.6	0	0	0	110.2	G29 S56 C57	G29-P37 WeakPolarHBondContact O-CD 3.19Å; G29-P37 WeakPolarHBondContact O-CG 3.17Å; P37-S56 VanDerWaalsContact CB-CB 3.49Å; P37-C57 WeakPolarHBondContact CA-O 3.18Å
38	I	80.3	Confident	72.8	Confident	83 Å²	83	78.9 Å²	78.9	43%	0.426	49%	0.487	S	S	.	.	S	Bend	trans	-74.6	-44.4	-179.9	-80.7	-165.8	0	0	0	112	P47 Y50 C57	I38-P47 HydrophobicContact CG2-CG 4.06Å; I38-Y50 HydrophobicContact CB-CD1 4.47Å; I38-Y50 HydrophobicContact CB-CE1 4.43Å; I38-Y50 HydrophobicContact CD1-CD1 4.01Å; I38-Y50 HydrophobicContact CD1-CD2 4.14Å; I38-Y50 HydrophobicContact CD1-CE1 3.35Å; I38-Y50 HydrophobicContact CD1-CE2 3.52Å; I38-Y50 HydrophobicContact CD1-CG 4.4Å; I38-Y50 VanDerWaalsContact CD1-OH 3.27Å; I38-Y50 WeakPolarHBondContact CD1-OH 3.02Å; I38-Y50 HydrophobicContact CG1-CD1 4.13Å; I38-Y50 HydrophobicContact CG1-CE1 3.61Å; I38-C57 PolarHBondContact N-O 3.12Å; I38-C57 VanDerWaalsContact N-O 3.1Å
39	I	82.7	Confident	73.8	Confident	84 Å²	84	76.9 Å²	76.9	43%	0.431	48%	0.475	S	S	.	.	S	Bend	trans	-151.9	159.2	177.7	56.8	176.9	0	0	0	108.6	C57	I39-C57 HydrophobicContact CG1-CB 4.01Å; I39-C57 VanDerWaalsContact CG1-SG 3.55Å; I39-C57 WeakPolarHBondContact O-CB 3.07Å; I39-C57 PolarHBondContact O-N 2.76Å
40	D	81.4	Confident	75.1	Confident	111 Å²	111	79.1 Å²	79.1	59%	0.594	48%	0.48	S	S	*	.	B	Isolated β-bridge	trans	-71.4	145.7	167.2	-60	-24.1	0	0	0	109.6	G55	D40-G55 CarbonylContact C-O 3.45Å; D40-G55 WeakPolarHBondContact CA-O 3.43Å
41	C	82	Confident	75.8	Confident	9 Å²	9	79.2 Å²	79.2	6%	0.061	47%	0.472	C	S	.	.			trans	-131.4	130.6	-180	56.3	0	0	0	0	110.5	C52 G55 S56	C41-C52 HydrophobicContact CB-CB 3.83Å; C41-C52 WeakPolarHBondContact CB-SG 3.04Å; C41-C52 PolarHBondContact O-SG 2.79Å; C41-C52 WeakPolarHBondContact SG-CA 2.99Å; C41-C52 WeakPolarHBondContact SG-CB 3.41Å; C41-C52 CovalentContact SG-SG 2.02Å; C41-C52 PolarHBondContact SG-SG 3.34Å; C41-G55 PolarHBondContact N-O 2.9Å; C41-G55 CarbonylContact O-C 3.59Å; C41-G55 VanDerWaalsContact O-CA 3.27Å; C41-G55 WeakPolarHBondContact O-CA 3.3Å; C41-S56 PolarHBondContact SG-N 3.36Å
42	V	72.2	Confident	76.2	Confident	144 Å²	144	80 Å²	80	87%	0.873	48%	0.478	S	S	*	.	S	Bend	trans	-98.8	-20.2	177.8	-173.1	0	0	0	0	110.9
43	T	67.2	Low	76.6	Confident	90 Å²	90	77.8 Å²	77.8	55%	0.552	46%	0.459	S	S	*	.	S	Bend	trans	-152.6	169.8	177.3	22.5	0	0	0	0	106.3	E45	T43-E45 PolarHBondContact O-N 3.25Å
44	N	63.1	Low	76.7	Confident	139 Å²	139	82.2 Å²	82.2	74%	0.743	48%	0.477	S	S	*	.	S	Bend	trans	-62.9	31.1	-169.6	-73.5	-44.4	0	0	0	116.9	C46	N44-C46 PolarHBondContact O-N 2.77Å
45	E	70.7	Confident	77.1	Confident	153 Å²	153	81 Å²	81	72%	0.715	46%	0.464	S	S	*	.			trans	-78.3	48	174.7	-57.5	-176	159.4	0	0	111.7	T43	T43-E45 PolarHBondContact O-N 3.25Å
46	C	80.9	Confident	77.4	Confident	22 Å²	22	79.2 Å²	79.2	15%	0.149	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-91.3	141.4	171.2	-67.6	0	0	0	0	110.5	N44 Y50 R51 C52 C57	N44-C46 PolarHBondContact O-N 2.77Å; C46-Y50 WeakPolarHBondContact CB-O 2.91Å; C46-R51 VanDerWaalsContact SG-C 3.58Å; C46-C52 VanDerWaalsContact SG-CA 3.59Å; C46-C52 PolarHBondContact SG-N 3.11Å; C46-C52 VanDerWaalsContact SG-N 3.35Å; C46-C57 WeakPolarHBondContact CA-SG 3.46Å; C46-C57 HydrophobicContact CB-CB 3.76Å; C46-C57 WeakPolarHBondContact CB-SG 3.14Å; C46-C57 WeakPolarHBondContact SG-CA 3.46Å; C46-C57 WeakPolarHBondContact SG-CB 3.28Å; C46-C57 CovalentContact SG-SG 2.03Å; C46-C57 PolarHBondContact SG-SG 2.77Å
47	P	76.2	Confident	77.8	Confident	57 Å²	57	71.9 Å²	71.9	37%	0.37	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-56.5	147.9	171.7	21.1	-29.3	0	0	0	110.7	I38 G49 Y50	I38-P47 HydrophobicContact CG2-CG 4.06Å; P47-G49 PolarHBondContact O-N 2.03Å; P47-Y50 HydrophobicContact CG-CD2 4.26Å; P47-Y50 WeakPolarHBondContact O-CB 2.91Å; P47-Y50 WeakPolarHBondContact O-CD2 3.5Å; P47-Y50 PolarHBondContact O-N 3.07Å
48	G	72.7	Confident	78.3	Confident	77 Å²	77	70.5 Å²	70.5	79%	0.794	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	134.4	-175.5	0	0	0	0	0	113.2
49	G	75.4	Confident	78.4	Confident	46 Å²	46	74.4 Å²	74.4	47%	0.474	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	-3.8	-173.4	0	0	0	0	0	114.9	P47 R59 L60	P47-G49 PolarHBondContact O-N 2.03Å; G49-R59 WeakPolarHBondContact O-CA 3.36Å; G49-L60 PolarHBondContact O-N 2.81Å
50	Y	83.2	Confident	77.7	Confident	63 Å²	63	74.5 Å²	74.5	25%	0.247	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	144.8	175.1	-61.4	-101.3	0	0	0	110.2	I38 C46 P47 C58 R59	I38-Y50 HydrophobicContact CB-CD1 4.47Å; I38-Y50 HydrophobicContact CB-CE1 4.43Å; I38-Y50 HydrophobicContact CD1-CD1 4.01Å; I38-Y50 HydrophobicContact CD1-CD2 4.14Å; I38-Y50 HydrophobicContact CD1-CE1 3.35Å; I38-Y50 HydrophobicContact CD1-CE2 3.52Å; I38-Y50 HydrophobicContact CD1-CG 4.4Å; I38-Y50 VanDerWaalsContact CD1-OH 3.27Å; I38-Y50 WeakPolarHBondContact CD1-OH 3.02Å; I38-Y50 HydrophobicContact CG1-CD1 4.13Å; I38-Y50 HydrophobicContact CG1-CE1 3.61Å; C46-Y50 WeakPolarHBondContact CB-O 2.91Å; P47-Y50 HydrophobicContact CG-CD2 4.26Å; P47-Y50 WeakPolarHBondContact O-CB 2.91Å; P47-Y50 WeakPolarHBondContact O-CD2 3.5Å; P47-Y50 PolarHBondContact O-N 3.07Å; Y50-C58 CarbonylContact C-O 3.51Å; Y50-C58 WeakPolarHBondContact CA-O 3.46Å; Y50-R59 HydrophobicContact CD1-CB 4.14Å; Y50-R59 HydrophobicContact CE1-CB 3.85Å; Y50-R59 HydrophobicContact CE1-CG 4.4Å
51	R	83.6	Confident	76.6	Confident	121 Å²	121	73.8 Å²	73.8	46%	0.457	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	149.5	169.4	75.2	175.3	-85.6	-102.1	1.7	109.9	C46 E53 C58 L60	C46-R51 VanDerWaalsContact SG-C 3.58Å; R51-E53 IonicContact CZ-OE1 3.44Å; R51-E53 IonicContact NH1-OE1 3.93Å; R51-E53 PolarHBondContact NH1-OE1 2.04Å; R51-E53 IonicContact NH1-OE2 2.75Å; R51-E53 PolarHBondContact NH1-OE2 3.29Å; R51-E53 VanDerWaalsContact NH1-OE2 3.13Å; R51-E53 PolarHBondContact O-N 2.78Å; R51-C58 PolarHBondContact N-O 2.86Å; R51-C58 PolarHBondContact O-N 2.85Å; R51-L60 HydrophobicContact CB-CD1 4.03Å
52	C	85.3	Confident	75	Confident	23 Å²	23	78.9 Å²	78.9	16%	0.155	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	116.2	172.4	-169.1	0	0	0	0	109.3	C41 C46	C41-C52 HydrophobicContact CB-CB 3.83Å; C41-C52 WeakPolarHBondContact CB-SG 3.04Å; C41-C52 PolarHBondContact O-SG 2.79Å; C41-C52 WeakPolarHBondContact SG-CA 2.99Å; C41-C52 WeakPolarHBondContact SG-CB 3.41Å; C41-C52 CovalentContact SG-SG 2.02Å; C41-C52 PolarHBondContact SG-SG 3.34Å; C46-C52 VanDerWaalsContact SG-CA 3.59Å; C46-C52 PolarHBondContact SG-N 3.11Å; C46-C52 VanDerWaalsContact SG-N 3.35Å
53	E	79.6	Confident	73.4	Confident	50 Å²	50	80 Å²	80	23%	0.234	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	114.1	-179.2	-170.8	154	-143.8	0	0	109	P32 R51 G55 S56 C58	P32-E53 WeakPolarHBondContact CD-OE2 3.32Å; P32-E53 VanDerWaalsContact CG-CD 3.49Å; P32-E53 VanDerWaalsContact CG-OE2 3.23Å; P32-E53 WeakPolarHBondContact CG-OE2 3.38Å; R51-E53 IonicContact CZ-OE1 3.44Å; R51-E53 IonicContact NH1-OE1 3.93Å; R51-E53 PolarHBondContact NH1-OE1 2.04Å; R51-E53 IonicContact NH1-OE2 2.75Å; R51-E53 PolarHBondContact NH1-OE2 3.29Å; R51-E53 VanDerWaalsContact NH1-OE2 3.13Å; R51-E53 PolarHBondContact O-N 2.78Å; E53-G55 VanDerWaalsContact C-N 3.26Å; E53-G55 PolarHBondContact O-N 2.76Å; E53-S56 PolarHBondContact N-O 2.96Å; E53-S56 WeakPolarHBondContact O-CB 2.93Å; E53-S56 PolarHBondContact O-N 3.32Å; E53-S56 VanDerWaalsContact O-O 3.08Å; E53-C58 HydrophobicContact CB-CB 4.14Å
54	Q	75.4	Confident	72.1	Confident	171 Å²	171	81.8 Å²	81.8	80%	0.799	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	35.7	-176.8	-55.5	-176.7	17	0	0	114.7	S56	Q54-S56 VanDerWaalsContact C-N 3.29Å
55	G	77.7	Confident	70.9	Confident	33 Å²	33	79.6 Å²	79.6	34%	0.34	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	9.2	-178.9	0	0	0	0	0	114	D40 C41 E53	D40-G55 CarbonylContact C-O 3.45Å; D40-G55 WeakPolarHBondContact CA-O 3.43Å; C41-G55 PolarHBondContact N-O 2.9Å; C41-G55 CarbonylContact O-C 3.59Å; C41-G55 VanDerWaalsContact O-CA 3.27Å; C41-G55 WeakPolarHBondContact O-CA 3.3Å; E53-G55 VanDerWaalsContact C-N 3.26Å; E53-G55 PolarHBondContact O-N 2.76Å
56	S	82.7	Confident	69.3	Low	3 Å²	3	79.7 Å²	79.7	2%	0.021	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.9	-177.5	-84.4	0	0	0	0	111.2	G29 P37 C41 E53 Q54 C58	G29-S56 PolarHBondContact O-OG 3.07Å; P37-S56 VanDerWaalsContact CB-CB 3.49Å; C41-S56 PolarHBondContact SG-N 3.36Å; E53-S56 PolarHBondContact N-O 2.96Å; E53-S56 WeakPolarHBondContact O-CB 2.93Å; E53-S56 PolarHBondContact O-N 3.32Å; E53-S56 VanDerWaalsContact O-O 3.08Å; Q54-S56 VanDerWaalsContact C-N 3.29Å; S56-C58 PolarHBondContact O-N 3.23Å
57	C	86.8	Confident	67.1	Low	0 Å²	0	90.3 Å²	90.3	0%	0	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	109.8	175	-70.3	0	0	0	0	112	P37 I38 I39 C46	P37-C57 WeakPolarHBondContact CA-O 3.18Å; I38-C57 PolarHBondContact N-O 3.12Å; I38-C57 VanDerWaalsContact N-O 3.1Å; I39-C57 HydrophobicContact CG1-CB 4.01Å; I39-C57 VanDerWaalsContact CG1-SG 3.55Å; I39-C57 WeakPolarHBondContact O-CB 3.07Å; I39-C57 PolarHBondContact O-N 2.76Å; C46-C57 WeakPolarHBondContact CA-SG 3.46Å; C46-C57 HydrophobicContact CB-CB 3.76Å; C46-C57 WeakPolarHBondContact CB-SG 3.14Å; C46-C57 WeakPolarHBondContact SG-CA 3.46Å; C46-C57 WeakPolarHBondContact SG-CB 3.28Å; C46-C57 CovalentContact SG-SG 2.03Å; C46-C57 PolarHBondContact SG-SG 2.77Å
58	C	84.7	Confident	65.3	Low	2 Å²	2	93 Å²	93	1%	0.014	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.7	-174.5	-65.9	0	0	0	0	112.7	C31 Y50 R51 E53 S56	C31-C58 WeakPolarHBondContact CA-SG 3.34Å; C31-C58 HydrophobicContact CB-CB 3.64Å; C31-C58 WeakPolarHBondContact CB-SG 3.01Å; C31-C58 WeakPolarHBondContact SG-CA 3.02Å; C31-C58 WeakPolarHBondContact SG-CB 3Å; C31-C58 CovalentContact SG-SG 2.03Å; C31-C58 PolarHBondContact SG-SG 2.89Å; Y50-C58 CarbonylContact C-O 3.51Å; Y50-C58 WeakPolarHBondContact CA-O 3.46Å; R51-C58 PolarHBondContact N-O 2.86Å; R51-C58 PolarHBondContact O-N 2.85Å; E53-C58 HydrophobicContact CB-CB 4.14Å; S56-C58 PolarHBondContact O-N 3.23Å
59	R	82.5	Confident	63.4	Low	165 Å²	165	95.4 Å²	95.4	62%	0.623	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	135.2	-174.2	-167.5	175.3	-179.2	142.8	-0.3	111.1	G49 Y50 S61	G49-R59 WeakPolarHBondContact O-CA 3.36Å; Y50-R59 HydrophobicContact CD1-CB 4.14Å; Y50-R59 HydrophobicContact CE1-CB 3.85Å; Y50-R59 HydrophobicContact CE1-CG 4.4Å; R59-S61 PolarHBondContact O-N 3.5Å
60	L	68.6	Low	61.6	Low	86 Å²	86	98.5 Å²	98.5	45%	0.45	54%	0.537	S	S	.	.			trans	-64.8	108	174.9	-87.4	89.8	0	0	0	110.7	G49 R51 T62	G49-L60 PolarHBondContact O-N 2.81Å; R51-L60 HydrophobicContact CB-CD1 4.03Å; L60-T62 PolarHBondContact O-N 3.43Å; L60-T62 VanDerWaalsContact O-N 3.09Å
61	S	57.2	Low	59.5	Low	96 Å²	96	103.9 Å²	103.9	67%	0.671	57%	0.565	S	S	*	*			trans	-77.3	82.6	168.2	-67.2	0	0	0	0	110	R59	R59-S61 PolarHBondContact O-N 3.5Å
62	T	49.6	Very low	57.4	Low	116 Å²	116	106 Å²	106	71%	0.712	59%	0.586	S	S	*	*			trans	-92.5	99.1	171.5	43.8	0	0	0	0	110.3	L60	L60-T62 PolarHBondContact O-N 3.43Å; L60-T62 VanDerWaalsContact O-N 3.09Å
63	L	39.3	Very low	55.3	Low	167 Å²	167	110.2 Å²	110.2	87%	0.874	62%	0.615	S	S	*	*			trans	-60.2	124.3	156.3	-84.6	149.5	0	0	0	108.3	A65	L63-A65 PolarHBondContact O-N 3.15Å
64	P	38.4	Very low	53.7	Low	127 Å²	127	113.2 Å²	113.2	83%	0.825	64%	0.639	S	S	*	*			trans	-82.1	108.4	-177	30.3	-29.6	0	0	0	110.2
65	A	38.3	Very low	51.9	Low	93 Å²	93	110.7 Å²	110.7	77%	0.769	64%	0.64	S	S	*	*			trans	-88.1	110.9	166.2	0	0	0	0	0	110.3	L63	L63-A65 PolarHBondContact O-N 3.15Å
66	N	36.9	Very low	50.2	Low	155 Å²	155	115.3 Å²	115.3	83%	0.829	66%	0.662	S	S	*	*			trans	29	106.7	142.5	-64.2	-32.9	0	0	0	119.3
67	R	34.1	Very low	48	Very low	245 Å²	245	119.7 Å²	119.7	93%	0.925	70%	0.698	S	S	*	*				170.7	154.2	107.5	-100.5	-171.5	177.1	178.2	0.4	113.9
68	P	38.7	Very low	45.8	Very low	115 Å²	115	125.9 Å²	125.9	75%	0.747	74%	0.739	S	S	*	*			trans	-101.5	-179	-155.6	44.1	-38.7	0	0	0	114.8
69	P	34.5	Very low	43.5	Very low	126 Å²	126	131.4 Å²	131.4	82%	0.818	77%	0.772	S	S	*	*			trans	-107.6	168.5	-148	41.7	-35.1	0	0	0	116.2
70	S	36.7	Very low	41.5	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	78%	0.784	S	S	*	*			trans	-133.5	106.7	161	52.9	0	0	0	0	107.7
71	Q	39.6	Very low	40.1	Very low	177 Å²	177	137 Å²	137	83%	0.827	80%	0.804	S	S	*	*				50.2	104.1	92.9	-66.3	-158.3	-18.3	0	0	113.7
72	D	39	Very low	39.1	Very low	166 Å²	166	143.4 Å²	143.4	89%	0.888	81%	0.814	S	S	*	*				-161.6	141.8	120	-95.9	-32.3	0	0	0	112.6
73	S	41.5	Very low	38.8	Very low	111 Å²	111	146.7 Å²	146.7	78%	0.776	82%	0.821	S	S	*	*			trans	-97.6	-150.8	-162.1	-56.8	0	0	0	0	112.9
74	P	45.2	Very low	38.6	Very low	113 Å²	113	150.6 Å²	150.6	73%	0.734	82%	0.824	S	S	*	*				-133.5	-174.7	-101.8	43.7	-24.2	0	0	0	113.8
75	S	38.1	Very low	38.5	Very low	118 Å²	118	152.3 Å²	152.3	83%	0.825	83%	0.826	S	S	*	*			trans	-167	99.9	154.3	-137.3	0	0	0	0	110
76	T	41.8	Very low	38.6	Very low	129 Å²	129	152.9 Å²	152.9	79%	0.791	83%	0.831	S	S	*	*				69.5	103.5	78.8	-45.2	0	0	0	0	115.8
77	A	36.5	Very low	38.7	Very low	95 Å²	95	149 Å²	149	79%	0.785	83%	0.828	S	S	*	*			trans	-175.3	150.6	144.9	0	0	0	0	0	111.7
78	P	40.9	Very low	38.8	Very low	131 Å²	131	148.4 Å²	148.4	85%	0.851	83%	0.828	S	S	*	*				-124.4	-174.1	-123.2	42.2	-30.7	0	0	0	118.3
79	V	36.1	Very low	39.2	Very low	118 Å²	118	148.8 Å²	148.8	72%	0.715	82%	0.823	S	S	*	*			trans	-81.8	145	-166	172	0	0	0	0	116
80	F	40.6	Very low	39.5	Very low	202 Å²	202	146 Å²	146	89%	0.886	82%	0.817	S	S	*	*			trans	-161.4	125.5	144.9	-82.8	-75.5	0	0	0	105.6
81	L	38.5	Very low	40.4	Very low	165 Å²	165	144 Å²	144	86%	0.864	80%	0.804	S	S	*	*			cis	-151.3	128.8	40.6	-76	154.6	0	0	0	110
82	R	37.1	Very low	41.4	Very low	232 Å²	232	143.3 Å²	143.3	88%	0.875	80%	0.798	S	S	*	*			trans	-94.7	146.5	159	-95	-178.1	165.8	165	-3.7	108.1
83	Q	42.6	Very low	42.8	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	76%	0.764	S	S	*	*				157.6	116.7	124.9	-85.9	173	-0.7	0	0	113.3
84	R	36.6	Very low	44.2	Very low	249 Å²	249	137.1 Å²	137.1	94%	0.94	76%	0.76	S	S	*	*			trans	-179.3	86.9	138.4	-103.5	178.5	-179.3	160.6	1.4	106.5
85	N	36.3	Very low	45.3	Very low	163 Å²	163	133.5 Å²	133.5	87%	0.872	74%	0.744	S	S	*	*				67.6	135.2	79.2	-107.6	2.4	0	0	0	116.8
86	A	40.1	Very low	47.2	Very low	105 Å²	105	132.9 Å²	132.9	87%	0.868	74%	0.739	S	S	*	*			trans	77.7	122.4	171.8	0	0	0	0	0	115.8
87	G	37.7	Very low	49	Very low	75 Å²	75	128.9 Å²	128.9	77%	0.773	72%	0.716	S	S	*	*			cis	153.7	111.6	6.9	0	0	0	0	0	106.9
88	Y	37.7	Very low	50.7	Low	232 Å²	232	127.9 Å²	127.9	91%	0.91	70%	0.702	S	S	*	*			trans	-162.3	149.5	167	-157.7	-108	0	0	0	111.4
89	D	45.5	Very low	51.9	Low	122 Å²	122	128 Å²	128	65%	0.652	70%	0.702	S	S	*	*			trans	-43.6	136	-161.6	-169.4	15.8	0	0	0	118.6	S91	D89-S91 PolarHBondContact O-N 2.85Å
90	G	42.6	Very low	53	Low	67 Å²	67	125.6 Å²	125.6	69%	0.691	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	55.6	-158.8	0	0	0	0	0	116.6
91	S	54.3	Low	53.4	Low	71 Å²	71	122 Å²	122	50%	0.497	69%	0.685	S	S	.	*	T	Hydrogen-bonded Turn	trans	-150.9	-3.1	165.9	57.5	0	0	0	0	116.7	D89	D89-S91 PolarHBondContact O-N 2.85Å
92	K	61.8	Low	53.7	Low	161 Å²	161	120.9 Å²	120.9	70%	0.7	68%	0.68	S	S	*	*			trans	-140.6	130.5	-179.2	-71.5	179.5	179.2	176.5	0	110.4	D115	K92-D115 WeakPolarHBondContact CA-OD2 3.16Å
93	K	68.2	Low	54.2	Low	40 Å²	40	118.1 Å²	118.1	17%	0.174	68%	0.677	C	S	.	*			trans	-65.5	143.5	167.3	-84.1	-178.1	-163.2	171	0	109.8	D115 C118 Q119 S120 W122 K123	K93-D115 HydrophobicContact CB-CB 4.06Å; K93-D115 HydrophobicContact CD-CB 4.31Å; K93-D115 VanDerWaalsContact CE-O 3.28Å; K93-D115 WeakPolarHBondContact CE-O 3.37Å; K93-D115 HydrophobicContact CG-CB 4.05Å; K93-D115 PolarHBondContact N-OD2 3.44Å; K93-D115 PolarHBondContact NZ-O 3.27Å; K93-C118 PolarHBondContact NZ-O 3.13Å; K93-Q119 PolarHBondContact NZ-O 2.76Å; K93-S120 WeakPolarHBondContact CD-O 3.03Å; K93-S120 WeakPolarHBondContact CE-O 3.45Å; K93-S120 PolarHBondContact NZ-O 2.9Å; K93-W122 VanDerWaalsContact CD-O 3.25Å; K93-W122 WeakPolarHBondContact CD-O 3.42Å; K93-W122 PolarHBondContact NZ-O 2.91Å; K93-K123 HydrophobicContact CB-CG 3.89Å; K93-K123 PolarHBondContact O-NZ 2.97Å
94	P	70.4	Confident	54	Low	107 Å²	107	114.1 Å²	114.1	70%	0.695	68%	0.675	S	S	*	*	S	Bend	trans	-57.1	140.6	172.8	-19.7	30.6	0	0	0	111.5	I136	P94-I136 WeakPolarHBondContact O-CD1 3.39Å
95	G	67.7	Low	54.3	Low	38 Å²	38	108.9 Å²	108.9	39%	0.392	67%	0.671	S	S	.	*	S	Bend	trans	118.4	165.6	178.5	0	0	0	0	0	114.6	K123	G95-K123 WeakPolarHBondContact O-CD 3.47Å; G95-K123 WeakPolarHBondContact O-CE 3.08Å
96	S	78.6	Confident	54.7	Low	105 Å²	105	105.4 Å²	105.4	73%	0.734	66%	0.664	S	S	*	*			trans	-116.1	138.7	-178.4	-61.6	0	0	0	0	112.5	I136	S96-I136 VanDerWaalsContact N-CG2 3.29Å; S96-I136 WeakPolarHBondContact O-CG2 3.43Å
97	C	78.5	Confident	55.1	Low	45 Å²	45	107.3 Å²	107.3	30%	0.304	67%	0.666	S	S	.	*	P	Polyproline II helix	trans	-67.2	143.9	172.1	-66.6	0	0	0	0	111.3	C125	C97-C125 VanDerWaalsContact CA-SG 3.5Å; C97-C125 HydrophobicContact CB-CB 3.66Å; C97-C125 WeakPolarHBondContact CB-SG 3.43Å; C97-C125 WeakPolarHBondContact SG-CA 3.27Å; C97-C125 WeakPolarHBondContact SG-CB 3.37Å; C97-C125 CovalentContact SG-SG 2.03Å; C97-C125 PolarHBondContact SG-SG 3.39Å
98	P	72	Confident	55.6	Low	74 Å²	74	106.8 Å²	106.8	48%	0.481	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-64	148.2	173.5	26.2	-32.2	0	0	0	111	S100 I134	P98-S100 PolarHBondContact O-N 2.96Å; P98-I134 HydrophobicContact CG-CD1 4.16Å; P98-I134 HydrophobicContact CG-CG2 4.28Å
99	P	66.6	Low	56.4	Low	132 Å²	132	98.6 Å²	98.6	86%	0.857	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-66.9	121.8	-176.7	25.6	-32.5	0	0	0	111.6
100	S	59.2	Low	57.4	Low	69 Å²	69	97.5 Å²	97.5	48%	0.483	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-82.2	122.2	171.5	52.6	0	0	0	0	110.3	P98	P98-S100 PolarHBondContact O-N 2.96Å
101	V	48.6	Very low	58.8	Low	127 Å²	127	97.5 Å²	97.5	77%	0.77	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-76.1	132.3	167.6	-92.3	0	0	0	0	110.1
102	D	46.2	Very low	60.1	Low	141 Å²	141	94.2 Å²	94.2	75%	0.754	60%	0.597	S	S	*	*	S	Bend	trans	-57.7	149.7	-172.2	-66.8	-55.3	0	0	0	114.4
103	H	46.5	Very low	61.1	Low	174 Å²	174	94.3 Å²	94.3	81%	0.806	60%	0.6	S	S	*	*			trans	140.4	88.1	149.5	-75.2	70.2	0	0	0	109.9
104	A	38.5	Very low	61.8	Low	99 Å²	99	95.8 Å²	95.8	82%	0.818	61%	0.61	S	S	*	*			trans	-78.4	119.6	178	0	0	0	0	0	111.2
105	T	43.7	Very low	62.4	Low	140 Å²	140	91.3 Å²	91.3	86%	0.859	58%	0.58	S	S	*	*			trans	-156.2	135.7	156.7	0.9	0	0	0	0	109.8
106	A	43.5	Very low	63	Low	89 Å²	89	96 Å²	96	74%	0.736	59%	0.589	S	S	*	*	S	Bend	trans	89.6	98.5	173.8	0	0	0	0	0	117.3
107	T	48.3	Very low	63.2	Low	146 Å²	146	95.8 Å²	95.8	90%	0.896	58%	0.577	S	S	*	*			trans	38.3	86.7	149.4	40.3	0	0	0	0	116.7	A109	T107-A109 PolarHBondContact O-N 2.88Å
108	A	48.1	Very low	63.4	Low	63 Å²	63	94 Å²	94	52%	0.521	57%	0.565	S	S	.	*			trans	-68.6	122.9	179	0	0	0	0	0	112.6
109	A	56	Low	63.7	Low	61 Å²	61	98.3 Å²	98.3	50%	0.504	58%	0.579	S	S	.	*	B	Isolated β-bridge	trans	-69.5	132	152.5	0	0	0	0	0	107	T107 P111 G130	T107-A109 PolarHBondContact O-N 2.88Å; A109-P111 WeakPolarHBondContact O-CD 3.4Å; A109-G130 WeakPolarHBondContact O-CA 3.33Å
110	T	65	Low	63.9	Low	99 Å²	99	96.5 Å²	96.5	61%	0.607	57%	0.569	S	S	*	*			trans	-107.5	76.8	177.9	32.3	0	0	0	0	110.7	C112	T110-C112 PolarHBondContact O-N 3.4Å
111	P	72.5	Confident	64.7	Low	67 Å²	67	98.7 Å²	98.7	44%	0.435	58%	0.576	S	S	.	*	S	Bend	trans	-62.7	-21.9	178.8	-3.3	-2	0	0	0	115.5	A109 T131 F132	A109-P111 WeakPolarHBondContact O-CD 3.4Å; P111-T131 WeakPolarHBondContact CD-O 3.22Å; P111-T131 WeakPolarHBondContact CG-O 3.5Å; P111-T131 VanDerWaalsContact N-O 3.16Å; P111-F132 HydrophobicContact CB-CD1 4.23Å; P111-F132 HydrophobicContact CB-CE1 4.42Å; P111-F132 HydrophobicContact CG-CB 4.38Å; P111-F132 HydrophobicContact CG-CD1 3.33Å; P111-F132 HydrophobicContact CG-CD2 3.79Å; P111-F132 HydrophobicContact CG-CE1 3.32Å; P111-F132 HydrophobicContact CG-CE2 3.77Å; P111-F132 HydrophobicContact CG-CG 3.58Å; P111-F132 HydrophobicContact CG-CZ 3.54Å
112	C	82.9	Confident	66.2	Low	1 Å²	1	97.3 Å²	97.3	1%	0.007	56%	0.557	C	S	.	*			trans	-149	159.4	172.3	63.3	0	0	0	0	111.5	T110 Q117 C124 T131	T110-C112 PolarHBondContact O-N 3.4Å; C112-Q117 HydrophobicContact CB-CB 4.12Å; C112-C124 HydrophobicContact CB-CB 3.83Å; C112-C124 WeakPolarHBondContact CB-SG 3.41Å; C112-C124 PolarHBondContact O-SG 3.17Å; C112-C124 WeakPolarHBondContact SG-CA 3.46Å; C112-C124 WeakPolarHBondContact SG-CB 3.42Å; C112-C124 CovalentContact SG-SG 2.04Å; C112-C124 PolarHBondContact SG-SG 2.77Å; C112-T131 PolarHBondContact N-O 3.25Å; C112-T131 VanDerWaalsContact N-O 3.12Å; C112-T131 WeakPolarHBondContact O-CB 3.48Å; C112-T131 PolarHBondContact O-OG1 3.49Å; C112-T131 PolarHBondContact SG-O 3.16Å
113	Q	82.2	Confident	68	Low	163 Å²	163	91.5 Å²	91.5	76%	0.762	53%	0.525	S	S	*	.	S	Bend	trans	-119.4	-24.9	173.7	-76.3	162	-52.2	0	0	112.4	Q117	Q113-Q117 VanDerWaalsContact CA-OE1 3.29Å; Q113-Q117 VanDerWaalsContact CB-OE1 3.29Å
114	N	81.6	Confident	70	Confident	72 Å²	72	84.2 Å²	84.2	39%	0.385	49%	0.493	S	S	.	.	S	Bend	trans	-146.7	166.7	175.1	61.9	41.2	0	0	0	111.4	F116 Q117 C124	N114-F116 HydrophobicContact CB-CD2 4.5Å; N114-F116 PolarHBondContact O-N 2.83Å; N114-F116 VanDerWaalsContact O-N 3.11Å; N114-F116 WeakPolarHBondContact OD1-CB 3.35Å; N114-F116 PolarHBondContact OD1-N 3.03Å; N114-F116 VanDerWaalsContact OD1-N 3.11Å; N114-Q117 PolarHBondContact O-N 2.83Å; N114-Q117 VanDerWaalsContact O-N 3.13Å; N114-Q117 PolarHBondContact OD1-N 2.83Å; N114-C124 VanDerWaalsContact C-CB 3.43Å; N114-C124 WeakPolarHBondContact O-CB 3.39Å
115	D	83.3	Confident	72.3	Confident	13 Å²	13	79.6 Å²	79.6	7%	0.07	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-60.1	-22.6	-178.9	-65.5	-16.6	0	0	0	113.4	K92 K93 Q117 C118 K123 C124	K92-D115 WeakPolarHBondContact CA-OD2 3.16Å; K93-D115 HydrophobicContact CB-CB 4.06Å; K93-D115 HydrophobicContact CD-CB 4.31Å; K93-D115 VanDerWaalsContact CE-O 3.28Å; K93-D115 WeakPolarHBondContact CE-O 3.37Å; K93-D115 HydrophobicContact CG-CB 4.05Å; K93-D115 PolarHBondContact N-OD2 3.44Å; K93-D115 PolarHBondContact NZ-O 3.27Å; D115-Q117 VanDerWaalsContact C-N 3.32Å; D115-C118 WeakPolarHBondContact O-CB 3.31Å; D115-C118 PolarHBondContact O-N 2.73Å; D115-K123 WeakPolarHBondContact OD1-CA 3.37Å; D115-K123 WeakPolarHBondContact OD1-CB 3.36Å; D115-K123 WeakPolarHBondContact OD1-CG 3.29Å; D115-K123 IonicContact OD1-NZ 3.13Å; D115-K123 IonicContact OD2-NZ 3.23Å; D115-K123 PolarHBondContact OD2-NZ 2.67Å; D115-C124 PolarHBondContact OD1-N 3.11Å
116	F	81.2	Confident	74.1	Confident	135 Å²	135	76.6 Å²	76.6	59%	0.592	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-75.3	-20.1	-179.6	-58	-78.2	0	0	0	113.1	N114	N114-F116 HydrophobicContact CB-CD2 4.5Å; N114-F116 PolarHBondContact O-N 2.83Å; N114-F116 VanDerWaalsContact O-N 3.11Å; N114-F116 WeakPolarHBondContact OD1-CB 3.35Å; N114-F116 PolarHBondContact OD1-N 3.03Å; N114-F116 VanDerWaalsContact OD1-N 3.11Å
117	Q	82.2	Confident	75.5	Confident	101 Å²	101	74.5 Å²	74.5	47%	0.472	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-78.2	-12.5	171.3	-76.9	162.7	-48.4	0	0	112.6	C112 Q113 N114 D115	C112-Q117 HydrophobicContact CB-CB 4.12Å; Q113-Q117 VanDerWaalsContact CA-OE1 3.29Å; Q113-Q117 VanDerWaalsContact CB-OE1 3.29Å; N114-Q117 PolarHBondContact O-N 2.83Å; N114-Q117 VanDerWaalsContact O-N 3.13Å; N114-Q117 PolarHBondContact OD1-N 2.83Å; D115-Q117 VanDerWaalsContact C-N 3.32Å
118	C	83.3	Confident	76.7	Confident	7 Å²	7	73 Å²	73	5%	0.047	41%	0.406	C	S	.	.	S	Bend	trans	-93.9	136.4	177.7	-58.4	0	0	0	0	110.5	K93 D115 W122 C133	K93-C118 PolarHBondContact NZ-O 3.13Å; D115-C118 WeakPolarHBondContact O-CB 3.31Å; D115-C118 PolarHBondContact O-N 2.73Å; C118-W122 HydrophobicContact CB-CB 3.76Å; C118-W122 WeakPolarHBondContact CB-O 3.46Å; C118-C133 WeakPolarHBondContact CA-SG 3.23Å; C118-C133 HydrophobicContact CB-CB 3.63Å; C118-C133 WeakPolarHBondContact CB-SG 3.43Å; C118-C133 WeakPolarHBondContact SG-CA 3.44Å; C118-C133 WeakPolarHBondContact SG-CB 3.35Å; C118-C133 CovalentContact SG-SG 2.03Å; C118-C133 PolarHBondContact SG-SG 3.49Å
119	Q	77.5	Confident	77.5	Confident	165 Å²	165	73.2 Å²	73.2	77%	0.771	40%	0.404	S	S	*	.			trans	-69.7	151.3	176.6	-83	-179.7	-9	0	0	111.9	K93 D121 W122	K93-Q119 PolarHBondContact NZ-O 2.76Å; Q119-D121 PolarHBondContact O-N 3.47Å; Q119-W122 VanDerWaalsContact O-CB 3.3Å; Q119-W122 WeakPolarHBondContact O-CB 3.01Å; Q119-W122 PolarHBondContact O-N 2.79Å
120	S	71.5	Confident	78.2	Confident	94 Å²	94	71 Å²	71	66%	0.657	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	-120.6	166.9	-50.6	0	0	0	0	115.2	K93	K93-S120 WeakPolarHBondContact CD-O 3.03Å; K93-S120 WeakPolarHBondContact CE-O 3.45Å; K93-S120 PolarHBondContact NZ-O 2.9Å
121	D	75.3	Confident	79.1	Confident	116 Å²	116	68 Å²	68	62%	0.62	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	22.9	-177.6	-57	-44.5	0	0	0	113	Q119 I136	Q119-D121 PolarHBondContact O-N 3.47Å; D121-I136 WeakPolarHBondContact O-CD1 3.45Å; D121-I136 VanDerWaalsContact O-CG1 3.27Å; D121-I136 WeakPolarHBondContact O-CG1 3.34Å
122	W	81.6	Confident	79.6	Confident	98 Å²	98	68.4 Å²	68.4	37%	0.371	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	133.3	-179.3	-63.1	62.7	0	0	0	110.6	K93 C118 Q119 C133 I134 E135	K93-W122 VanDerWaalsContact CD-O 3.25Å; K93-W122 WeakPolarHBondContact CD-O 3.42Å; K93-W122 PolarHBondContact NZ-O 2.91Å; C118-W122 HydrophobicContact CB-CB 3.76Å; C118-W122 WeakPolarHBondContact CB-O 3.46Å; Q119-W122 VanDerWaalsContact O-CB 3.3Å; Q119-W122 WeakPolarHBondContact O-CB 3.01Å; Q119-W122 PolarHBondContact O-N 2.79Å; W122-C133 HydrophobicContact CB-CB 4.25Å; W122-C133 HydrophobicContact CE3-CB 4.25Å; W122-C133 VanDerWaalsContact CE3-O 3.24Å; W122-C133 WeakPolarHBondContact CZ3-O 3.14Å; W122-I134 CarbonylContact C-O 3.48Å; W122-I134 WeakPolarHBondContact CA-O 3.26Å; W122-I134 VanDerWaalsContact CE3-C 3.46Å; W122-E135 HydrophobicContact CD2-CB 4.02Å; W122-E135 HydrophobicContact CE3-CB 4.17Å; W122-E135 HydrophobicContact CH2-CB 4.09Å; W122-E135 HydrophobicContact CZ2-CB 3.94Å; W122-E135 HydrophobicContact CZ3-CB 4.21Å
123	K	83.3	Confident	79.7	Confident	19 Å²	19	70.2 Å²	70.2	8%	0.083	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	150.7	173.6	-86.7	171.9	83.4	71.6	0	111.2	K93 G95 D115 C125 C133 I134 I136	K93-K123 HydrophobicContact CB-CG 3.89Å; K93-K123 PolarHBondContact O-NZ 2.97Å; G95-K123 WeakPolarHBondContact O-CD 3.47Å; G95-K123 WeakPolarHBondContact O-CE 3.08Å; D115-K123 WeakPolarHBondContact OD1-CA 3.37Å; D115-K123 WeakPolarHBondContact OD1-CB 3.36Å; D115-K123 WeakPolarHBondContact OD1-CG 3.29Å; D115-K123 IonicContact OD1-NZ 3.13Å; D115-K123 IonicContact OD2-NZ 3.23Å; D115-K123 PolarHBondContact OD2-NZ 2.67Å; K123-C125 PolarHBondContact O-N 3.07Å; K123-C133 CarbonylContact O-C 3.46Å; K123-C133 WeakPolarHBondContact O-CA 3.36Å; K123-I134 PolarHBondContact N-O 2.03Å; K123-I134 PolarHBondContact O-N 2.88Å; K123-I136 HydrophobicContact CB-CD1 3.91Å; K123-I136 HydrophobicContact CB-CG1 3.79Å; K123-I136 HydrophobicContact CD-CD1 3.36Å; K123-I136 HydrophobicContact CD-CG1 3.72Å; K123-I136 HydrophobicContact CD-CG2 4.41Å; K123-I136 HydrophobicContact CG-CD1 3.28Å; K123-I136 HydrophobicContact CG-CG1 3.71Å
124	C	88.1	Confident	79.7	Confident	20 Å²	20	64.6 Å²	64.6	14%	0.135	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	107.7	172.1	-171.4	0	0	0	0	109.4	C112 N114 D115	C112-C124 HydrophobicContact CB-CB 3.83Å; C112-C124 WeakPolarHBondContact CB-SG 3.41Å; C112-C124 PolarHBondContact O-SG 3.17Å; C112-C124 WeakPolarHBondContact SG-CA 3.46Å; C112-C124 WeakPolarHBondContact SG-CB 3.42Å; C112-C124 CovalentContact SG-SG 2.04Å; C112-C124 PolarHBondContact SG-SG 2.77Å; N114-C124 VanDerWaalsContact C-CB 3.43Å; N114-C124 WeakPolarHBondContact O-CB 3.39Å; D115-C124 PolarHBondContact OD1-N 3.11Å
125	C	86.2	Confident	79.5	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.014	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.5	-172.3	-65.8	0	0	0	0	111.2	C97 K123 T131 F132 I134	C97-C125 VanDerWaalsContact CA-SG 3.5Å; C97-C125 HydrophobicContact CB-CB 3.66Å; C97-C125 WeakPolarHBondContact CB-SG 3.43Å; C97-C125 WeakPolarHBondContact SG-CA 3.27Å; C97-C125 WeakPolarHBondContact SG-CB 3.37Å; C97-C125 CovalentContact SG-SG 2.03Å; C97-C125 PolarHBondContact SG-SG 3.39Å; K123-C125 PolarHBondContact O-N 3.07Å; C125-T131 WeakPolarHBondContact O-CA 2.99Å; C125-F132 PolarHBondContact N-O 3.3Å; C125-F132 PolarHBondContact O-N 2.84Å; C125-I134 HydrophobicContact CB-CB 4.22Å; C125-I134 HydrophobicContact CB-CD1 3.47Å; C125-I134 VanDerWaalsContact CB-CD1 3.47Å; C125-I134 HydrophobicContact CB-CG1 3.84Å
126	P	82	Confident	78.7	Confident	77 Å²	77	66.5 Å²	66.5	50%	0.5	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	133.3	172.3	29.3	-32.3	0	0	0	110.4
127	T	74.1	Confident	77.6	Confident	46 Å²	46	67 Å²	67	28%	0.282	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	169.5	171.9	73.7	0	0	0	0	109.3	S129 G130 F132 I134	T127-S129 PolarHBondContact O-N 3.34Å; T127-S129 PolarHBondContact OG1-N 3.02Å; T127-G130 PolarHBondContact N-O 2.95Å; T127-G130 PolarHBondContact O-N 2.79Å; T127-G130 VanDerWaalsContact O-N 3.17Å; T127-G130 PolarHBondContact OG1-O 3.31Å; T127-G130 VanDerWaalsContact OG1-O 3.13Å; T127-F132 HydrophobicContact CG2-CB 4.08Å; T127-F132 HydrophobicContact CG2-CD2 4.11Å; T127-F132 HydrophobicContact CG2-CG 4.44Å; T127-F132 WeakPolarHBondContact OG1-CD2 3.03Å; T127-I134 HydrophobicContact CG2-CD1 3.76Å
128	V	72	Confident	76	Confident	113 Å²	113	66.4 Å²	66.4	69%	0.685	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-13.9	173.3	-65.2	0	0	0	0	113.7
129	S	65.2	Low	74	Confident	69 Å²	69	71.5 Å²	71.5	48%	0.483	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	6	-177.8	-53.1	0	0	0	0	114	T127	T127-S129 PolarHBondContact O-N 3.34Å; T127-S129 PolarHBondContact OG1-N 3.02Å
130	G	71.7	Confident	72.3	Confident	14 Å²	14	69.3 Å²	69.3	14%	0.144	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.5	-152.1	-176.1	0	0	0	0	0	112.7	A109 T127	A109-G130 WeakPolarHBondContact O-CA 3.33Å; T127-G130 PolarHBondContact N-O 2.95Å; T127-G130 PolarHBondContact O-N 2.79Å; T127-G130 VanDerWaalsContact O-N 3.17Å; T127-G130 PolarHBondContact OG1-O 3.31Å; T127-G130 VanDerWaalsContact OG1-O 3.13Å
131	T	83.3	Confident	70.7	Confident	37 Å²	37	68.3 Å²	68.3	23%	0.227	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	113.2	-177.4	43.2	0	0	0	0	111.3	P111 C112 C125	P111-T131 WeakPolarHBondContact CD-O 3.22Å; P111-T131 WeakPolarHBondContact CG-O 3.5Å; P111-T131 VanDerWaalsContact N-O 3.16Å; C112-T131 PolarHBondContact N-O 3.25Å; C112-T131 VanDerWaalsContact N-O 3.12Å; C112-T131 WeakPolarHBondContact O-CB 3.48Å; C112-T131 PolarHBondContact O-OG1 3.49Å; C112-T131 PolarHBondContact SG-O 3.16Å; C125-T131 WeakPolarHBondContact O-CA 2.99Å
132	F	82.9	Confident	68.8	Low	75 Å²	75	72.3 Å²	72.3	33%	0.329	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	148.8	-176.7	-73.3	-102.7	0	0	0	111.1	P111 C125 T127 I134	P111-F132 HydrophobicContact CB-CD1 4.23Å; P111-F132 HydrophobicContact CB-CE1 4.42Å; P111-F132 HydrophobicContact CG-CB 4.38Å; P111-F132 HydrophobicContact CG-CD1 3.33Å; P111-F132 HydrophobicContact CG-CD2 3.79Å; P111-F132 HydrophobicContact CG-CE1 3.32Å; P111-F132 HydrophobicContact CG-CE2 3.77Å; P111-F132 HydrophobicContact CG-CG 3.58Å; P111-F132 HydrophobicContact CG-CZ 3.54Å; C125-F132 PolarHBondContact N-O 3.3Å; C125-F132 PolarHBondContact O-N 2.84Å; T127-F132 HydrophobicContact CG2-CB 4.08Å; T127-F132 HydrophobicContact CG2-CD2 4.11Å; T127-F132 HydrophobicContact CG2-CG 4.44Å; T127-F132 WeakPolarHBondContact OG1-CD2 3.03Å; F132-I134 PolarHBondContact O-N 2.91Å
133	C	86.2	Confident	66.6	Low	39 Å²	39	73.9 Å²	73.9	26%	0.264	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	121.5	167.4	-65.1	0	0	0	0	108.8	C118 W122 K123	C118-C133 WeakPolarHBondContact CA-SG 3.23Å; C118-C133 HydrophobicContact CB-CB 3.63Å; C118-C133 WeakPolarHBondContact CB-SG 3.43Å; C118-C133 WeakPolarHBondContact SG-CA 3.44Å; C118-C133 WeakPolarHBondContact SG-CB 3.35Å; C118-C133 CovalentContact SG-SG 2.03Å; C118-C133 PolarHBondContact SG-SG 3.49Å; W122-C133 HydrophobicContact CB-CB 4.25Å; W122-C133 HydrophobicContact CE3-CB 4.25Å; W122-C133 VanDerWaalsContact CE3-O 3.24Å; W122-C133 WeakPolarHBondContact CZ3-O 3.14Å; K123-C133 CarbonylContact O-C 3.46Å; K123-C133 WeakPolarHBondContact O-CA 3.36Å
134	I	82	Confident	64.2	Low	44 Å²	44	81.9 Å²	81.9	23%	0.226	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.8	178.9	-53.1	-177.9	0	0	0	109.1	P98 W122 K123 C125 T127 F132	P98-I134 HydrophobicContact CG-CD1 4.16Å; P98-I134 HydrophobicContact CG-CG2 4.28Å; W122-I134 CarbonylContact C-O 3.48Å; W122-I134 WeakPolarHBondContact CA-O 3.26Å; W122-I134 VanDerWaalsContact CE3-C 3.46Å; K123-I134 PolarHBondContact N-O 2.03Å; K123-I134 PolarHBondContact O-N 2.88Å; C125-I134 HydrophobicContact CB-CB 4.22Å; C125-I134 HydrophobicContact CB-CD1 3.47Å; C125-I134 VanDerWaalsContact CB-CD1 3.47Å; C125-I134 HydrophobicContact CB-CG1 3.84Å; T127-I134 HydrophobicContact CG2-CD1 3.76Å; F132-I134 PolarHBondContact O-N 2.91Å
135	E	77.5	Confident	61.7	Low	108 Å²	108	88.2 Å²	88.2	51%	0.505	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	134	175.2	-172.7	174.5	-147.1	0	0	110.8	W122	W122-E135 HydrophobicContact CD2-CB 4.02Å; W122-E135 HydrophobicContact CE3-CB 4.17Å; W122-E135 HydrophobicContact CH2-CB 4.09Å; W122-E135 HydrophobicContact CZ2-CB 3.94Å; W122-E135 HydrophobicContact CZ3-CB 4.21Å
136	I	65.9	Low	59.4	Low	18 Å²	18	96.4 Å²	96.4	9%	0.092	55%	0.546	C	S	.	.			trans	-111.1	120.5	-175.1	-16.8	132.9	0	0	0	109.1	P94 S96 D121 K123 S138	P94-I136 WeakPolarHBondContact O-CD1 3.39Å; S96-I136 VanDerWaalsContact N-CG2 3.29Å; S96-I136 WeakPolarHBondContact O-CG2 3.43Å; D121-I136 WeakPolarHBondContact O-CD1 3.45Å; D121-I136 VanDerWaalsContact O-CG1 3.27Å; D121-I136 WeakPolarHBondContact O-CG1 3.34Å; K123-I136 HydrophobicContact CB-CD1 3.91Å; K123-I136 HydrophobicContact CB-CG1 3.79Å; K123-I136 HydrophobicContact CD-CD1 3.36Å; K123-I136 HydrophobicContact CD-CG1 3.72Å; K123-I136 HydrophobicContact CD-CG2 4.41Å; K123-I136 HydrophobicContact CG-CD1 3.28Å; K123-I136 HydrophobicContact CG-CG1 3.71Å; I136-S138 PolarHBondContact O-N 3.02Å; I136-S138 VanDerWaalsContact O-N 3.15Å
137	V	57.1	Low	57.2	Low	146 Å²	146	99.8 Å²	99.8	89%	0.885	56%	0.56	S	S	*	*			trans	-80.4	99.9	-179.9	-142.8	0	0	0	0	108.9
138	S	48.7	Very low	55.5	Low	87 Å²	87	101.6 Å²	101.6	61%	0.608	57%	0.572	S	S	*	*			trans	-80	116.7	176.1	-56.2	0	0	0	0	110.4	I136 S140	I136-S138 PolarHBondContact O-N 3.02Å; I136-S138 VanDerWaalsContact O-N 3.15Å; S138-S140 PolarHBondContact O-N 3.33Å
139	S	41.9	Very low	53.9	Low	115 Å²	115	104.4 Å²	104.4	80%	0.804	58%	0.578	S	S	*	*			trans	-83.3	98.3	178.5	52	0	0	0	0	112.1
140	S	41.6	Very low	53	Low	118 Å²	118	104.8 Å²	104.8	83%	0.825	57%	0.574	S	S	*	*			trans	176.8	118.6	146.2	29.2	0	0	0	0	113.5	S138	S138-S140 PolarHBondContact O-N 3.33Å
141	G	37.7	Very low	51.7	Low	73 Å²	73	109.8 Å²	109.8	75%	0.753	60%	0.597	S	S	*	*			trans	73.7	104.2	141.1	0	0	0	0	0	120.2
142	K	36.8	Very low	50.3	Low	201 Å²	201	112.1 Å²	112.1	87%	0.874	61%	0.611	S	S	*	*			trans	68.1	121.8	147.3	-59.8	179	-179.2	171.6	0	117.7
143	T	35.2	Very low	49.5	Very low	130 Å²	130	113.6 Å²	113.6	80%	0.798	62%	0.62	S	S	*	*			trans	90.9	112.5	159.5	72	0	0	0	0	118
144	K	31.3	Very low	49.2	Very low	187 Å²	187	111.7 Å²	111.7	81%	0.813	61%	0.607	S	S	*	*			trans	50.9	137.7	136.4	-61.5	-179.3	177.7	178.5	0	119.2
145	H	36.5	Very low	49.3	Very low	153 Å²	153	114.2 Å²	114.2	71%	0.708	62%	0.62	S	S	*	*			trans	85.8	143.5	176.3	-63	-86.9	0	0	0	113.5
146	R	37	Very low	49.6	Very low	175 Å²	175	112.6 Å²	112.6	66%	0.66	62%	0.618	S	S	*	*			cis	-168.9	123.7	-2.4	-114.1	163.8	177.9	165.4	-2	103.7
147	N	37	Very low	50.4	Low	148 Å²	148	115.1 Å²	115.1	79%	0.791	63%	0.631	S	S	*	*			trans	-90.5	123.2	163.4	-168.8	3.7	0	0	0	107	E149	N147-E149 PolarHBondContact O-N 3.18Å; N147-E149 VanDerWaalsContact O-N 3.17Å
148	P	37.5	Very low	51.7	Low	84 Å²	84	115.6 Å²	115.6	55%	0.545	63%	0.629	S	S	.	*	S	Bend	trans	-91.7	72.8	-167.6	37.2	-33.1	0	0	0	111.4
149	E	39.2	Very low	53.2	Low	171 Å²	171	116.2 Å²	116.2	80%	0.799	62%	0.622	S	S	*	*			trans	-111.5	62.2	148.5	-79.9	-172.9	137.5	0	0	107.2	N147 L151	N147-E149 PolarHBondContact O-N 3.18Å; N147-E149 VanDerWaalsContact O-N 3.17Å; E149-L151 PolarHBondContact O-N 2.98Å
150	L	46.3	Very low	55.1	Low	77 Å²	77	111.1 Å²	111.1	40%	0.403	59%	0.587	S	S	.	*			trans	-68.6	94.1	162.7	-106.4	81.9	0	0	0	105.8	V152 R171 G172	L150-V152 VanDerWaalsContact C-N 3.3Å; L150-V152 PolarHBondContact O-N 3.43Å; L150-R171 VanDerWaalsContact CG-C 3.45Å; L150-R171 WeakPolarHBondContact CG-O 3.38Å; L150-G172 VanDerWaalsContact CD2-N 3.34Å
151	L	45.3	Very low	56.8	Low	119 Å²	119	112.9 Å²	112.9	62%	0.623	58%	0.582	S	S	*	*			trans	-50.9	100.3	164.1	-89.2	92.7	0	0	0	107.5	E149 M153	E149-L151 PolarHBondContact O-N 2.98Å; L151-M153 VanDerWaalsContact C-N 3.26Å; L151-M153 HydrophobicContact CB-CG 4Å; L151-M153 HydrophobicContact CD2-CG 4.15Å; L151-M153 HydrophobicContact CD2-SD 4.44Å; L151-M153 PolarHBondContact O-N 3.3Å; L151-M153 VanDerWaalsContact O-N 3.1Å
152	V	53.5	Low	58.2	Low	86 Å²	86	115.4 Å²	115.4	52%	0.521	59%	0.585	S	S	.	*			trans	-73.4	92.6	160.5	178.6	0	0	0	0	104.2	L150 C154 I155 R173	L150-V152 VanDerWaalsContact C-N 3.3Å; L150-V152 PolarHBondContact O-N 3.43Å; V152-C154 VanDerWaalsContact C-N 3.25Å; V152-C154 WeakPolarHBondContact CG1-O 3.34Å; V152-I155 HydrophobicContact CG1-CG1 3.81Å; V152-R173 HydrophobicContact CG1-CB 4.21Å
153	M	66.4	Low	59.8	Low	106 Å²	106	110 Å²	110	52%	0.522	57%	0.57	S	S	.	*			trans	-79.6	-12.3	176.8	-63.8	-162.7	-73.9	0	0	112.2	L151 R173 V174	L151-M153 VanDerWaalsContact C-N 3.26Å; L151-M153 HydrophobicContact CB-CG 4Å; L151-M153 HydrophobicContact CD2-CG 4.15Å; L151-M153 HydrophobicContact CD2-SD 4.44Å; L151-M153 PolarHBondContact O-N 3.3Å; L151-M153 VanDerWaalsContact O-N 3.1Å; M153-R173 PolarHBondContact N-O 3.17Å; M153-V174 HydrophobicContact CE-CB 3.5Å; M153-V174 HydrophobicContact CE-CG1 3.39Å
154	C	79.6	Confident	62	Low	0 Å²	0	106.2 Å²	106.2	0%	0	55%	0.545	C	S	.	.			trans	-158.3	155.1	176.1	60.3	0	0	0	0	110.4	V152 E159 C160 C166 R173 C175	V152-C154 VanDerWaalsContact C-N 3.25Å; V152-C154 WeakPolarHBondContact CG1-O 3.34Å; C154-E159 VanDerWaalsContact CA-OE2 3.3Å; C154-E159 WeakPolarHBondContact CA-OE2 3.46Å; C154-E159 HydrophobicContact CB-CB 4.21Å; C154-C160 VanDerWaalsContact CB-SG 3.54Å; C154-C166 HydrophobicContact CB-CB 3.63Å; C154-C166 WeakPolarHBondContact CB-SG 3.16Å; C154-C166 PolarHBondContact O-SG 2.77Å; C154-C166 WeakPolarHBondContact SG-CA 3.41Å; C154-C166 WeakPolarHBondContact SG-CB 3.38Å; C154-C166 CovalentContact SG-SG 2.04Å; C154-C166 PolarHBondContact SG-SG 2.95Å; C154-R173 WeakPolarHBondContact O-CB 3.33Å; C154-R173 VanDerWaalsContact O-CD 3.22Å; C154-R173 WeakPolarHBondContact O-CD 3.48Å; C154-C175 WeakPolarHBondContact CB-SG 3.16Å; C154-C175 PolarHBondContact SG-N 2.9Å
155	I	82.5	Confident	64.3	Low	97 Å²	97	102.1 Å²	102.1	50%	0.497	53%	0.527	S	S	.	.	S	Bend	trans	-116.9	-40.1	176	-58.5	177.4	0	0	0	109.5	V152 E159 R173	V152-I155 HydrophobicContact CG1-CG1 3.81Å; I155-E159 PolarHBondContact N-OE2 3.45Å; I155-R173 VanDerWaalsContact CG2-NH1 3.33Å; I155-R173 PolarHBondContact O-NH1 3.25Å
156	V	84.9	Confident	66.6	Low	74 Å²	74	96 Å²	96	45%	0.448	50%	0.501	S	S	.	.	S	Bend	trans	-128.1	162.9	176.4	-65	0	0	0	0	110.6	D158 E159	V156-D158 HydrophobicContact CG2-CB 4.35Å; V156-D158 PolarHBondContact O-N 3.22Å; V156-E159 HydrophobicContact CG2-CG 3.78Å; V156-E159 WeakPolarHBondContact O-CB 3.19Å; V156-E159 PolarHBondContact O-N 2.88Å; V156-E159 VanDerWaalsContact O-N 3.17Å
157	D	83.2	Confident	68.8	Low	70 Å²	70	89.8 Å²	89.8	37%	0.374	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-61.3	-31.1	-178.7	-75.7	-11.9	0	0	0	112.7	E159 C160 K165 C166	D157-E159 PolarHBondContact O-N 3.49Å; D157-C160 WeakPolarHBondContact O-CB 3.34Å; D157-C160 PolarHBondContact O-N 2.89Å; D157-K165 WeakPolarHBondContact OD1-CB 2.95Å; D157-C166 PolarHBondContact OD1-N 3.22Å
158	D	83.1	Confident	70.7	Confident	156 Å²	156	89.4 Å²	89.4	83%	0.834	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-68.9	-13	179.4	-59.4	-28.6	0	0	0	113.4	V156 C160	V156-D158 HydrophobicContact CG2-CB 4.35Å; V156-D158 PolarHBondContact O-N 3.22Å; D158-C160 VanDerWaalsContact C-N 3.26Å
159	E	80.9	Confident	72.1	Confident	101 Å²	101	88.1 Å²	88.1	47%	0.472	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-83.4	-4.8	172.1	-66.1	177.2	-168.2	0	0	112.5	C154 I155 V156 D157	C154-E159 VanDerWaalsContact CA-OE2 3.3Å; C154-E159 WeakPolarHBondContact CA-OE2 3.46Å; C154-E159 HydrophobicContact CB-CB 4.21Å; I155-E159 PolarHBondContact N-OE2 3.45Å; V156-E159 HydrophobicContact CG2-CG 3.78Å; V156-E159 WeakPolarHBondContact O-CB 3.19Å; V156-E159 PolarHBondContact O-N 2.88Å; V156-E159 VanDerWaalsContact O-N 3.17Å; D157-E159 PolarHBondContact O-N 3.49Å
160	C	81.7	Confident	73.6	Confident	8 Å²	8	91.6 Å²	91.6	5%	0.054	48%	0.479	C	S	.	.	S	Bend	trans	-104.5	135	178.3	-63.4	0	0	0	0	111.2	C154 D157 D158 P162 L164 C175	C154-C160 VanDerWaalsContact CB-SG 3.54Å; D157-C160 WeakPolarHBondContact O-CB 3.34Å; D157-C160 PolarHBondContact O-N 2.89Å; D158-C160 VanDerWaalsContact C-N 3.26Å; C160-P162 WeakPolarHBondContact O-CD 3.45Å; C160-L164 HydrophobicContact CB-CB 3.82Å; C160-L164 WeakPolarHBondContact CB-O 3.38Å; C160-C175 WeakPolarHBondContact CA-SG 3.25Å; C160-C175 HydrophobicContact CB-CB 3.72Å; C160-C175 WeakPolarHBondContact CB-SG 3.47Å; C160-C175 WeakPolarHBondContact SG-CA 2.91Å; C160-C175 WeakPolarHBondContact SG-CB 3.45Å; C160-C175 CovalentContact SG-SG 2.04Å; C160-C175 PolarHBondContact SG-SG 2.02Å
161	E	77	Confident	74.3	Confident	155 Å²	155	97.6 Å²	97.6	72%	0.724	50%	0.497	S	S	*	.			trans	-60.3	127.3	172.1	-85.7	178	163.6	0	0	110.1	L164	E161-L164 WeakPolarHBondContact O-CB 3.37Å; E161-L164 WeakPolarHBondContact O-CG 3.16Å; E161-L164 PolarHBondContact O-N 3.18Å
162	P	67.3	Low	75.5	Confident	125 Å²	125	92.2 Å²	92.2	81%	0.812	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	130.5	173.7	-25	33.8	0	0	0	110.2	C160	C160-P162 WeakPolarHBondContact O-CD 3.45Å
163	P	70.7	Confident	76.8	Confident	88 Å²	88	93 Å²	93	57%	0.571	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	cis	-100	19.2	17.3	39.3	-37.1	0	0	0	115.6	M177 P178	P163-M177 HydrophobicContact CG-CE 4.16Å; P163-P178 VanDerWaalsContact O-CD 3.31Å; P163-P178 WeakPolarHBondContact O-CD 3.32Å
164	L	80.7	Confident	77.6	Confident	51 Å²	51	89.1 Å²	89.1	27%	0.267	45%	0.446	S	S	.	.			trans	-75	150.9	-175.9	-58.3	166.7	0	0	0	111.4	C160 E161 C175 A176 M177	C160-L164 HydrophobicContact CB-CB 3.82Å; C160-L164 WeakPolarHBondContact CB-O 3.38Å; E161-L164 WeakPolarHBondContact O-CB 3.37Å; E161-L164 WeakPolarHBondContact O-CG 3.16Å; E161-L164 PolarHBondContact O-N 3.18Å; L164-C175 HydrophobicContact CB-CB 4.1Å; L164-C175 HydrophobicContact CD1-CB 4.14Å; L164-A176 VanDerWaalsContact CD2-C 3.49Å; L164-M177 HydrophobicContact CD2-CB 4.41Å; L164-M177 HydrophobicContact CD2-CG 3.63Å; L164-M177 VanDerWaalsContact CD2-N 3.32Å
165	K	81.1	Confident	77.7	Confident	101 Å²	101	90.8 Å²	90.8	44%	0.439	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	154.1	172.5	-69.4	-160.8	177.9	-160.7	0	110.2	D157 V167 C175 A176 P178	D157-K165 WeakPolarHBondContact OD1-CB 2.95Å; K165-V167 PolarHBondContact O-N 2.94Å; K165-C175 WeakPolarHBondContact O-CA 3.42Å; K165-A176 PolarHBondContact N-O 3.42Å; K165-A176 PolarHBondContact O-N 2.65Å; K165-P178 HydrophobicContact CD-CB 4.1Å; K165-P178 HydrophobicContact CD-CG 4.28Å; K165-P178 HydrophobicContact CG-CB 4.33Å; K165-P178 HydrophobicContact CG-CG 4.17Å
166	C	83.8	Confident	77.4	Confident	24 Å²	24	87.2 Å²	87.2	16%	0.162	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	107.8	177.5	-169.5	0	0	0	0	110.4	C154 D157	C154-C166 HydrophobicContact CB-CB 3.63Å; C154-C166 WeakPolarHBondContact CB-SG 3.16Å; C154-C166 PolarHBondContact O-SG 2.77Å; C154-C166 WeakPolarHBondContact SG-CA 3.41Å; C154-C166 WeakPolarHBondContact SG-CB 3.38Å; C154-C166 CovalentContact SG-SG 2.04Å; C154-C166 PolarHBondContact SG-SG 2.95Å; D157-C166 PolarHBondContact OD1-N 3.22Å
167	V	83.7	Confident	76.7	Confident	45 Å²	45	86.6 Å²	86.6	27%	0.273	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	149.3	-177.2	-56.5	0	0	0	0	112.1	K165 S169 R173 V174 A176	K165-V167 PolarHBondContact O-N 2.94Å; V167-S169 PolarHBondContact O-N 3.31Å; V167-R173 WeakPolarHBondContact O-CA 3.49Å; V167-V174 HydrophobicContact CG2-CG2 4Å; V167-V174 WeakPolarHBondContact CG2-O 3.22Å; V167-V174 PolarHBondContact N-O 2.95Å; V167-V174 PolarHBondContact O-N 2.96Å; V167-A176 HydrophobicContact CG2-CB 3.36Å
168	N	76.1	Confident	75.5	Confident	139 Å²	139	84.4 Å²	84.4	74%	0.743	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	109.9	172.1	-75.7	-13.1	0	0	0	110.5	R173	N168-R173 WeakPolarHBondContact OD1-CG 3.43Å
169	S	66.5	Low	74	Confident	58 Å²	58	86.1 Å²	86.1	41%	0.406	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	164.2	167.4	177.8	0	0	0	0	111.4	V167 R171 G172	V167-S169 PolarHBondContact O-N 3.31Å; S169-R171 PolarHBondContact O-N 3.14Å; S169-R171 VanDerWaalsContact O-N 3.07Å; S169-R171 PolarHBondContact OG-N 3.4Å; S169-G172 WeakPolarHBondContact CA-O 3.02Å; S169-G172 VanDerWaalsContact CB-O 3.29Å; S169-G172 WeakPolarHBondContact CB-O 2.98Å; S169-G172 PolarHBondContact N-O 3.2Å; S169-G172 PolarHBondContact O-N 2.87Å
170	R	71.9	Confident	72.5	Confident	243 Å²	243	86.8 Å²	86.8	92%	0.917	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-20.2	170.4	-64.8	-170.6	-173.3	-170.6	3.7	112.4
171	R	61.4	Low	70.6	Confident	203 Å²	203	89.3 Å²	89.3	77%	0.766	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	18.7	178	-57.2	178.9	83.8	158.7	4	113.8	L150 S169	L150-R171 VanDerWaalsContact CG-C 3.45Å; L150-R171 WeakPolarHBondContact CG-O 3.38Å; S169-R171 PolarHBondContact O-N 3.14Å; S169-R171 VanDerWaalsContact O-N 3.07Å; S169-R171 PolarHBondContact OG-N 3.4Å
172	G	68.5	Low	69.2	Low	6 Å²	6	91 Å²	91	6%	0.062	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	112	-173.5	175	0	0	0	0	0	114	L150 S169 V174	L150-G172 VanDerWaalsContact CD2-N 3.34Å; S169-G172 WeakPolarHBondContact CA-O 3.02Å; S169-G172 VanDerWaalsContact CB-O 3.29Å; S169-G172 WeakPolarHBondContact CB-O 2.98Å; S169-G172 PolarHBondContact N-O 3.2Å; S169-G172 PolarHBondContact O-N 2.87Å; G172-V174 PolarHBondContact O-N 3.32Å
173	R	81.6	Confident	68.6	Low	103 Å²	103	88.4 Å²	88.4	39%	0.389	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	124.8	175.1	-69.5	-169.8	-160.6	174.2	14.9	108.9	V152 M153 C154 I155 V167 N168	V152-R173 HydrophobicContact CG1-CB 4.21Å; M153-R173 PolarHBondContact N-O 3.17Å; C154-R173 WeakPolarHBondContact O-CB 3.33Å; C154-R173 VanDerWaalsContact O-CD 3.22Å; C154-R173 WeakPolarHBondContact O-CD 3.48Å; I155-R173 VanDerWaalsContact CG2-NH1 3.33Å; I155-R173 PolarHBondContact O-NH1 3.25Å; V167-R173 WeakPolarHBondContact O-CA 3.49Å; N168-R173 WeakPolarHBondContact OD1-CG 3.43Å
174	V	83	Confident	68.7	Low	25 Å²	25	90.2 Å²	90.2	15%	0.152	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	141.4	-177.8	-60.7	0	0	0	0	109.5	M153 V167 G172 A176	M153-V174 HydrophobicContact CE-CB 3.5Å; M153-V174 HydrophobicContact CE-CG1 3.39Å; V167-V174 HydrophobicContact CG2-CG2 4Å; V167-V174 WeakPolarHBondContact CG2-O 3.22Å; V167-V174 PolarHBondContact N-O 2.95Å; V167-V174 PolarHBondContact O-N 2.96Å; G172-V174 PolarHBondContact O-N 3.32Å; V174-A176 HydrophobicContact CG2-CB 4.45Å; V174-A176 PolarHBondContact O-N 3.27Å; V174-A176 VanDerWaalsContact O-N 3.07Å
175	C	83.1	Confident	68.7	Low	34 Å²	34	88.6 Å²	88.6	23%	0.23	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	106.6	166.1	-66.9	0	0	0	0	107.9	C154 C160 L164 K165	C154-C175 WeakPolarHBondContact CB-SG 3.16Å; C154-C175 PolarHBondContact SG-N 2.9Å; C160-C175 WeakPolarHBondContact CA-SG 3.25Å; C160-C175 HydrophobicContact CB-CB 3.72Å; C160-C175 WeakPolarHBondContact CB-SG 3.47Å; C160-C175 WeakPolarHBondContact SG-CA 2.91Å; C160-C175 WeakPolarHBondContact SG-CB 3.45Å; C160-C175 CovalentContact SG-SG 2.04Å; C160-C175 PolarHBondContact SG-SG 2.02Å; L164-C175 HydrophobicContact CB-CB 4.1Å; L164-C175 HydrophobicContact CD1-CB 4.14Å; K165-C175 WeakPolarHBondContact O-CA 3.42Å
176	A	76.4	Confident	68.8	Low	23 Å²	23	87.4 Å²	87.4	19%	0.19	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	157.6	172.5	0	0	0	0	0	108.5	L164 K165 V167 V174	L164-A176 VanDerWaalsContact CD2-C 3.49Å; K165-A176 PolarHBondContact N-O 3.42Å; K165-A176 PolarHBondContact O-N 2.65Å; V167-A176 HydrophobicContact CG2-CB 3.36Å; V174-A176 HydrophobicContact CG2-CB 4.45Å; V174-A176 PolarHBondContact O-N 3.27Å; V174-A176 VanDerWaalsContact O-N 3.07Å
177	M	68.9	Low	68.7	Low	61 Å²	61	93.3 Å²	93.3	30%	0.3	48%	0.479	S	S	.	.			trans	-59	137.8	166.7	-73.2	-163.2	-173.2	0	0	108.4	P163 L164 M179 Q183	P163-M177 HydrophobicContact CG-CE 4.16Å; L164-M177 HydrophobicContact CD2-CB 4.41Å; L164-M177 HydrophobicContact CD2-CG 3.63Å; L164-M177 VanDerWaalsContact CD2-N 3.32Å; M177-M179 PolarHBondContact O-N 2.8Å; M177-Q183 HydrophobicContact SD-CG 4.2Å; M177-Q183 PolarHBondContact SD-NE2 3.11Å; M177-Q183 VanDerWaalsContact SD-NE2 3.37Å
178	P	58.3	Low	68.9	Low	24 Å²	24	93.6 Å²	93.6	16%	0.156	48%	0.478	C	S	.	.			trans	-54	113.9	167.9	21.2	-28.7	0	0	0	106.7	P163 K165 S180 S181	P163-P178 VanDerWaalsContact O-CD 3.31Å; P163-P178 WeakPolarHBondContact O-CD 3.32Å; K165-P178 HydrophobicContact CD-CB 4.1Å; K165-P178 HydrophobicContact CD-CG 4.28Å; K165-P178 HydrophobicContact CG-CB 4.33Å; K165-P178 HydrophobicContact CG-CG 4.17Å; P178-S180 PolarHBondContact O-N 3.48Å; P178-S181 PolarHBondContact O-N 3.13Å; P178-S181 PolarHBondContact O-OG 2.75Å
179	M	52	Low	69.6	Low	192 Å²	192	87.6 Å²	87.6	95%	0.946	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	4.8	178.7	-66.8	-171.6	-176.7	0	0	112.5	M177	M177-M179 PolarHBondContact O-N 2.8Å
180	S	48.6	Very low	70.6	Confident	114 Å²	114	87.9 Å²	87.9	80%	0.797	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-2.9	175.4	74.7	0	0	0	0	115.1	P178	P178-S180 PolarHBondContact O-N 3.48Å
181	S	42.8	Very low	71.3	Confident	62 Å²	62	80.1 Å²	80.1	43%	0.434	42%	0.42	S	S	.	.	S	Bend	trans	-95.7	105.1	159.4	62.4	0	0	0	0	107	P178 Q183	P178-S181 PolarHBondContact O-N 3.13Å; P178-S181 PolarHBondContact O-OG 2.75Å; S181-Q183 PolarHBondContact O-N 3.05Å
182	K	47.1	Very low	72.3	Confident	189 Å²	189	71.2 Å²	71.2	82%	0.822	39%	0.39	S	S	*	.			trans	-45.8	112.9	160.5	-74.7	177.2	178.5	177.6	0	105.7	V184	K182-V184 HydrophobicContact CB-CG2 4.1Å; K182-V184 WeakPolarHBondContact O-CG2 3.37Å; K182-V184 PolarHBondContact O-N 2.9Å
183	Q	54.7	Low	72.7	Confident	71 Å²	71	79.5 Å²	79.5	33%	0.332	43%	0.427	S	S	.	.			trans	-67.9	91.5	174.6	-158.1	170.9	6.7	0	0	104.6	M177 S181 C185 V191	M177-Q183 HydrophobicContact SD-CG 4.2Å; M177-Q183 PolarHBondContact SD-NE2 3.11Å; M177-Q183 VanDerWaalsContact SD-NE2 3.37Å; S181-Q183 PolarHBondContact O-N 3.05Å; Q183-C185 PolarHBondContact O-N 3.36Å; Q183-V191 HydrophobicContact CB-CG2 4.14Å; Q183-V191 WeakPolarHBondContact O-CG2 3.37Å
184	V	72.2	Confident	72.6	Confident	126 Å²	126	76.5 Å²	76.5	76%	0.764	42%	0.421	S	S	*	.			trans	-78.4	97.6	-177.2	-177.1	0	0	0	0	105.4	K182	K182-V184 HydrophobicContact CB-CG2 4.1Å; K182-V184 WeakPolarHBondContact O-CG2 3.37Å; K182-V184 PolarHBondContact O-N 2.9Å
185	C	82	Confident	72.4	Confident	18 Å²	18	76 Å²	76	12%	0.122	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-62.8	150.3	168.9	-65.9	0	0	0	0	110.2	Q183 E189 V191 C220	Q183-C185 PolarHBondContact O-N 3.36Å; C185-E189 HydrophobicContact CB-CB 3.65Å; C185-V191 WeakPolarHBondContact SG-CG2 3.39Å; C185-C220 WeakPolarHBondContact CA-SG 3.42Å; C185-C220 HydrophobicContact CB-CB 3.73Å; C185-C220 WeakPolarHBondContact CB-SG 3.02Å; C185-C220 VanDerWaalsContact SG-CA 3.57Å; C185-C220 WeakPolarHBondContact SG-CB 3.44Å; C185-C220 CovalentContact SG-SG 2.04Å; C185-C220 PolarHBondContact SG-SG 2.87Å
186	P	82.1	Confident	72	Confident	75 Å²	75	76.3 Å²	76.3	49%	0.487	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-52.3	165.2	171.5	-24.6	33.5	0	0	0	112.6	N188 E189	P186-N188 PolarHBondContact O-N 3.19Å; P186-E189 HydrophobicContact CB-CG 4.48Å; P186-E189 WeakPolarHBondContact O-CB 3.11Å; P186-E189 PolarHBondContact O-N 2.72Å
187	I	82.9	Confident	71.9	Confident	149 Å²	149	77.1 Å²	77.1	76%	0.764	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	135.5	175.2	-61.8	172.6	0	0	0	109.2	E189	I187-E189 VanDerWaalsContact C-N 3.25Å; I187-E189 PolarHBondContact O-N 2.03Å
188	N	87.6	Confident	72.4	Confident	50 Å²	50	75.2 Å²	75.2	27%	0.267	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	11.7	-176.6	-48.3	-37.4	0	0	0	116.2	P186 R223 F226 C238	P186-N188 PolarHBondContact O-N 3.19Å; N188-R223 WeakPolarHBondContact O-CG 3.4Å; N188-R223 PolarHBondContact O-N 3.27Å; N188-F226 HydrophobicContact CB-CD1 3.46Å; N188-F226 VanDerWaalsContact CB-CD1 3.46Å; N188-F226 HydrophobicContact CB-CD2 4.19Å; N188-F226 HydrophobicContact CB-CE1 3.54Å; N188-F226 HydrophobicContact CB-CE2 4.24Å; N188-F226 HydrophobicContact CB-CG 3.82Å; N188-F226 HydrophobicContact CB-CZ 3.93Å; N188-F226 VanDerWaalsContact CG-CZ 3.49Å; N188-F226 WeakPolarHBondContact ND2-CE1 2.97Å; N188-F226 WeakPolarHBondContact OD1-CE1 3.31Å; N188-F226 WeakPolarHBondContact OD1-CZ 3.06Å; N188-C238 HydrophobicContact CB-CB 3.96Å; N188-C238 PolarHBondContact ND2-O 3.42Å
189	E	90.5	Very high	73.4	Confident	13 Å²	13	75 Å²	75	6%	0.061	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	154.9	170.8	-67.9	-175.9	-150	0	0	111.3	C185 P186 I187 C220 M221 R223 R228 C238	C185-E189 HydrophobicContact CB-CB 3.65Å; P186-E189 HydrophobicContact CB-CG 4.48Å; P186-E189 WeakPolarHBondContact O-CB 3.11Å; P186-E189 PolarHBondContact O-N 2.72Å; I187-E189 VanDerWaalsContact C-N 3.25Å; I187-E189 PolarHBondContact O-N 2.03Å; E189-C220 HydrophobicContact CB-CB 4.2Å; E189-C220 WeakPolarHBondContact OE2-CB 3.43Å; E189-M221 CarbonylContact C-O 3.45Å; E189-M221 WeakPolarHBondContact CA-O 3.29Å; E189-M221 WeakPolarHBondContact CB-O 3.47Å; E189-R223 PolarHBondContact O-NE 3.09Å; E189-R223 PolarHBondContact O-NH2 3.34Å; E189-R228 IonicContact OE1-CZ 3.83Å; E189-R228 IonicContact OE1-NH1 2.97Å; E189-R228 PolarHBondContact OE1-NH1 3.36Å; E189-R228 IonicContact OE1-NH2 3.78Å; E189-R228 IonicContact OE2-NH1 3.94Å; E189-R228 IonicContact OE2-NH2 3.42Å; E189-R228 PolarHBondContact OE2-NH2 3.1Å; E189-C238 HydrophobicContact CG-CB 4.18Å; E189-C238 WeakPolarHBondContact CG-SG 3.39Å
190	E	88	Confident	74.8	Confident	65 Å²	65	68 Å²	68	30%	0.304	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.2	174	62.9	-174.1	-176.6	0	0	111.2	A192 C220 M221 R223	E190-A192 PolarHBondContact O-N 3.25Å; E190-C220 WeakPolarHBondContact O-CA 2.98Å; E190-M221 HydrophobicContact CG-CG 3.92Å; E190-M221 PolarHBondContact N-O 3.36Å; E190-M221 PolarHBondContact O-N 3.23Å; E190-R223 HydrophobicContact CB-CG 3.84Å; E190-R223 HydrophobicContact CG-CG 3.96Å
191	V	85.3	Confident	76.5	Confident	80 Å²	80	63 Å²	63	49%	0.485	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	123	177.7	-179.5	0	0	0	0	108.2	Q183 C185	Q183-V191 HydrophobicContact CB-CG2 4.14Å; Q183-V191 WeakPolarHBondContact O-CG2 3.37Å; C185-V191 WeakPolarHBondContact SG-CG2 3.39Å
192	A	82.3	Confident	78.7	Confident	15 Å²	15	60.9 Å²	60.9	12%	0.124	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	148.2	169.6	0	0	0	0	0	111.5	E190 C194 P218 G219 M221	E190-A192 PolarHBondContact O-N 3.25Å; A192-C194 PolarHBondContact O-N 3.47Å; A192-P218 VanDerWaalsContact O-CA 3.31Å; A192-P218 WeakPolarHBondContact O-CA 3.47Å; A192-G219 PolarHBondContact N-O 2.92Å; A192-G219 PolarHBondContact O-N 2.97Å; A192-M221 HydrophobicContact CB-CE 2.95Å; A192-M221 HydrophobicContact CB-CG 3.98Å; A192-M221 HydrophobicContact CB-SD 3.58Å; A192-M221 VanDerWaalsContact CB-SD 3.58Å
193	Q	78.7	Confident	80.3	Confident	180 Å²	180	54.4 Å²	54.4	84%	0.841	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	-17.8	175.1	-64.1	-179.5	-13.7	0	0	112.3	P218	Q193-P218 WeakPolarHBondContact O-CG 3.32Å
194	C	79.3	Confident	81.2	Confident	40 Å²	40	54.3 Å²	54.3	27%	0.27	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	115.9	-176.7	-172.8	0	0	0	0	108.8	A192 C216 R217 M221 L274	A192-C194 PolarHBondContact O-N 3.47Å; C194-C216 WeakPolarHBondContact CA-SG 3.25Å; C194-C216 HydrophobicContact CB-CB 4.3Å; C194-C216 WeakPolarHBondContact CB-SG 3.15Å; C194-C216 WeakPolarHBondContact SG-CB 3.36Å; C194-C216 CovalentContact SG-SG 1.99Å; C194-C216 PolarHBondContact SG-SG 3.43Å; C194-R217 CarbonylContact C-O 3.52Å; C194-M221 WeakPolarHBondContact O-CE 2.97Å; C194-L274 HydrophobicContact CB-CD2 3.54Å; C194-L274 WeakPolarHBondContact O-CD2 3.49Å
195	T	76.9	Confident	80.7	Confident	16 Å²	16	53.7 Å²	53.7	10%	0.098	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	146.1	170.1	177.2	0	0	0	0	108.6	Q199 R217	T195-Q199 PolarHBondContact OG1-NE2 3.32Å; T195-R217 WeakPolarHBondContact CG2-O 3.32Å; T195-R217 PolarHBondContact N-O 3.31Å; T195-R217 PolarHBondContact O-N 2.03Å; T195-R217 VanDerWaalsContact O-O 3.09Å
196	S	75	Confident	79.8	Confident	39 Å²	39	56.3 Å²	56.3	27%	0.273	31%	0.31	S	S	.	.			trans	-91.7	158.4	165.1	61.8	0	0	0	0	109.7	C198 Q199	S196-C198 PolarHBondContact O-N 2.86Å; S196-C198 PolarHBondContact OG-N 2.98Å; S196-C198 PolarHBondContact OG-O 3.09Å; S196-Q199 WeakPolarHBondContact O-CG 3.47Å
197	S	74.7	Confident	78.6	Confident	40 Å²	40	58 Å²	58	28%	0.28	32%	0.321	S	S	.	.	S	Bend	trans	-67.1	-20.3	164.5	55.3	0	0	0	0	111.5	Q199 D213	S197-Q199 PolarHBondContact O-N 2.79Å; S197-D213 WeakPolarHBondContact OG-CB 3.05Å; S197-D213 PolarHBondContact OG-OD2 3.48Å
198	C	78.9	Confident	77.3	Confident	21 Å²	21	54.8 Å²	54.8	14%	0.142	31%	0.311	C	S	.	.			trans	-90.8	60.9	-179.6	-57.1	0	0	0	0	113.6	S196 C211 D213 N232	S196-C198 PolarHBondContact O-N 2.86Å; S196-C198 PolarHBondContact OG-N 2.98Å; S196-C198 PolarHBondContact OG-O 3.09Å; C198-C211 HydrophobicContact CB-CB 3.3Å; C198-C211 WeakPolarHBondContact CB-SG 3.04Å; C198-C211 VanDerWaalsContact SG-CA 3.53Å; C198-C211 WeakPolarHBondContact SG-CB 3.03Å; C198-C211 CovalentContact SG-SG 1.97Å; C198-C211 PolarHBondContact SG-SG 2.88Å; C198-D213 PolarHBondContact SG-O 3.03Å; C198-N232 WeakPolarHBondContact CA-OD1 3.31Å; C198-N232 WeakPolarHBondContact CB-OD1 3.45Å
199	Q	79.9	Confident	76	Confident	21 Å²	21	54 Å²	54	10%	0.098	31%	0.312	C	S	.	.			trans	-78	144.5	175.5	-62.8	-174.2	15.6	0	0	110.9	T195 S196 S197 G201 C220 R228 N232	T195-Q199 PolarHBondContact OG1-NE2 3.32Å; S196-Q199 WeakPolarHBondContact O-CG 3.47Å; S197-Q199 PolarHBondContact O-N 2.79Å; Q199-G201 PolarHBondContact O-N 2.86Å; Q199-C220 PolarHBondContact NE2-O 2.82Å; Q199-R228 HydrophobicContact CB-CG 4.21Å; Q199-R228 VanDerWaalsContact CD-NE 3.3Å; Q199-N232 PolarHBondContact O-N 3.27Å
200	T	81.1	Confident	74.7	Confident	43 Å²	43	58.5 Å²	58.5	26%	0.264	34%	0.341	S	S	.	.			trans	-65.9	130.2	176.5	-49	0	0	0	0	110.6	I227 R228 V281	T200-I227 HydrophobicContact CG2-CD1 4.18Å; T200-I227 WeakPolarHBondContact O-CG1 3.38Å; T200-R228 WeakPolarHBondContact O-CB 3.46Å; T200-R228 PolarHBondContact O-N 3.27Å; T200-V281 HydrophobicContact CG2-CG1 3.88Å
201	G	85.6	Confident	73.9	Confident	11 Å²	11	57.7 Å²	57.7	11%	0.113	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	168.8	175.4	0	0	0	0	0	113.9	Q199 R228	Q199-G201 PolarHBondContact O-N 2.86Å; G201-R228 CarbonylContact C-O 3.56Å; G201-R228 WeakPolarHBondContact CA-O 3.05Å
202	C	87.9	Confident	73	Confident	16 Å²	16	64.9 Å²	64.9	11%	0.108	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	-41.9	-177	-168.2	0	0	0	0	112.5	I227 R228 L229 I239 C244	C202-I227 HydrophobicContact CB-CG2 4.43Å; C202-R228 PolarHBondContact N-O 3.36Å; C202-L229 WeakPolarHBondContact CB-O 3.46Å; C202-L229 PolarHBondContact N-O 2.8Å; C202-I239 HydrophobicContact CB-CD1 4.13Å; C202-C244 VanDerWaalsContact CA-SG 3.55Å; C202-C244 HydrophobicContact CB-CB 3.9Å; C202-C244 WeakPolarHBondContact CB-SG 3.35Å; C202-C244 WeakPolarHBondContact SG-CA 3.26Å; C202-C244 WeakPolarHBondContact SG-CB 3.46Å; C202-C244 CovalentContact SG-SG 2.03Å; C202-C244 PolarHBondContact SG-SG 2.99Å
203	F	81.5	Confident	72.3	Confident	53 Å²	53	66.7 Å²	66.7	23%	0.232	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126	178.2	-60	-70.1	0	0	0	110.8	N205 L229 H230 H231 I247 L248	F203-N205 PolarHBondContact O-N 3.07Å; F203-L229 HydrophobicContact CD2-CD1 3.86Å; F203-L229 HydrophobicContact CD2-CG 4.14Å; F203-L229 VanDerWaalsContact CD2-O 3.25Å; F203-L229 WeakPolarHBondContact CD2-O 3.16Å; F203-L229 HydrophobicContact CE2-CD1 3.59Å; F203-L229 HydrophobicContact CE2-CG 4.36Å; F203-L229 PolarHBondContact N-O 2.9Å; F203-H230 WeakPolarHBondContact O-CA 3.37Å; F203-H231 WeakPolarHBondContact O-CB 3.31Å; F203-H231 PolarHBondContact O-N 3.27Å; F203-I247 HydrophobicContact CE1-CG2 4.17Å; F203-I247 HydrophobicContact CE2-CB 4.49Å; F203-I247 HydrophobicContact CE2-CD1 4.3Å; F203-I247 HydrophobicContact CE2-CG2 4.03Å; F203-I247 HydrophobicContact CZ-CB 3.82Å; F203-I247 HydrophobicContact CZ-CD1 4.45Å; F203-I247 HydrophobicContact CZ-CG2 3.29Å; F203-L248 HydrophobicContact CD1-CD2 4.3Å; F203-L248 HydrophobicContact CE1-CD2 3.72Å; F203-L248 HydrophobicContact CE1-CG 4.49Å; F203-L248 HydrophobicContact CZ-CD2 4.39Å
204	K	73.3	Confident	71.5	Confident	70 Å²	70	63.1 Å²	63.1	30%	0.304	36%	0.358	S	S	.	.			trans	-85.1	97.4	164.7	-141.5	-177	-176.8	-170.4	0	107.2	D206 P207 H231	K204-D206 PolarHBondContact O-N 3.11Å; K204-P207 PolarHBondContact NZ-O 3.31Å; K204-P207 VanDerWaalsContact NZ-O 3.17Å; K204-H231 HydrophobicContact CB-CB 4.47Å; K204-H231 HydrophobicContact CG-CB 4.13Å
205	N	62.1	Low	70.9	Confident	112 Å²	112	69 Å²	69	60%	0.599	38%	0.376	S	S	*	.	S	Bend	trans	-63.8	-23.3	-179.2	-68.4	-11	0	0	0	112.2	F203 H230	F203-N205 PolarHBondContact O-N 3.07Å; N205-H230 VanDerWaalsContact CG-ND1 3.33Å; N205-H230 PolarHBondContact ND2-ND1 3.37Å; N205-H230 PolarHBondContact OD1-ND1 3.33Å
206	D	61.9	Low	70.9	Confident	73 Å²	73	71.8 Å²	71.8	39%	0.39	40%	0.395	S	S	.	.			trans	-138	118	176.7	-175.8	-11.4	0	0	0	109.3	K204 S208 A209	K204-D206 PolarHBondContact O-N 3.11Å; D206-S208 PolarHBondContact O-N 2.75Å; D206-S208 VanDerWaalsContact O-N 3.11Å; D206-S208 WeakPolarHBondContact OD1-CB 3.23Å; D206-S208 PolarHBondContact OD1-N 3.46Å; D206-S208 PolarHBondContact OD1-OG 2.87Å; D206-S208 PolarHBondContact OD2-OG 3Å; D206-S208 VanDerWaalsContact OD2-OG 3.12Å; D206-A209 HydrophobicContact CB-CB 3.89Å; D206-A209 PolarHBondContact O-N 2.89Å
207	P	57.4	Low	70.8	Confident	111 Å²	111	77.8 Å²	77.8	72%	0.721	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-28.4	175.4	-23.3	32.1	0	0	0	113.2	K204	K204-P207 PolarHBondContact NZ-O 3.31Å; K204-P207 VanDerWaalsContact NZ-O 3.17Å
208	S	55.6	Low	71	Confident	81 Å²	81	80.4 Å²	80.4	57%	0.566	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.5	-175.6	77.6	0	0	0	0	114.9	D206 T210	D206-S208 PolarHBondContact O-N 2.75Å; D206-S208 VanDerWaalsContact O-N 3.11Å; D206-S208 WeakPolarHBondContact OD1-CB 3.23Å; D206-S208 PolarHBondContact OD1-N 3.46Å; D206-S208 PolarHBondContact OD1-OG 2.87Å; D206-S208 PolarHBondContact OD2-OG 3Å; D206-S208 VanDerWaalsContact OD2-OG 3.12Å; S208-T210 VanDerWaalsContact C-N 3.28Å; S208-T210 PolarHBondContact O-N 2.04Å
209	A	60.2	Low	71.2	Confident	34 Å²	34	79.9 Å²	79.9	28%	0.281	43%	0.426	S	S	.	.			trans	-68	87	178.3	0	0	0	0	0	110.5	D206 N232	D206-A209 HydrophobicContact CB-CB 3.89Å; D206-A209 PolarHBondContact O-N 2.89Å; A209-N232 PolarHBondContact O-ND2 3.29Å; A209-N232 VanDerWaalsContact O-ND2 3.12Å
210	T	64.4	Low	71.6	Confident	108 Å²	108	80.2 Å²	80.2	66%	0.663	43%	0.43	S	S	*	.			trans	-82.5	127.5	168.1	41.3	0	0	0	0	108.4	S208 R212	S208-T210 VanDerWaalsContact C-N 3.28Å; S208-T210 PolarHBondContact O-N 2.04Å; T210-R212 PolarHBondContact O-N 3.32Å
211	C	69.5	Low	71.9	Confident	47 Å²	47	78.6 Å²	78.6	32%	0.318	42%	0.42	S	S	.	.			trans	-61.3	122.5	169.1	170	0	0	0	0	109.8	C198 D213	C198-C211 HydrophobicContact CB-CB 3.3Å; C198-C211 WeakPolarHBondContact CB-SG 3.04Å; C198-C211 VanDerWaalsContact SG-CA 3.53Å; C198-C211 WeakPolarHBondContact SG-CB 3.03Å; C198-C211 CovalentContact SG-SG 1.97Å; C198-C211 PolarHBondContact SG-SG 2.88Å; C211-D213 PolarHBondContact SG-N 2.89Å; C211-D213 VanDerWaalsContact SG-N 3.4Å; C211-D213 PolarHBondContact SG-O 2.81Å
212	R	68	Low	72.2	Confident	232 Å²	232	78.3 Å²	78.3	88%	0.875	42%	0.416	S	S	*	.			trans	-97.5	-12.4	169.9	-70.5	-175.3	179.5	173.4	-0.6	113.5	T210	T210-R212 PolarHBondContact O-N 3.32Å
213	D	65.9	Low	72.2	Confident	53 Å²	53	83.5 Å²	83.5	28%	0.283	43%	0.433	S	S	.	.			trans	-100.4	88.9	-177.1	-174	12.8	0	0	0	111.2	S197 C198 C211 Y215	S197-D213 WeakPolarHBondContact OG-CB 3.05Å; S197-D213 PolarHBondContact OG-OD2 3.48Å; C198-D213 PolarHBondContact SG-O 3.03Å; C211-D213 PolarHBondContact SG-N 2.89Å; C211-D213 VanDerWaalsContact SG-N 3.4Å; C211-D213 PolarHBondContact SG-O 2.81Å; D213-Y215 VanDerWaalsContact C-N 3.32Å; D213-Y215 WeakPolarHBondContact OD1-CD2 3.49Å; D213-Y215 PolarHBondContact OD1-N 3.32Å
214	T	63.6	Low	72.4	Confident	104 Å²	104	83.9 Å²	83.9	64%	0.638	44%	0.442	S	S	*	.			trans	-89.6	2.5	175.3	50.2	0	0	0	0	112.8	C216	T214-C216 PolarHBondContact O-N 2.86Å
215	Y	66.3	Low	72.9	Confident	164 Å²	164	82.2 Å²	82.2	64%	0.643	45%	0.446	S	S	*	.			trans	-75	120	-177.5	-61.9	-79.6	0	0	0	110.7	D213 R217	D213-Y215 VanDerWaalsContact C-N 3.32Å; D213-Y215 WeakPolarHBondContact OD1-CD2 3.49Å; D213-Y215 PolarHBondContact OD1-N 3.32Å; Y215-R217 PolarHBondContact O-N 3.42Å
216	C	76.7	Confident	74.4	Confident	74 Å²	74	79.1 Å²	79.1	50%	0.5	43%	0.427	S	S	.	.			trans	-68.7	117.3	171.6	166.5	0	0	0	0	110.8	C194 T214	C194-C216 WeakPolarHBondContact CA-SG 3.25Å; C194-C216 HydrophobicContact CB-CB 4.3Å; C194-C216 WeakPolarHBondContact CB-SG 3.15Å; C194-C216 WeakPolarHBondContact SG-CB 3.36Å; C194-C216 CovalentContact SG-SG 1.99Å; C194-C216 PolarHBondContact SG-SG 3.43Å; T214-C216 PolarHBondContact O-N 2.86Å
217	R	72.8	Confident	75.7	Confident	165 Å²	165	76.3 Å²	76.3	62%	0.623	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	149.4	172.3	-62.6	-176.9	-177.5	-119.8	1	110.4	C194 T195 Y215	C194-R217 CarbonylContact C-O 3.52Å; T195-R217 WeakPolarHBondContact CG2-O 3.32Å; T195-R217 PolarHBondContact N-O 3.31Å; T195-R217 PolarHBondContact O-N 2.03Å; T195-R217 VanDerWaalsContact O-O 3.09Å; Y215-R217 PolarHBondContact O-N 3.42Å
218	P	78.1	Confident	77.2	Confident	96 Å²	96	71.1 Å²	71.1	62%	0.623	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.8	136.9	171.7	-22	31.8	0	0	0	112	A192 Q193	A192-P218 VanDerWaalsContact O-CA 3.31Å; A192-P218 WeakPolarHBondContact O-CA 3.47Å; Q193-P218 WeakPolarHBondContact O-CG 3.32Å
219	G	82.9	Confident	78.7	Confident	10 Å²	10	69.1 Å²	69.1	10%	0.103	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.7	-174.3	-176.1	0	0	0	0	0	113.5	A192	A192-G219 PolarHBondContact N-O 2.92Å; A192-G219 PolarHBondContact O-N 2.97Å
220	C	88.2	Confident	79.9	Confident	28 Å²	28	69.9 Å²	69.9	19%	0.189	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	133.4	-176.7	-62.9	0	0	0	0	112.1	C185 E189 E190 Q199 R228	C185-C220 WeakPolarHBondContact CA-SG 3.42Å; C185-C220 HydrophobicContact CB-CB 3.73Å; C185-C220 WeakPolarHBondContact CB-SG 3.02Å; C185-C220 VanDerWaalsContact SG-CA 3.57Å; C185-C220 WeakPolarHBondContact SG-CB 3.44Å; C185-C220 CovalentContact SG-SG 2.04Å; C185-C220 PolarHBondContact SG-SG 2.87Å; E189-C220 HydrophobicContact CB-CB 4.2Å; E189-C220 WeakPolarHBondContact OE2-CB 3.43Å; E190-C220 WeakPolarHBondContact O-CA 2.98Å; Q199-C220 PolarHBondContact NE2-O 2.82Å; C220-R228 PolarHBondContact O-NH2 2.93Å
221	M	88.5	Confident	80.7	Confident	9 Å²	9	67.3 Å²	67.3	4%	0.044	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	156.3	173.7	64.5	176.8	50.7	0	0	111.5	E189 E190 A192 C194 R223 L274	E189-M221 CarbonylContact C-O 3.45Å; E189-M221 WeakPolarHBondContact CA-O 3.29Å; E189-M221 WeakPolarHBondContact CB-O 3.47Å; E190-M221 HydrophobicContact CG-CG 3.92Å; E190-M221 PolarHBondContact N-O 3.36Å; E190-M221 PolarHBondContact O-N 3.23Å; A192-M221 HydrophobicContact CB-CE 2.95Å; A192-M221 HydrophobicContact CB-CG 3.98Å; A192-M221 HydrophobicContact CB-SD 3.58Å; A192-M221 VanDerWaalsContact CB-SD 3.58Å; C194-M221 WeakPolarHBondContact O-CE 2.97Å; M221-R223 PolarHBondContact O-N 3.41Å; M221-L274 HydrophobicContact CE-CD1 3.07Å; M221-L274 HydrophobicContact CE-CD2 4.38Å; M221-L274 HydrophobicContact CE-CG 4.29Å; M221-L274 HydrophobicContact SD-CD1 3.94Å
222	C	90.7	Very high	81	Confident	5 Å²	5	67 Å²	67	3%	0.034	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	131	172.1	-61.3	0	0	0	0	110.7	F226 I227 R228 C238	C222-F226 HydrophobicContact CB-CB 3.94Å; C222-F226 WeakPolarHBondContact CB-O 2.99Å; C222-I227 VanDerWaalsContact SG-C 3.59Å; C222-R228 WeakPolarHBondContact SG-CG 3.35Å; C222-R228 PolarHBondContact SG-N 3.36Å; C222-R228 VanDerWaalsContact SG-N 3.41Å; C222-C238 WeakPolarHBondContact CA-SG 3.11Å; C222-C238 HydrophobicContact CB-CB 3.82Å; C222-C238 WeakPolarHBondContact CB-SG 3.45Å; C222-C238 WeakPolarHBondContact SG-CB 3.39Å; C222-C238 CovalentContact SG-SG 2.03Å; C222-C238 PolarHBondContact SG-SG 2.03Å
223	R	89.7	Confident	81.6	Confident	125 Å²	125	58.7 Å²	58.7	47%	0.472	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-58	156.4	171.5	-68.1	177	-173.5	-158.8	-2.6	110.5	N188 E189 E190 M221 G225 F226	N188-R223 WeakPolarHBondContact O-CG 3.4Å; N188-R223 PolarHBondContact O-N 3.27Å; E189-R223 PolarHBondContact O-NE 3.09Å; E189-R223 PolarHBondContact O-NH2 3.34Å; E190-R223 HydrophobicContact CB-CG 3.84Å; E190-R223 HydrophobicContact CG-CG 3.96Å; M221-R223 PolarHBondContact O-N 3.41Å; R223-G225 PolarHBondContact O-N 2.71Å; R223-F226 HydrophobicContact CB-CD2 4.04Å; R223-F226 WeakPolarHBondContact O-CB 3.27Å; R223-F226 PolarHBondContact O-N 3.48Å
224	S	84.9	Confident	82.2	Confident	60 Å²	60	63.1 Å²	63.1	42%	0.42	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	130.2	174.8	-47.9	0	0	0	0	111.4	E271	S224-E271 PolarHBondContact OG-O 3.29Å
225	G	84.6	Confident	83.2	Confident	36 Å²	36	65.4 Å²	65.4	37%	0.371	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	-5.5	-173.1	0	0	0	0	0	115.6	R223 L241	R223-G225 PolarHBondContact O-N 2.71Å; G225-L241 PolarHBondContact O-N 2.8Å
226	F	91.7	Very high	84.1	Confident	47 Å²	47	57.7 Å²	57.7	21%	0.206	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	150	172.7	-63.7	-99	0	0	0	111.5	N188 C222 R223 C238 I239 P240	N188-F226 HydrophobicContact CB-CD1 3.46Å; N188-F226 VanDerWaalsContact CB-CD1 3.46Å; N188-F226 HydrophobicContact CB-CD2 4.19Å; N188-F226 HydrophobicContact CB-CE1 3.54Å; N188-F226 HydrophobicContact CB-CE2 4.24Å; N188-F226 HydrophobicContact CB-CG 3.82Å; N188-F226 HydrophobicContact CB-CZ 3.93Å; N188-F226 VanDerWaalsContact CG-CZ 3.49Å; N188-F226 WeakPolarHBondContact ND2-CE1 2.97Å; N188-F226 WeakPolarHBondContact OD1-CE1 3.31Å; N188-F226 WeakPolarHBondContact OD1-CZ 3.06Å; C222-F226 HydrophobicContact CB-CB 3.94Å; C222-F226 WeakPolarHBondContact CB-O 2.99Å; R223-F226 HydrophobicContact CB-CD2 4.04Å; R223-F226 WeakPolarHBondContact O-CB 3.27Å; R223-F226 PolarHBondContact O-N 3.48Å; F226-C238 HydrophobicContact CB-CB 4.04Å; F226-I239 CarbonylContact C-O 3.41Å; F226-I239 VanDerWaalsContact CA-O 3.27Å; F226-I239 WeakPolarHBondContact CA-O 2.82Å; F226-I239 VanDerWaalsContact CD1-C 3.48Å; F226-P240 HydrophobicContact CD1-CG 4.16Å; F226-P240 HydrophobicContact CE1-CB 4.37Å; F226-P240 HydrophobicContact CE1-CG 3.71Å
227	I	89.1	Confident	84.8	Confident	14 Å²	14	57.7 Å²	57.7	7%	0.072	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.9	176.4	-166.8	170.3	0	0	0	108.7	T200 C202 C222 C238 I239 L241 C244 V281	T200-I227 HydrophobicContact CG2-CD1 4.18Å; T200-I227 WeakPolarHBondContact O-CG1 3.38Å; C202-I227 HydrophobicContact CB-CG2 4.43Å; C222-I227 VanDerWaalsContact SG-C 3.59Å; I227-C238 WeakPolarHBondContact O-CA 3.08Å; I227-I239 HydrophobicContact CG2-CG1 4.1Å; I227-I239 PolarHBondContact N-O 2.85Å; I227-I239 WeakPolarHBondContact O-CG1 3.26Å; I227-I239 PolarHBondContact O-N 3.46Å; I227-L241 HydrophobicContact CB-CD1 4.33Å; I227-L241 HydrophobicContact CD1-CD1 4.4Å; I227-L241 HydrophobicContact CG2-CD1 4.1Å; I227-C244 HydrophobicContact CG2-CB 3.76Å; I227-V281 HydrophobicContact CD1-CG1 4.21Å
228	R	89.4	Confident	85.7	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.008	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	151.1	175.6	-74.6	-150.5	-178.1	-83.1	-1.1	110.3	E189 Q199 T200 G201 C202 C220 C222 D233 W234 S236 P237	E189-R228 IonicContact OE1-CZ 3.83Å; E189-R228 IonicContact OE1-NH1 2.97Å; E189-R228 PolarHBondContact OE1-NH1 3.36Å; E189-R228 IonicContact OE1-NH2 3.78Å; E189-R228 IonicContact OE2-NH1 3.94Å; E189-R228 IonicContact OE2-NH2 3.42Å; E189-R228 PolarHBondContact OE2-NH2 3.1Å; Q199-R228 HydrophobicContact CB-CG 4.21Å; Q199-R228 VanDerWaalsContact CD-NE 3.3Å; T200-R228 WeakPolarHBondContact O-CB 3.46Å; T200-R228 PolarHBondContact O-N 3.27Å; G201-R228 CarbonylContact C-O 3.56Å; G201-R228 WeakPolarHBondContact CA-O 3.05Å; C202-R228 PolarHBondContact N-O 3.36Å; C220-R228 PolarHBondContact O-NH2 2.93Å; C222-R228 WeakPolarHBondContact SG-CG 3.35Å; C222-R228 PolarHBondContact SG-N 3.36Å; C222-R228 VanDerWaalsContact SG-N 3.41Å; R228-D233 WeakPolarHBondContact CD-O 3.47Å; R228-W234 PolarHBondContact NH1-O 3.13Å; R228-W234 PolarHBondContact NH2-O 2.71Å; R228-S236 WeakPolarHBondContact CB-OG 3.31Å; R228-S236 PolarHBondContact NH1-O 2.04Å; R228-P237 CarbonylContact C-O 3.43Å
229	L	88.4	Confident	86.3	Confident	39 Å²	39	46.2 Å²	46.2	20%	0.204	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	-42	175.2	-174	67.7	0	0	0	110.9	C202 F203 P237 I239 I247	C202-L229 WeakPolarHBondContact CB-O 3.46Å; C202-L229 PolarHBondContact N-O 2.8Å; F203-L229 HydrophobicContact CD2-CD1 3.86Å; F203-L229 HydrophobicContact CD2-CG 4.14Å; F203-L229 VanDerWaalsContact CD2-O 3.25Å; F203-L229 WeakPolarHBondContact CD2-O 3.16Å; F203-L229 HydrophobicContact CE2-CD1 3.59Å; F203-L229 HydrophobicContact CE2-CG 4.36Å; F203-L229 PolarHBondContact N-O 2.9Å; L229-P237 HydrophobicContact CB-CG 4.09Å; L229-P237 HydrophobicContact CD2-CG 4.2Å; L229-P237 PolarHBondContact N-O 3.34Å; L229-I239 HydrophobicContact CD1-CD1 3.69Å; L229-I239 HydrophobicContact CD1-CG1 4.44Å; L229-I239 HydrophobicContact CD1-CG2 4.38Å; L229-I247 HydrophobicContact CD1-CD1 4.2Å
230	H	84.2	Confident	86.7	Confident	50 Å²	50	47.9 Å²	47.9	23%	0.231	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.9	-178.3	-60.6	-72	0	0	0	111.2	F203 N205 D233 S236	F203-H230 WeakPolarHBondContact O-CA 3.37Å; N205-H230 VanDerWaalsContact CG-ND1 3.33Å; N205-H230 PolarHBondContact ND2-ND1 3.37Å; N205-H230 PolarHBondContact OD1-ND1 3.33Å; H230-D233 HydrophobicContact CB-CB 3.93Å; H230-D233 PolarHBondContact O-N 3.2Å; H230-S236 PolarHBondContact N-OG 2.03Å; H230-S236 VanDerWaalsContact N-OG 3.12Å; H230-S236 PolarHBondContact O-OG 2.73Å
231	H	81.9	Confident	86.6	Confident	53 Å²	53	48.5 Å²	48.5	25%	0.245	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	136.9	-178.6	-174.3	87.8	0	0	0	111.1	F203 K204 D233	F203-H231 WeakPolarHBondContact O-CB 3.31Å; F203-H231 PolarHBondContact O-N 3.27Å; K204-H231 HydrophobicContact CB-CB 4.47Å; K204-H231 HydrophobicContact CG-CB 4.13Å; H231-D233 PolarHBondContact O-N 3.21Å
232	N	76.1	Confident	86.4	Confident	40 Å²	40	52.5 Å²	52.5	21%	0.214	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	17	-175.6	-61.9	-28.5	0	0	0	115.2	C198 Q199 A209	C198-N232 WeakPolarHBondContact CA-OD1 3.31Å; C198-N232 WeakPolarHBondContact CB-OD1 3.45Å; Q199-N232 PolarHBondContact O-N 3.27Å; A209-N232 PolarHBondContact O-ND2 3.29Å; A209-N232 VanDerWaalsContact O-ND2 3.12Å
233	D	79.8	Confident	86.3	Confident	58 Å²	58	57.3 Å²	57.3	31%	0.31	29%	0.291	S	S	.	.			trans	-112.9	93.8	173.5	-178.4	3.6	0	0	0	109.5	R228 H230 H231 K235 S236	R228-D233 WeakPolarHBondContact CD-O 3.47Å; H230-D233 HydrophobicContact CB-CB 3.93Å; H230-D233 PolarHBondContact O-N 3.2Å; H231-D233 PolarHBondContact O-N 3.21Å; D233-K235 PolarHBondContact O-N 2.75Å; D233-K235 VanDerWaalsContact O-N 3.12Å; D233-K235 WeakPolarHBondContact OD1-CB 3.38Å; D233-K235 PolarHBondContact OD1-N 2.88Å; D233-S236 WeakPolarHBondContact O-CB 3.44Å; D233-S236 PolarHBondContact O-N 3.34Å; D233-S236 PolarHBondContact O-OG 3.31Å; D233-S236 PolarHBondContact OD1-N 2.88Å
234	W	78.3	Confident	86.2	Confident	147 Å²	147	51.7 Å²	51.7	56%	0.557	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.3	177.8	73.7	-90.8	0	0	0	113.9	R228	R228-W234 PolarHBondContact NH1-O 3.13Å; R228-W234 PolarHBondContact NH2-O 2.71Å
235	K	84.1	Confident	86.1	Confident	151 Å²	151	51.2 Å²	51.2	66%	0.657	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-13.8	174.9	-61.2	-179	179.5	177.7	0	112.4	D233	D233-K235 PolarHBondContact O-N 2.75Å; D233-K235 VanDerWaalsContact O-N 3.12Å; D233-K235 WeakPolarHBondContact OD1-CB 3.38Å; D233-K235 PolarHBondContact OD1-N 2.88Å
236	S	87	Confident	85.9	Confident	3 Å²	3	55 Å²	55	2%	0.021	27%	0.274	C	S	.	.	S	Bend	trans	-72.4	140.8	-177.6	72.4	0	0	0	0	111.5	R228 H230 D233	R228-S236 WeakPolarHBondContact CB-OG 3.31Å; R228-S236 PolarHBondContact NH1-O 2.04Å; H230-S236 PolarHBondContact N-OG 2.03Å; H230-S236 VanDerWaalsContact N-OG 3.12Å; H230-S236 PolarHBondContact O-OG 2.73Å; D233-S236 WeakPolarHBondContact O-CB 3.44Å; D233-S236 PolarHBondContact O-N 3.34Å; D233-S236 PolarHBondContact O-OG 3.31Å; D233-S236 PolarHBondContact OD1-N 2.88Å
237	P	89.6	Confident	85.3	Confident	73 Å²	73	54.7 Å²	54.7	47%	0.474	27%	0.274	S	S	.	.			trans	-67.4	143.1	-171.8	26	-34.4	0	0	0	112	R228 L229 I239	R228-P237 CarbonylContact C-O 3.43Å; L229-P237 HydrophobicContact CB-CG 4.09Å; L229-P237 HydrophobicContact CD2-CG 4.2Å; L229-P237 PolarHBondContact N-O 3.34Å; P237-I239 PolarHBondContact O-N 3.13Å
238	C	92.5	Very high	84.5	Confident	6 Å²	6	57.8 Å²	57.8	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	110.8	171.5	-67.5	0	0	0	0	110.6	N188 E189 C222 F226 I227	N188-C238 HydrophobicContact CB-CB 3.96Å; N188-C238 PolarHBondContact ND2-O 3.42Å; E189-C238 HydrophobicContact CG-CB 4.18Å; E189-C238 WeakPolarHBondContact CG-SG 3.39Å; C222-C238 WeakPolarHBondContact CA-SG 3.11Å; C222-C238 HydrophobicContact CB-CB 3.82Å; C222-C238 WeakPolarHBondContact CB-SG 3.45Å; C222-C238 WeakPolarHBondContact SG-CB 3.39Å; C222-C238 CovalentContact SG-SG 2.03Å; C222-C238 PolarHBondContact SG-SG 2.03Å; F226-C238 HydrophobicContact CB-CB 4.04Å; I227-C238 WeakPolarHBondContact O-CA 3.08Å
239	I	91.2	Very high	83.5	Confident	14 Å²	14	67 Å²	67	7%	0.072	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	148.3	177.7	59.4	161.5	0	0	0	110.6	C202 F226 I227 L229 P237 L241 K243 C244 I247	C202-I239 HydrophobicContact CB-CD1 4.13Å; F226-I239 CarbonylContact C-O 3.41Å; F226-I239 VanDerWaalsContact CA-O 3.27Å; F226-I239 WeakPolarHBondContact CA-O 2.82Å; F226-I239 VanDerWaalsContact CD1-C 3.48Å; I227-I239 HydrophobicContact CG2-CG1 4.1Å; I227-I239 PolarHBondContact N-O 2.85Å; I227-I239 WeakPolarHBondContact O-CG1 3.26Å; I227-I239 PolarHBondContact O-N 3.46Å; L229-I239 HydrophobicContact CD1-CD1 3.69Å; L229-I239 HydrophobicContact CD1-CG1 4.44Å; L229-I239 HydrophobicContact CD1-CG2 4.38Å; P237-I239 PolarHBondContact O-N 3.13Å; I239-L241 PolarHBondContact O-N 2.97Å; I239-K243 HydrophobicContact CB-CD 4.41Å; I239-K243 HydrophobicContact CG2-CD 4.49Å; I239-C244 HydrophobicContact CD1-CB 3.74Å; I239-C244 HydrophobicContact CG1-CB 4.43Å; I239-I247 HydrophobicContact CD1-CD1 3.97Å
240	P	90.3	Very high	82.3	Confident	46 Å²	46	69 Å²	69	30%	0.299	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	141.5	172.7	-23.9	32.4	0	0	0	110.9	F226 T242 K243 C244	F226-P240 HydrophobicContact CD1-CG 4.16Å; F226-P240 HydrophobicContact CE1-CB 4.37Å; F226-P240 HydrophobicContact CE1-CG 3.71Å; P240-T242 PolarHBondContact O-N 2.82Å; P240-K243 HydrophobicContact CB-CB 4.28Å; P240-K243 HydrophobicContact CG-CB 4.46Å; P240-K243 WeakPolarHBondContact O-CA 3.45Å; P240-K243 WeakPolarHBondContact O-CB 3.47Å; P240-K243 PolarHBondContact O-N 3.34Å; P240-C244 PolarHBondContact O-N 3.37Å
241	L	85.8	Confident	80.8	Confident	41 Å²	41	72.4 Å²	72.4	22%	0.215	36%	0.362	C	S	.	.	H	α-helix	trans	-58	-32.7	178	-168.4	67.3	0	0	0	112	G225 I227 I239 C244 T245 H283	G225-L241 PolarHBondContact O-N 2.8Å; I227-L241 HydrophobicContact CB-CD1 4.33Å; I227-L241 HydrophobicContact CD1-CD1 4.4Å; I227-L241 HydrophobicContact CG2-CD1 4.1Å; I239-L241 PolarHBondContact O-N 2.97Å; L241-C244 WeakPolarHBondContact O-CB 2.98Å; L241-C244 PolarHBondContact O-N 3.5Å; L241-T245 PolarHBondContact O-N 3.12Å; L241-T245 PolarHBondContact O-OG1 3.12Å; L241-H283 HydrophobicContact CD2-CB 4.41Å; L241-H283 VanDerWaalsContact CD2-ND1 3.34Å; L241-H283 WeakPolarHBondContact CD2-ND1 3.04Å
242	T	85.8	Confident	79.1	Confident	93 Å²	93	74.7 Å²	74.7	57%	0.571	38%	0.381	S	S	*	.	H	α-helix	trans	-60.6	-45.2	172.4	51.6	0	0	0	0	112.2	P240 C244 T245 E246	P240-T242 PolarHBondContact O-N 2.82Å; T242-C244 PolarHBondContact O-N 2.69Å; T242-T245 VanDerWaalsContact O-CB 3.31Å; T242-T245 WeakPolarHBondContact O-CB 3.44Å; T242-T245 PolarHBondContact O-N 2.61Å; T242-T245 VanDerWaalsContact O-N 3.17Å; T242-E246 WeakPolarHBondContact O-CG 3.49Å; T242-E246 PolarHBondContact O-N 3Å
243	K	87.3	Confident	77.4	Confident	105 Å²	105	77.3 Å²	77.3	46%	0.457	41%	0.409	S	S	.	.	H	α-helix	trans	-64.6	-40.2	176	-172.8	175.2	-176.9	177.8	0	111.5	I239 P240 T245 E246 I247	I239-K243 HydrophobicContact CB-CD 4.41Å; I239-K243 HydrophobicContact CG2-CD 4.49Å; P240-K243 HydrophobicContact CB-CB 4.28Å; P240-K243 HydrophobicContact CG-CB 4.46Å; P240-K243 WeakPolarHBondContact O-CA 3.45Å; P240-K243 WeakPolarHBondContact O-CB 3.47Å; P240-K243 PolarHBondContact O-N 3.34Å; K243-T245 VanDerWaalsContact C-N 3.29Å; K243-T245 PolarHBondContact O-N 2.82Å; K243-E246 PolarHBondContact O-N 2.75Å; K243-I247 HydrophobicContact CG-CD1 4.08Å; K243-I247 HydrophobicContact CG-CG1 4.38Å; K243-I247 VanDerWaalsContact O-CG1 3.23Å; K243-I247 WeakPolarHBondContact O-CG1 2.95Å; K243-I247 PolarHBondContact O-N 3.42Å
244	C	87.4	Confident	75.7	Confident	7 Å²	7	82.7 Å²	82.7	5%	0.047	43%	0.432	C	S	.	.	H	α-helix	trans	-58.8	-45.4	173.1	176.3	0	0	0	0	110.9	C202 I227 I239 P240 L241 T242 E246 I247 L248	C202-C244 VanDerWaalsContact CA-SG 3.55Å; C202-C244 HydrophobicContact CB-CB 3.9Å; C202-C244 WeakPolarHBondContact CB-SG 3.35Å; C202-C244 WeakPolarHBondContact SG-CA 3.26Å; C202-C244 WeakPolarHBondContact SG-CB 3.46Å; C202-C244 CovalentContact SG-SG 2.03Å; C202-C244 PolarHBondContact SG-SG 2.99Å; I227-C244 HydrophobicContact CG2-CB 3.76Å; I239-C244 HydrophobicContact CD1-CB 3.74Å; I239-C244 HydrophobicContact CG1-CB 4.43Å; P240-C244 PolarHBondContact O-N 3.37Å; L241-C244 WeakPolarHBondContact O-CB 2.98Å; L241-C244 PolarHBondContact O-N 3.5Å; T242-C244 PolarHBondContact O-N 2.69Å; C244-E246 VanDerWaalsContact C-N 3.32Å; C244-E246 PolarHBondContact O-N 3.14Å; C244-I247 PolarHBondContact O-N 3.18Å; C244-L248 WeakPolarHBondContact O-CB 3.43Å; C244-L248 VanDerWaalsContact O-CG 3.26Å; C244-L248 WeakPolarHBondContact O-CG 3.49Å; C244-L248 PolarHBondContact O-N 3.05Å
245	T	82.9	Confident	73.6	Confident	50 Å²	50	81.9 Å²	81.9	31%	0.307	45%	0.446	S	S	.	.	H	α-helix	trans	-60.4	-40.7	176.6	-49.8	0	0	0	0	111.8	L241 T242 K243 R249	L241-T245 PolarHBondContact O-N 3.12Å; L241-T245 PolarHBondContact O-OG1 3.12Å; T242-T245 VanDerWaalsContact O-CB 3.31Å; T242-T245 WeakPolarHBondContact O-CB 3.44Å; T242-T245 PolarHBondContact O-N 2.61Å; T242-T245 VanDerWaalsContact O-N 3.17Å; K243-T245 VanDerWaalsContact C-N 3.29Å; K243-T245 PolarHBondContact O-N 2.82Å; T245-R249 WeakPolarHBondContact O-CB 3.12Å; T245-R249 WeakPolarHBondContact O-CG 3.14Å; T245-R249 PolarHBondContact O-N 2.97Å
246	E	81.5	Confident	71.4	Confident	117 Å²	117	77.8 Å²	77.8	55%	0.547	45%	0.446	S	S	.	.	H	α-helix	trans	-66.3	-45.9	175.9	-72.7	166.1	-169	0	0	112.4	T242 K243 C244 L248 R249 S250	T242-E246 WeakPolarHBondContact O-CG 3.49Å; T242-E246 PolarHBondContact O-N 3Å; K243-E246 PolarHBondContact O-N 2.75Å; C244-E246 VanDerWaalsContact C-N 3.32Å; C244-E246 PolarHBondContact O-N 3.14Å; E246-L248 VanDerWaalsContact C-N 3.31Å; E246-L248 PolarHBondContact O-N 2.73Å; E246-R249 PolarHBondContact O-N 3.12Å; E246-S250 WeakPolarHBondContact O-CB 3.24Å; E246-S250 PolarHBondContact O-N 3.27Å; E246-S250 PolarHBondContact O-OG 3.43Å
247	I	79.9	Confident	68.9	Low	40 Å²	40	86 Å²	86	21%	0.205	49%	0.49	C	S	.	.	H	α-helix	trans	-63.6	-42.7	-180	-56.2	158.8	0	0	0	109.7	F203 L229 I239 K243 C244 R249 S250 N251	F203-I247 HydrophobicContact CE1-CG2 4.17Å; F203-I247 HydrophobicContact CE2-CB 4.49Å; F203-I247 HydrophobicContact CE2-CD1 4.3Å; F203-I247 HydrophobicContact CE2-CG2 4.03Å; F203-I247 HydrophobicContact CZ-CB 3.82Å; F203-I247 HydrophobicContact CZ-CD1 4.45Å; F203-I247 HydrophobicContact CZ-CG2 3.29Å; L229-I247 HydrophobicContact CD1-CD1 4.2Å; I239-I247 HydrophobicContact CD1-CD1 3.97Å; K243-I247 HydrophobicContact CG-CD1 4.08Å; K243-I247 HydrophobicContact CG-CG1 4.38Å; K243-I247 VanDerWaalsContact O-CG1 3.23Å; K243-I247 WeakPolarHBondContact O-CG1 2.95Å; K243-I247 PolarHBondContact O-N 3.42Å; C244-I247 PolarHBondContact O-N 3.18Å; I247-R249 VanDerWaalsContact C-N 3.35Å; I247-R249 PolarHBondContact O-N 2.81Å; I247-S250 WeakPolarHBondContact CA-OG 3.32Å; I247-S250 PolarHBondContact O-N 2.79Å; I247-S250 PolarHBondContact O-OG 3.45Å; I247-N251 PolarHBondContact O-N 3.02Å
248	L	72.4	Confident	66.6	Low	79 Å²	79	88.4 Å²	88.4	41%	0.414	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-36.7	175.5	-68.1	172	0	0	0	112.4	F203 C244 E246	F203-L248 HydrophobicContact CD1-CD2 4.3Å; F203-L248 HydrophobicContact CE1-CD2 3.72Å; F203-L248 HydrophobicContact CE1-CG 4.49Å; F203-L248 HydrophobicContact CZ-CD2 4.39Å; C244-L248 WeakPolarHBondContact O-CB 3.43Å; C244-L248 VanDerWaalsContact O-CG 3.26Å; C244-L248 WeakPolarHBondContact O-CG 3.49Å; C244-L248 PolarHBondContact O-N 3.05Å; E246-L248 VanDerWaalsContact C-N 3.31Å; E246-L248 PolarHBondContact O-N 2.73Å
249	R	67.3	Low	64.1	Low	195 Å²	195	96.7 Å²	96.7	74%	0.736	54%	0.54	S	S	*	.	H	α-helix	trans	-69.2	-31.2	173.6	-77.7	173.4	178.7	160.6	1.2	113.2	T245 E246 I247	T245-R249 WeakPolarHBondContact O-CB 3.12Å; T245-R249 WeakPolarHBondContact O-CG 3.14Å; T245-R249 PolarHBondContact O-N 2.97Å; E246-R249 PolarHBondContact O-N 3.12Å; I247-R249 VanDerWaalsContact C-N 3.35Å; I247-R249 PolarHBondContact O-N 2.81Å
250	S	63.1	Low	61.7	Low	81 Å²	81	99.7 Å²	99.7	57%	0.566	56%	0.559	S	S	*	*	H	α-helix	trans	-84.9	-12.6	-175.8	68.7	0	0	0	0	114.9	E246 I247 P252	E246-S250 WeakPolarHBondContact O-CB 3.24Å; E246-S250 PolarHBondContact O-N 3.27Å; E246-S250 PolarHBondContact O-OG 3.43Å; I247-S250 WeakPolarHBondContact CA-OG 3.32Å; I247-S250 PolarHBondContact O-N 2.79Å; I247-S250 PolarHBondContact O-OG 3.45Å; S250-P252 WeakPolarHBondContact O-CD 3.45Å
251	N	52.9	Low	59.3	Low	121 Å²	121	101.2 Å²	101.2	65%	0.647	57%	0.569	S	S	*	*	S	Bend	trans	-120.7	82.3	175.4	-82.5	-48.4	0	0	0	110.8	I247	I247-N251 PolarHBondContact O-N 3.02Å
252	P	45.3	Very low	57.6	Low	101 Å²	101	104.4 Å²	104.4	66%	0.656	58%	0.583	S	S	*	*			trans	-85.7	117.3	-178	32.5	-30.1	0	0	0	111.4	S250	S250-P252 WeakPolarHBondContact O-CD 3.45Å
253	A	42.2	Very low	55.8	Low	96 Å²	96	107.3 Å²	107.3	79%	0.793	60%	0.595	S	S	*	*			trans	-118.4	81.4	148.5	0	0	0	0	0	106.6
254	H	42.3	Very low	54	Low	171 Å²	171	109.4 Å²	109.4	79%	0.792	60%	0.6	S	S	*	*				81.9	150.5	108.9	-78.7	30.6	0	0	0	114.6
255	P	34	Very low	52.4	Low	130 Å²	130	115.7 Å²	115.7	84%	0.844	62%	0.623	S	S	*	*				-99.6	136.5	-88.3	29.8	-12	0	0	0	112.8
256	G	38.2	Very low	51	Low	64 Å²	64	115.5 Å²	115.5	66%	0.66	62%	0.62	S	S	*	*			trans	163.6	47.2	177	0	0	0	0	0	114.9	V258	G256-V258 VanDerWaalsContact C-N 3.26Å; G256-V258 PolarHBondContact O-N 2.81Å
257	D	35.9	Very low	49.9	Very low	177 Å²	177	114.2 Å²	114.2	95%	0.947	62%	0.621	S	S	*	*			trans	-62.6	87.3	175.7	-67.6	-43.3	0	0	0	110.5
258	V	39.8	Very low	49	Very low	122 Å²	122	113.4 Å²	113.4	74%	0.739	62%	0.618	S	S	*	*			trans	-95.6	113.6	167.5	-179.6	0	0	0	0	106.9	G256 V260	G256-V258 VanDerWaalsContact C-N 3.26Å; G256-V258 PolarHBondContact O-N 2.81Å; V258-V260 PolarHBondContact O-N 3.36Å
259	H	41.7	Very low	49.2	Very low	180 Å²	180	115 Å²	115	83%	0.833	63%	0.627	S	S	*	*			trans	-39.3	120.6	165.2	-117.2	-86.2	0	0	0	110.3	P261	H259-P261 WeakPolarHBondContact O-CD 3.46Å; H259-P261 VanDerWaalsContact O-N 3.13Å
260	V	40.2	Very low	49.7	Very low	77 Å²	77	106 Å²	106	47%	0.467	59%	0.594	S	S	.	*			trans	-61.5	116	171.8	179.9	0	0	0	0	107.4	V258 E262 W291	V258-V260 PolarHBondContact O-N 3.36Å; V260-E262 PolarHBondContact O-N 3Å; V260-W291 HydrophobicContact CG2-CH2 3.51Å; V260-W291 HydrophobicContact CG2-CZ2 3.89Å; V260-W291 HydrophobicContact CG2-CZ3 4.42Å
261	P	40.5	Very low	50.2	Low	78 Å²	78	109.2 Å²	109.2	51%	0.506	60%	0.6	S	S	.	*			trans	-65.5	135.9	175.4	-14.7	29.3	0	0	0	108.7	H259 N263 R264	H259-P261 WeakPolarHBondContact O-CD 3.46Å; H259-P261 VanDerWaalsContact O-N 3.13Å; P261-N263 PolarHBondContact O-N 2.93Å; P261-R264 PolarHBondContact O-N 3.22Å
262	E	48.3	Very low	51	Low	109 Å²	109	104.9 Å²	104.9	51%	0.509	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-54.1	-13.3	176.8	-102.7	176.3	148.3	0	0	114.4	V260 R264 R265	V260-E262 PolarHBondContact O-N 3Å; E262-R264 VanDerWaalsContact C-N 3.27Å; E262-R264 PolarHBondContact O-N 3Å; E262-R265 IonicContact OE1-CZ 3.84Å; E262-R265 IonicContact OE1-NH1 3.99Å; E262-R265 IonicContact OE1-NH2 3.13Å; E262-R265 PolarHBondContact OE1-NH2 2.86Å; E262-R265 VanDerWaalsContact OE1-NH2 3.13Å
263	N	49.3	Very low	52	Low	154 Å²	154	102 Å²	102	82%	0.824	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-79.4	9.4	-178.9	-64.3	-14.4	0	0	0	115.2	P261	P261-N263 PolarHBondContact O-N 2.93Å
264	R	49.8	Very low	53.2	Low	148 Å²	148	101.3 Å²	101.3	56%	0.558	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-117.1	12.3	174.2	-70.7	-165.4	-178.8	-169.1	2.1	114.7	P261 E262 L266 P289	P261-R264 PolarHBondContact O-N 3.22Å; E262-R264 VanDerWaalsContact C-N 3.27Å; E262-R264 PolarHBondContact O-N 3Å; R264-L266 PolarHBondContact O-N 3.16Å; R264-P289 HydrophobicContact CB-CG 4.21Å
265	R	52.8	Low	54.6	Low	139 Å²	139	97.2 Å²	97.2	53%	0.525	52%	0.521	S	S	.	.			trans	-68.7	118.4	163.8	-64.6	-173.6	-171.5	157.6	14	107.2	E262	E262-R265 IonicContact OE1-CZ 3.84Å; E262-R265 IonicContact OE1-NH1 3.99Å; E262-R265 IonicContact OE1-NH2 3.13Å; E262-R265 PolarHBondContact OE1-NH2 2.86Å; E262-R265 VanDerWaalsContact OE1-NH2 3.13Å
266	L	54.6	Low	56.5	Low	47 Å²	47	91.8 Å²	91.8	25%	0.246	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.7	166.5	-106.2	107.6	0	0	0	106.2	R264 V268 Y280 C287	R264-L266 PolarHBondContact O-N 3.16Å; L266-V268 HydrophobicContact CB-CB 4.33Å; L266-V268 HydrophobicContact CB-CG2 3.91Å; L266-V268 HydrophobicContact CD2-CG2 3.63Å; L266-V268 HydrophobicContact CG-CG2 4.36Å; L266-V268 PolarHBondContact O-N 3.38Å; L266-Y280 HydrophobicContact CD1-CD1 3.55Å; L266-Y280 HydrophobicContact CD1-CD2 4.02Å; L266-Y280 HydrophobicContact CD1-CE1 3.08Å; L266-Y280 HydrophobicContact CD1-CE2 3.59Å; L266-Y280 HydrophobicContact CD1-CG 4.03Å; L266-Y280 WeakPolarHBondContact CD1-OH 2.7Å; L266-Y280 HydrophobicContact CG-CE1 4.38Å; L266-C287 HydrophobicContact CB-CB 4.1Å; L266-C287 PolarHBondContact N-O 1.99Å
267	P	58	Low	58	Low	89 Å²	89	92.5 Å²	92.5	58%	0.578	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	46.8	176.4	33.2	-35.4	0	0	0	110
268	V	61	Low	59.2	Low	24 Å²	24	91.5 Å²	91.5	15%	0.145	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	108.5	-179.3	-176.8	0	0	0	0	105.8	L266 C270 H275 T286 C287 F418	L266-V268 HydrophobicContact CB-CB 4.33Å; L266-V268 HydrophobicContact CB-CG2 3.91Å; L266-V268 HydrophobicContact CD2-CG2 3.63Å; L266-V268 HydrophobicContact CG-CG2 4.36Å; L266-V268 PolarHBondContact O-N 3.38Å; V268-C270 PolarHBondContact O-N 3.38Å; V268-H275 VanDerWaalsContact CG1-O 3.31Å; V268-H275 WeakPolarHBondContact CG1-O 3.38Å; V268-T286 WeakPolarHBondContact O-CA 3Å; V268-C287 HydrophobicContact CB-CB 4.2Å; V268-C287 PolarHBondContact O-N 2.93Å; V268-C287 VanDerWaalsContact O-N 3.11Å; V268-F418 HydrophobicContact CG2-CE1 3.6Å; V268-F418 HydrophobicContact CG2-CZ 3.48Å; V268-F418 VanDerWaalsContact CG2-CZ 3.48Å
269	N	76.2	Confident	60.3	Low	111 Å²	111	87.4 Å²	87.4	59%	0.594	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	126.9	170.3	-78.4	5.5	0	0	0	108.4	G285	N269-G285 CarbonylContact C-O 3.56Å; N269-G285 WeakPolarHBondContact CA-O 3.01Å
270	C	77.1	Confident	61.8	Low	7 Å²	7	81.7 Å²	81.7	5%	0.047	43%	0.429	C	S	.	.			trans	-120.9	133.4	-177.6	68	0	0	0	0	109.2	V268 H275 C282 G285 T286	V268-C270 PolarHBondContact O-N 3.38Å; C270-H275 HydrophobicContact CB-CB 3.76Å; C270-C282 HydrophobicContact CB-CB 3.56Å; C270-C282 WeakPolarHBondContact CB-SG 3.19Å; C270-C282 PolarHBondContact O-SG 3.21Å; C270-C282 WeakPolarHBondContact SG-CA 3.33Å; C270-C282 WeakPolarHBondContact SG-CB 3.38Å; C270-C282 CovalentContact SG-SG 2.02Å; C270-C282 PolarHBondContact SG-SG 3.45Å; C270-G285 PolarHBondContact N-O 3.47Å; C270-G285 WeakPolarHBondContact O-CA 3.35Å; C270-T286 PolarHBondContact SG-N 3.23Å; C270-T286 PolarHBondContact SG-O 2.68Å; C270-T286 VanDerWaalsContact SG-O 3.4Å
271	E	74.1	Confident	63.3	Low	149 Å²	149	78.5 Å²	78.5	70%	0.696	41%	0.41	S	S	*	.	S	Bend	trans	-94	-35.7	165.8	-68.4	-178	160.8	0	0	109.8	S224 H275	S224-E271 PolarHBondContact OG-O 3.29Å; E271-H275 PolarHBondContact N-ND1 3.27Å
272	T	70.2	Confident	65.2	Low	29 Å²	29	75.2 Å²	75.2	18%	0.178	39%	0.389	C	S	.	.	S	Bend	trans	-132.9	165.7	179.7	66.3	0	0	0	0	110.5	L274 H275 C282	T272-L274 PolarHBondContact O-N 3.13Å; T272-L274 VanDerWaalsContact O-N 3.09Å; T272-L274 PolarHBondContact OG1-N 2.81Å; T272-H275 PolarHBondContact O-N 2.92Å; T272-H275 VanDerWaalsContact O-N 3.13Å; T272-H275 PolarHBondContact OG1-CD2 3.04Å; T272-C282 WeakPolarHBondContact O-CB 3.47Å
273	N	65.2	Low	66.4	Low	41 Å²	41	73.8 Å²	73.8	22%	0.219	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-60.2	-17.5	175.7	-68.9	-46.3	0	0	0	113.3	H275 C276 C282	N273-H275 PolarHBondContact O-N 2.68Å; N273-C276 PolarHBondContact O-N 3.25Å; N273-C282 PolarHBondContact OD1-N 3.32Å
274	L	68.5	Low	67.5	Low	81 Å²	81	71.6 Å²	71.6	42%	0.424	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-67.8	-22.4	176.3	-104.3	74.6	0	0	0	114.3	C194 M221 T272 C276	C194-L274 HydrophobicContact CB-CD2 3.54Å; C194-L274 WeakPolarHBondContact O-CD2 3.49Å; M221-L274 HydrophobicContact CE-CD1 3.07Å; M221-L274 HydrophobicContact CE-CD2 4.38Å; M221-L274 HydrophobicContact CE-CG 4.29Å; M221-L274 HydrophobicContact SD-CD1 3.94Å; T272-L274 PolarHBondContact O-N 3.13Å; T272-L274 VanDerWaalsContact O-N 3.09Å; T272-L274 PolarHBondContact OG1-N 2.81Å; L274-C276 PolarHBondContact O-N 3.24Å
275	H	70.6	Confident	68.5	Low	85 Å²	85	66.1 Å²	66.1	39%	0.394	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-78.2	-7.7	-179.2	-63.9	-156.4	0	0	0	110.8	V268 C270 E271 T272 N273	V268-H275 VanDerWaalsContact CG1-O 3.31Å; V268-H275 WeakPolarHBondContact CG1-O 3.38Å; C270-H275 HydrophobicContact CB-CB 3.76Å; E271-H275 PolarHBondContact N-ND1 3.27Å; T272-H275 PolarHBondContact O-N 2.92Å; T272-H275 VanDerWaalsContact O-N 3.13Å; T272-H275 PolarHBondContact OG1-CD2 3.04Å; N273-H275 PolarHBondContact O-N 2.68Å
276	C	74.4	Confident	69.6	Low	16 Å²	16	61.4 Å²	61.4	11%	0.108	36%	0.355	C	S	.	.	S	Bend	trans	-104.6	134.5	-176.1	-58	0	0	0	0	110.8	N273 L274 Y280 C287	N273-C276 PolarHBondContact O-N 3.25Å; L274-C276 PolarHBondContact O-N 3.24Å; C276-Y280 WeakPolarHBondContact CB-O 3.29Å; C276-C287 WeakPolarHBondContact CA-SG 3.37Å; C276-C287 HydrophobicContact CB-CB 3.82Å; C276-C287 WeakPolarHBondContact CB-SG 3.37Å; C276-C287 WeakPolarHBondContact SG-CA 3.34Å; C276-C287 WeakPolarHBondContact SG-CB 2.94Å; C276-C287 CovalentContact SG-SG 2.04Å; C276-C287 PolarHBondContact SG-SG 2.96Å
277	S	69.5	Low	70.7	Confident	79 Å²	79	59.2 Å²	59.2	55%	0.552	34%	0.344	S	S	*	.			trans	-56.2	158.4	171.9	-60.4	0	0	0	0	111.4	G279 Y280	S277-G279 PolarHBondContact O-N 2.83Å; S277-Y280 WeakPolarHBondContact O-CB 2.9Å; S277-Y280 PolarHBondContact O-N 3.05Å
278	N	60.4	Low	71.4	Confident	157 Å²	157	56.4 Å²	56.4	84%	0.84	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	128.6	173.3	-77.3	-11.6	0	0	0	111
279	G	63.2	Low	71.6	Confident	36 Å²	36	57.2 Å²	57.2	37%	0.371	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	12.6	-175.3	0	0	0	0	0	114.9	S277 P289 G290	S277-G279 PolarHBondContact O-N 2.83Å; G279-P289 CarbonylContact O-C 3.42Å; G279-G290 WeakPolarHBondContact O-CA 3.43Å; G279-G290 PolarHBondContact O-N 3.44Å; G279-G290 VanDerWaalsContact O-O 3.1Å
280	Y	72.9	Confident	70.7	Confident	60 Å²	60	52.6 Å²	52.6	24%	0.235	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	148.2	171.2	-69.6	-100.1	0	0	0	110.6	L266 C276 S277 C287 V288 P289	L266-Y280 HydrophobicContact CD1-CD1 3.55Å; L266-Y280 HydrophobicContact CD1-CD2 4.02Å; L266-Y280 HydrophobicContact CD1-CE1 3.08Å; L266-Y280 HydrophobicContact CD1-CE2 3.59Å; L266-Y280 HydrophobicContact CD1-CG 4.03Å; L266-Y280 WeakPolarHBondContact CD1-OH 2.7Å; L266-Y280 HydrophobicContact CG-CE1 4.38Å; C276-Y280 WeakPolarHBondContact CB-O 3.29Å; S277-Y280 WeakPolarHBondContact O-CB 2.9Å; S277-Y280 PolarHBondContact O-N 3.05Å; Y280-C287 HydrophobicContact CD1-CB 4.49Å; Y280-V288 CarbonylContact C-O 3.59Å; Y280-V288 VanDerWaalsContact CA-O 3.23Å; Y280-V288 WeakPolarHBondContact CA-O 3.18Å; Y280-V288 VanDerWaalsContact CD1-C 3.42Å; Y280-P289 HydrophobicContact CD1-CB 4.33Å; Y280-P289 HydrophobicContact CD1-CG 4.21Å; Y280-P289 VanDerWaalsContact CD1-N 3.34Å; Y280-P289 HydrophobicContact CE1-CB 3.99Å; Y280-P289 HydrophobicContact CE1-CG 3.62Å
281	V	73.2	Confident	69.4	Low	10 Å²	10	61.7 Å²	61.7	6%	0.061	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	146.9	177.4	-66.1	0	0	0	0	110	T200 I227 H283 C287 V288	T200-V281 HydrophobicContact CG2-CG1 3.88Å; I227-V281 HydrophobicContact CD1-CG1 4.21Å; V281-H283 PolarHBondContact O-N 2.89Å; V281-C287 WeakPolarHBondContact O-CA 3.32Å; V281-V288 HydrophobicContact CG2-CG2 3.65Å; V281-V288 PolarHBondContact N-O 3.29Å; V281-V288 WeakPolarHBondContact O-CG2 3.12Å; V281-V288 PolarHBondContact O-N 3.07Å
282	C	78.8	Confident	67.9	Low	9 Å²	9	61.9 Å²	61.9	6%	0.061	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	113.3	179.5	-176.3	0	0	0	0	110.8	C270 T272 N273	C270-C282 HydrophobicContact CB-CB 3.56Å; C270-C282 WeakPolarHBondContact CB-SG 3.19Å; C270-C282 PolarHBondContact O-SG 3.21Å; C270-C282 WeakPolarHBondContact SG-CA 3.33Å; C270-C282 WeakPolarHBondContact SG-CB 3.38Å; C270-C282 CovalentContact SG-SG 2.02Å; C270-C282 PolarHBondContact SG-SG 3.45Å; T272-C282 WeakPolarHBondContact O-CB 3.47Å; N273-C282 PolarHBondContact OD1-N 3.32Å
283	H	74.8	Confident	66.4	Low	78 Å²	78	67.6 Å²	67.6	36%	0.361	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	120.9	178.5	-175.8	67.2	0	0	0	110.8	L241 V281 G285 T286 V288	L241-H283 HydrophobicContact CD2-CB 4.41Å; L241-H283 VanDerWaalsContact CD2-ND1 3.34Å; L241-H283 WeakPolarHBondContact CD2-ND1 3.04Å; V281-H283 PolarHBondContact O-N 2.89Å; H283-G285 PolarHBondContact O-N 3.07Å; H283-G285 VanDerWaalsContact O-N 3.16Å; H283-T286 PolarHBondContact N-O 3.21Å; H283-T286 PolarHBondContact O-N 2.76Å; H283-T286 PolarHBondContact O-OG1 3.3Å; H283-V288 HydrophobicContact CB-CB 4.46Å; H283-V288 HydrophobicContact CB-CG1 4.08Å; H283-V288 HydrophobicContact CB-CG2 3.53Å
284	S	71.8	Confident	65.1	Low	108 Å²	108	72.6 Å²	72.6	76%	0.755	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	37.2	176.3	-55.7	0	0	0	0	113.7
285	G	71.4	Confident	63.5	Low	34 Å²	34	77.2 Å²	77.2	35%	0.351	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	1.5	-179.6	0	0	0	0	0	115.1	N269 C270 H283	N269-G285 CarbonylContact C-O 3.56Å; N269-G285 WeakPolarHBondContact CA-O 3.01Å; C270-G285 PolarHBondContact N-O 3.47Å; C270-G285 WeakPolarHBondContact O-CA 3.35Å; H283-G285 PolarHBondContact O-N 3.07Å; H283-G285 VanDerWaalsContact O-N 3.16Å
286	T	75.2	Confident	62	Low	39 Å²	39	78.9 Å²	78.9	24%	0.239	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.2	179.8	26.2	0	0	0	0	112.8	V268 C270 H283 V288	V268-T286 WeakPolarHBondContact O-CA 3Å; C270-T286 PolarHBondContact SG-N 3.23Å; C270-T286 PolarHBondContact SG-O 2.68Å; C270-T286 VanDerWaalsContact SG-O 3.4Å; H283-T286 PolarHBondContact N-O 3.21Å; H283-T286 PolarHBondContact O-N 2.76Å; H283-T286 PolarHBondContact O-OG1 3.3Å; T286-V288 PolarHBondContact O-N 3.39Å
287	C	77	Confident	60.2	Low	1 Å²	1	84.2 Å²	84.2	1%	0.007	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	108.1	172.7	-67.1	0	0	0	0	111	L266 V268 C276 Y280 V281	L266-C287 HydrophobicContact CB-CB 4.1Å; L266-C287 PolarHBondContact N-O 1.99Å; V268-C287 HydrophobicContact CB-CB 4.2Å; V268-C287 PolarHBondContact O-N 2.93Å; V268-C287 VanDerWaalsContact O-N 3.11Å; C276-C287 WeakPolarHBondContact CA-SG 3.37Å; C276-C287 HydrophobicContact CB-CB 3.82Å; C276-C287 WeakPolarHBondContact CB-SG 3.37Å; C276-C287 WeakPolarHBondContact SG-CA 3.34Å; C276-C287 WeakPolarHBondContact SG-CB 2.94Å; C276-C287 CovalentContact SG-SG 2.04Å; C276-C287 PolarHBondContact SG-SG 2.96Å; Y280-C287 HydrophobicContact CD1-CB 4.49Å; V281-C287 WeakPolarHBondContact O-CA 3.32Å
288	V	74.6	Confident	58.8	Low	30 Å²	30	84.8 Å²	84.8	18%	0.182	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	146.9	173.6	-61	0	0	0	0	109.7	Y280 V281 H283 T286 G290	Y280-V288 CarbonylContact C-O 3.59Å; Y280-V288 VanDerWaalsContact CA-O 3.23Å; Y280-V288 WeakPolarHBondContact CA-O 3.18Å; Y280-V288 VanDerWaalsContact CD1-C 3.42Å; V281-V288 HydrophobicContact CG2-CG2 3.65Å; V281-V288 PolarHBondContact N-O 3.29Å; V281-V288 WeakPolarHBondContact O-CG2 3.12Å; V281-V288 PolarHBondContact O-N 3.07Å; H283-V288 HydrophobicContact CB-CB 4.46Å; H283-V288 HydrophobicContact CB-CG1 4.08Å; H283-V288 HydrophobicContact CB-CG2 3.53Å; T286-V288 PolarHBondContact O-N 3.39Å; V288-G290 PolarHBondContact O-N 1.97Å; V288-G290 VanDerWaalsContact O-N 3.1Å
289	P	65	Low	57.6	Low	41 Å²	41	85.1 Å²	85.1	27%	0.266	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	121.2	176	-21.9	28.7	0	0	0	110.7	R264 G279 Y280	R264-P289 HydrophobicContact CB-CG 4.21Å; G279-P289 CarbonylContact O-C 3.42Å; Y280-P289 HydrophobicContact CD1-CB 4.33Å; Y280-P289 HydrophobicContact CD1-CG 4.21Å; Y280-P289 VanDerWaalsContact CD1-N 3.34Å; Y280-P289 HydrophobicContact CE1-CB 3.99Å; Y280-P289 HydrophobicContact CE1-CG 3.62Å
290	G	56.5	Low	56.2	Low	14 Å²	14	89.6 Å²	89.6	14%	0.144	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-71.3	125	159.3	0	0	0	0	0	107.3	G279 V288 H292	G279-G290 WeakPolarHBondContact O-CA 3.43Å; G279-G290 PolarHBondContact O-N 3.44Å; G279-G290 VanDerWaalsContact O-O 3.1Å; V288-G290 PolarHBondContact O-N 1.97Å; V288-G290 VanDerWaalsContact O-N 3.1Å; G290-H292 PolarHBondContact O-N 3.25Å
291	W	50.7	Low	54.6	Low	198 Å²	198	91.8 Å²	91.8	75%	0.75	52%	0.517	S	S	*	.	S	Bend	trans	-61.4	107.5	-172.5	-63.5	84.7	0	0	0	111.5	V260	V260-W291 HydrophobicContact CG2-CH2 3.51Å; V260-W291 HydrophobicContact CG2-CZ2 3.89Å; V260-W291 HydrophobicContact CG2-CZ3 4.42Å
292	H	43	Very low	52.7	Low	153 Å²	153	98.7 Å²	98.7	71%	0.708	55%	0.548	S	S	*	.			trans	160.2	105.4	137.7	-91.6	-77	0	0	0	112.9	G290	G290-H292 PolarHBondContact O-N 3.25Å
293	E	38.2	Very low	50.9	Low	149 Å²	149	104.3 Å²	104.3	70%	0.696	59%	0.588	S	S	*	*				177.3	88.5	128.3	-97.8	-170.6	-167.9	0	0	108.5
294	I	37.2	Very low	48.9	Very low	146 Å²	146	109.4 Å²	109.4	75%	0.749	61%	0.609	S	S	*	*			trans	-102.8	97.2	156.5	-59.8	174.9	0	0	0	105.2
295	K	34.6	Very low	47.2	Very low	178 Å²	178	107.7 Å²	107.7	77%	0.774	61%	0.608	S	S	*	*			trans	-93.3	96.6	157.9	-79.4	178.6	177	171.3	0	106.3
296	D	39.5	Very low	45.6	Very low	120 Å²	120	115.6 Å²	115.6	64%	0.642	63%	0.633	S	S	*	*			trans	171.6	121.7	134.1	-132.7	-49.9	0	0	0	110.6	S298	D296-S298 PolarHBondContact OD1-OG 3.47Å
297	P	36.7	Very low	43.5	Very low	129 Å²	129	119.1 Å²	119.1	84%	0.838	66%	0.659	S	S	*	*			trans	-101	88.5	167.8	33.8	-21.7	0	0	0	109.8
298	S	40	Very low	41.7	Very low	91 Å²	91	126.6 Å²	126.6	64%	0.636	70%	0.697	S	S	*	*			trans	-156.1	1.9	174.7	44.9	0	0	0	0	118.4	D296	D296-S298 PolarHBondContact OD1-OG 3.47Å
299	D	36.4	Very low	39.8	Very low	163 Å²	163	131.5 Å²	131.5	87%	0.872	73%	0.727	S	S	*	*			trans	-125.8	48.7	-170.5	-119.9	-6.1	0	0	0	116
300	C	33.7	Very low	38.2	Very low	131 Å²	131	133.3 Å²	133.3	89%	0.885	75%	0.753	S	S	*	*			trans	-132.9	89.7	170.7	-73.9	0	0	0	0	111.4
301	A	37.7	Very low	37.3	Very low	106 Å²	106	136 Å²	136	88%	0.876	78%	0.781	S	S	*	*			trans	-79.5	125.1	163.2	0	0	0	0	0	109.8
302	E	33.1	Very low	36.5	Very low	154 Å²	154	135.1 Å²	135.1	72%	0.72	79%	0.789	S	S	*	*			trans	-52	149.3	179	-68.1	-179.6	132.1	0	0	114.1
303	S	41	Very low	36.6	Very low	127 Å²	127	132 Å²	132	89%	0.888	78%	0.78	S	S	*	*			trans	-137.9	112.6	138.6	-78.2	0	0	0	0	109.8
304	K	33.7	Very low	37.4	Very low	186 Å²	186	133.7 Å²	133.7	81%	0.809	79%	0.789	S	S	*	*			trans	-58.8	140.2	178.2	-64.8	176.4	176.6	175.5	0	111.4
305	G	35.4	Very low	38.9	Very low	72 Å²	72	131 Å²	131	74%	0.742	78%	0.776	S	S	*	*			trans	-170.8	58.6	177.5	0	0	0	0	0	117.4
306	K	38.8	Very low	40.8	Very low	200 Å²	200	128.3 Å²	128.3	87%	0.87	77%	0.766	S	S	*	*			trans	55.1	108.5	150.8	-73	177.6	176.7	176.1	0	119.8
307	S	31.2	Very low	42.8	Very low	112 Å²	112	122.8 Å²	122.8	78%	0.783	74%	0.737	S	S	*	*			trans	-59.1	128.2	152	-171.7	0	0	0	0	111.4
308	I	38	Very low	45	Very low	158 Å²	158	119.4 Å²	119.4	81%	0.81	72%	0.72	S	S	*	*			trans	-129.7	124.2	153.6	-62.9	-177	0	0	0	108.1
309	V	35.3	Very low	46.9	Very low	134 Å²	134	118 Å²	118	81%	0.812	71%	0.708	S	S	*	*			trans	-63.3	140.3	177.6	172	0	0	0	0	111.7
310	G	31.7	Very low	49.1	Very low	79 Å²	79	114.3 Å²	114.3	81%	0.814	69%	0.688	S	S	*	*			trans	113.2	127.9	144.9	0	0	0	0	0	116.3
311	G	37	Very low	51.2	Low	70 Å²	70	116.4 Å²	116.4	72%	0.722	68%	0.682	S	S	*	*			trans	130	101.1	160.6	0	0	0	0	0	113.5	T313	G311-T313 PolarHBondContact O-N 3.12Å
312	I	35	Very low	53.2	Low	179 Å²	179	115.6 Å²	115.6	92%	0.918	66%	0.663	S	S	*	*			trans	-66	100.8	175.8	-57.5	163.1	0	0	0	108.5
313	T	44.7	Very low	55.6	Low	87 Å²	87	108.8 Å²	108.8	53%	0.534	63%	0.632	S	S	.	*			trans	-137.5	112	164.3	54.3	0	0	0	0	108.1	G311 D315	G311-T313 PolarHBondContact O-N 3.12Å; T313-D315 PolarHBondContact O-N 3.18Å
314	Q	55.8	Low	57.5	Low	186 Å²	186	107.2 Å²	107.2	87%	0.869	62%	0.619	S	S	*	*			trans	-80.2	102.2	-174.5	-162.6	170.4	5.3	0	0	108.7	E316	Q314-E316 PolarHBondContact O-N 3.11Å
315	D	67.4	Low	59.3	Low	89 Å²	89	107.8 Å²	107.8	48%	0.476	62%	0.621	S	S	.	*			trans	-65.3	124.8	173.8	-73.7	-25.5	0	0	0	109.8	T313 G335 R336	T313-D315 PolarHBondContact O-N 3.18Å; D315-G335 VanDerWaalsContact OD1-CA 3.24Å; D315-G335 WeakPolarHBondContact OD1-CA 3.31Å; D315-R336 HydrophobicContact CB-CB 4.02Å; D315-R336 HydrophobicContact CB-CG 4.41Å; D315-R336 PolarHBondContact OD1-N 2.04Å
316	E	74.2	Confident	60.7	Low	121 Å²	121	109 Å²	109	57%	0.565	62%	0.624	S	S	*	*	S	Bend	trans	-85.5	-20.4	-178.1	-165.1	179.2	172.3	0	0	112.2	Q314 R336 Q337	Q314-E316 PolarHBondContact O-N 3.11Å; E316-R336 WeakPolarHBondContact CA-O 3.17Å; E316-R336 VanDerWaalsContact CB-O 3.25Å; E316-R336 WeakPolarHBondContact CB-O 2.98Å; E316-R336 PolarHBondContact N-O 3.23Å; E316-Q337 HydrophobicContact CB-CG 4.49Å; E316-Q337 PolarHBondContact OE2-NE2 2.81Å; E316-Q337 VanDerWaalsContact OE2-NE2 3.1Å
317	C	83	Confident	62.7	Low	5 Å²	5	99.7 Å²	99.7	3%	0.034	59%	0.585	C	S	.	*			trans	-145.9	148.8	175.6	60.3	0	0	0	0	110.2	D322 C323 C329 R336 Q337 C338	C317-D322 HydrophobicContact CB-CB 3.92Å; C317-C323 VanDerWaalsContact CB-SG 3.58Å; C317-C329 HydrophobicContact CB-CB 3.8Å; C317-C329 WeakPolarHBondContact CB-SG 3Å; C317-C329 PolarHBondContact O-SG 2.78Å; C317-C329 WeakPolarHBondContact SG-CA 2.99Å; C317-C329 WeakPolarHBondContact SG-CB 3.22Å; C317-C329 CovalentContact SG-SG 2.04Å; C317-C329 PolarHBondContact SG-SG 3.17Å; C317-R336 WeakPolarHBondContact O-CB 3.4Å; C317-R336 WeakPolarHBondContact O-CD 3.46Å; C317-Q337 VanDerWaalsContact SG-C 3.52Å; C317-C338 VanDerWaalsContact CB-SG 3.58Å
318	A	81.5	Confident	65.1	Low	58 Å²	58	99.4 Å²	99.4	48%	0.479	57%	0.571	S	S	.	*	S	Bend	trans	-101.8	-35	171.9	0	0	0	0	0	111.4	D322 R336	A318-D322 WeakPolarHBondContact CA-OD2 3.35Å; A318-D322 WeakPolarHBondContact CB-OD2 3.47Å; A318-D322 PolarHBondContact N-OD2 3.33Å; A318-R336 PolarHBondContact O-NH1 3.17Å
319	T	81.2	Confident	67.3	Low	62 Å²	62	93.1 Å²	93.1	38%	0.38	54%	0.541	S	S	.	.	S	Bend	trans	-139.1	168.1	-179.2	68.3	0	0	0	0	111.1	F321 D322 C329	T319-F321 PolarHBondContact O-N 3.3Å; T319-F321 VanDerWaalsContact O-N 3.15Å; T319-F321 PolarHBondContact OG1-N 2.67Å; T319-D322 PolarHBondContact N-OD2 3.11Å; T319-D322 WeakPolarHBondContact O-CB 3.46Å; T319-D322 PolarHBondContact O-N 2.75Å; T319-D322 VanDerWaalsContact O-N 3.12Å; T319-D322 PolarHBondContact OG1-OD2 3.35Å; T319-C329 VanDerWaalsContact C-CB 3.44Å; T319-C329 WeakPolarHBondContact O-CB 3.5Å
320	D	81.4	Confident	69.6	Low	85 Å²	85	89 Å²	89	46%	0.455	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-60.3	-21.3	176.1	-69.4	-11.5	0	0	0	113.1	D322 C323 C329	D320-D322 VanDerWaalsContact C-N 3.33Å; D320-C323 PolarHBondContact O-N 2.04Å; D320-C329 PolarHBondContact OD1-N 3.37Å
321	F	77.3	Confident	72	Confident	175 Å²	175	93.5 Å²	93.5	77%	0.768	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-75.5	-20.3	177.9	-63	-75.8	0	0	0	113.6	T319 C323	T319-F321 PolarHBondContact O-N 3.3Å; T319-F321 VanDerWaalsContact O-N 3.15Å; T319-F321 PolarHBondContact OG1-N 2.67Å; F321-C323 PolarHBondContact O-N 2.84Å
322	D	81.6	Confident	73.6	Confident	88 Å²	88	92.9 Å²	92.9	47%	0.471	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-76.8	-7.6	174.9	-56.7	-50.5	0	0	0	111.8	C317 A318 T319 D320	C317-D322 HydrophobicContact CB-CB 3.92Å; A318-D322 WeakPolarHBondContact CA-OD2 3.35Å; A318-D322 WeakPolarHBondContact CB-OD2 3.47Å; A318-D322 PolarHBondContact N-OD2 3.33Å; T319-D322 PolarHBondContact N-OD2 3.11Å; T319-D322 WeakPolarHBondContact O-CB 3.46Å; T319-D322 PolarHBondContact O-N 2.75Å; T319-D322 VanDerWaalsContact O-N 3.12Å; T319-D322 PolarHBondContact OG1-OD2 3.35Å; D320-D322 VanDerWaalsContact C-N 3.33Å
323	C	83.2	Confident	75.6	Confident	11 Å²	11	89.5 Å²	89.5	7%	0.074	50%	0.5	C	S	.	.	S	Bend	trans	-103.2	123.9	-174.7	-66.7	0	0	0	0	112.4	C317 D320 F321 A327 C338	C317-C323 VanDerWaalsContact CB-SG 3.58Å; D320-C323 PolarHBondContact O-N 2.04Å; F321-C323 PolarHBondContact O-N 2.84Å; C323-A327 HydrophobicContact CB-CB 3.91Å; C323-A327 WeakPolarHBondContact CB-O 2.99Å; C323-C338 WeakPolarHBondContact CA-SG 3.43Å; C323-C338 HydrophobicContact CB-CB 3.7Å; C323-C338 WeakPolarHBondContact CB-SG 3.36Å; C323-C338 WeakPolarHBondContact SG-CA 3.3Å; C323-C338 WeakPolarHBondContact SG-CB 3.36Å; C323-C338 CovalentContact SG-SG 2.03Å; C323-C338 PolarHBondContact SG-SG 3.1Å
324	P	80	Confident	76.9	Confident	94 Å²	94	95.1 Å²	95.1	61%	0.61	51%	0.511	S	S	*	.	S	Bend	trans	-67.4	152.2	176.2	27.5	-33.6	0	0	0	111.5	A327	P324-A327 WeakPolarHBondContact O-CB 3.22Å; P324-A327 PolarHBondContact O-N 3.34Å
325	K	71	Confident	77.9	Confident	198 Å²	198	86.6 Å²	86.6	86%	0.861	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	46	168.1	-55.9	177.2	-180	177.9	0	114.9	A327	K325-A327 PolarHBondContact O-N 2.78Å
326	A	65.2	Low	78.7	Confident	97 Å²	97	87 Å²	87	80%	0.802	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	25.2	178.2	0	0	0	0	0	113.9
327	A	80.7	Confident	79.1	Confident	6 Å²	6	84.9 Å²	84.9	5%	0.05	46%	0.458	C	S	.	.			trans	-70.3	144.8	168.7	0	0	0	0	0	109.3	C323 P324 K325 C338	C323-A327 HydrophobicContact CB-CB 3.91Å; C323-A327 WeakPolarHBondContact CB-O 2.99Å; P324-A327 WeakPolarHBondContact O-CB 3.22Å; P324-A327 PolarHBondContact O-N 3.34Å; K325-A327 PolarHBondContact O-N 2.78Å; A327-C338 HydrophobicContact CB-CB 4.27Å
328	Q	81.6	Confident	79.2	Confident	106 Å²	106	86.3 Å²	86.3	50%	0.495	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	138.5	178.1	-74.6	177.2	-29	0	0	109.8	T330 K339	Q328-T330 HydrophobicContact CB-CG2 4.2Å; Q328-T330 PolarHBondContact O-N 2.93Å; Q328-K339 PolarHBondContact N-O 3.4Å; Q328-K339 PolarHBondContact O-N 3.28Å
329	C	85.4	Confident	79.1	Confident	25 Å²	25	90.4 Å²	90.4	17%	0.169	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	106	173.2	-173.9	0	0	0	0	108.8	C317 T319 D320	C317-C329 HydrophobicContact CB-CB 3.8Å; C317-C329 WeakPolarHBondContact CB-SG 3Å; C317-C329 PolarHBondContact O-SG 2.78Å; C317-C329 WeakPolarHBondContact SG-CA 2.99Å; C317-C329 WeakPolarHBondContact SG-CB 3.22Å; C317-C329 CovalentContact SG-SG 2.04Å; C317-C329 PolarHBondContact SG-SG 3.17Å; T319-C329 VanDerWaalsContact C-CB 3.44Å; T319-C329 WeakPolarHBondContact O-CB 3.5Å; D320-C329 PolarHBondContact OD1-N 3.37Å
330	T	83.8	Confident	78.5	Confident	49 Å²	49	91.1 Å²	91.1	30%	0.301	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	136.3	-175	58	0	0	0	0	110.7	Q328 S332 R336 Q337 K339	Q328-T330 HydrophobicContact CB-CG2 4.2Å; Q328-T330 PolarHBondContact O-N 2.93Å; T330-S332 PolarHBondContact O-N 3.21Å; T330-R336 WeakPolarHBondContact O-CA 3.4Å; T330-Q337 PolarHBondContact N-O 2.04Å; T330-Q337 PolarHBondContact O-N 2.67Å; T330-Q337 PolarHBondContact OG1-O 3.49Å; T330-K339 HydrophobicContact CG2-CB 4.34Å
331	Q	82.2	Confident	77.4	Confident	172 Å²	172	90.8 Å²	90.8	80%	0.804	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.2	173.6	-170.6	171.8	13.2	0	0	109.8
332	S	70.4	Confident	76.1	Confident	58 Å²	58	93.6 Å²	93.6	41%	0.406	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	167.7	173.9	179.7	0	0	0	0	110	T330 R334 G335	T330-S332 PolarHBondContact O-N 3.21Å; S332-R334 PolarHBondContact O-N 3.3Å; S332-G335 WeakPolarHBondContact CB-O 3.01Å; S332-G335 PolarHBondContact N-O 3.16Å; S332-G335 PolarHBondContact O-N 2.99Å; S332-G335 VanDerWaalsContact O-N 3.13Å
333	A	75.3	Confident	74.3	Confident	108 Å²	108	95.4 Å²	95.4	89%	0.893	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-8.2	172.1	0	0	0	0	0	113.8
334	R	73.3	Confident	72.2	Confident	204 Å²	204	99.8 Å²	99.8	77%	0.77	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	6.8	177.6	-67.2	-176.4	-179.6	161.6	-0.2	114.3	S332	S332-R334 PolarHBondContact O-N 3.3Å
335	G	76.7	Confident	70.1	Confident	7 Å²	7	100.5 Å²	100.5	7%	0.072	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	113.1	179.3	-170.9	0	0	0	0	0	112.2	D315 S332	D315-G335 VanDerWaalsContact OD1-CA 3.24Å; D315-G335 WeakPolarHBondContact OD1-CA 3.31Å; S332-G335 WeakPolarHBondContact CB-O 3.01Å; S332-G335 PolarHBondContact N-O 3.16Å; S332-G335 PolarHBondContact O-N 2.99Å; S332-G335 VanDerWaalsContact O-N 3.13Å
336	R	83.5	Confident	68.4	Low	99 Å²	99	94.9 Å²	94.9	37%	0.374	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	127.7	174.6	-65.4	-177.5	-177.4	-175.6	5.8	110.1	D315 E316 C317 A318 T330	D315-R336 HydrophobicContact CB-CB 4.02Å; D315-R336 HydrophobicContact CB-CG 4.41Å; D315-R336 PolarHBondContact OD1-N 2.04Å; E316-R336 WeakPolarHBondContact CA-O 3.17Å; E316-R336 VanDerWaalsContact CB-O 3.25Å; E316-R336 WeakPolarHBondContact CB-O 2.98Å; E316-R336 PolarHBondContact N-O 3.23Å; C317-R336 WeakPolarHBondContact O-CB 3.4Å; C317-R336 WeakPolarHBondContact O-CD 3.46Å; A318-R336 PolarHBondContact O-NH1 3.17Å; T330-R336 WeakPolarHBondContact O-CA 3.4Å
337	Q	82.4	Confident	66.9	Low	76 Å²	76	95.9 Å²	95.9	36%	0.355	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.3	-179.6	-57.6	-165.2	-75.6	0	0	111.7	E316 C317 T330 K339	E316-Q337 HydrophobicContact CB-CG 4.49Å; E316-Q337 PolarHBondContact OE2-NE2 2.81Å; E316-Q337 VanDerWaalsContact OE2-NE2 3.1Å; C317-Q337 VanDerWaalsContact SG-C 3.52Å; T330-Q337 PolarHBondContact N-O 2.04Å; T330-Q337 PolarHBondContact O-N 2.67Å; T330-Q337 PolarHBondContact OG1-O 3.49Å; Q337-K339 PolarHBondContact O-N 3.22Å
338	C	85.1	Confident	64.9	Low	35 Å²	35	102.3 Å²	102.3	24%	0.236	58%	0.581	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.3	107.2	174.7	-66.2	0	0	0	0	110.5	C317 C323 A327	C317-C338 VanDerWaalsContact CB-SG 3.58Å; C323-C338 WeakPolarHBondContact CA-SG 3.43Å; C323-C338 HydrophobicContact CB-CB 3.7Å; C323-C338 WeakPolarHBondContact CB-SG 3.36Å; C323-C338 WeakPolarHBondContact SG-CA 3.3Å; C323-C338 WeakPolarHBondContact SG-CB 3.36Å; C323-C338 CovalentContact SG-SG 2.03Å; C323-C338 PolarHBondContact SG-SG 3.1Å; A327-C338 HydrophobicContact CB-CB 4.27Å
339	K	79.8	Confident	62.6	Low	143 Å²	143	100.4 Å²	100.4	62%	0.622	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.9	106	178.1	-162.7	173.5	-177	-179.7	0	109.1	Q328 T330 Q337 S341	Q328-K339 PolarHBondContact N-O 3.4Å; Q328-K339 PolarHBondContact O-N 3.28Å; T330-K339 HydrophobicContact CG2-CB 4.34Å; Q337-K339 PolarHBondContact O-N 3.22Å; K339-S341 PolarHBondContact O-N 3.26Å
340	S	69.2	Low	60.4	Low	77 Å²	77	104.9 Å²	104.9	54%	0.538	62%	0.621	S	S	.	*			trans	-67.5	118.8	169.3	-172.5	0	0	0	0	108.4	R342	S340-R342 PolarHBondContact O-N 2.76Å
341	S	57.5	Low	58.8	Low	78 Å²	78	106.7 Å²	106.7	55%	0.545	63%	0.633	S	S	.	*			trans	-59	102.7	169.6	-66.8	0	0	0	0	107.9	K339 V343	K339-S341 PolarHBondContact O-N 3.26Å; S341-V343 PolarHBondContact O-N 3.12Å
342	R	50.8	Low	57.7	Low	235 Å²	235	101 Å²	101	89%	0.887	62%	0.615	S	S	*	*			trans	-65.4	79.3	167.1	-69	-176.1	-170.4	176.6	2.5	107.9	S340 S344	S340-R342 PolarHBondContact O-N 2.76Å; R342-S344 VanDerWaalsContact C-N 3.35Å; R342-S344 PolarHBondContact O-N 2.68Å
343	V	42.7	Very low	58	Low	126 Å²	126	102.1 Å²	102.1	76%	0.764	62%	0.616	S	S	*	*			trans	-81.1	99.6	154.1	-178.3	0	0	0	0	105.2	S341	S341-V343 PolarHBondContact O-N 3.12Å
344	S	40.7	Very low	58.3	Low	103 Å²	103	97.1 Å²	97.1	72%	0.72	57%	0.574	S	S	*	*			trans	-49.3	145	174.6	-54.9	0	0	0	0	111.6	R342 A346	R342-S344 VanDerWaalsContact C-N 3.35Å; R342-S344 PolarHBondContact O-N 2.68Å; S344-A346 PolarHBondContact O-N 2.86Å
345	A	35.7	Very low	58.3	Low	109 Å²	109	91.9 Å²	91.9	90%	0.901	57%	0.567	S	S	*	*	S	Bend	trans	-50.6	104.4	-178.5	0	0	0	0	0	113.7
346	A	35.2	Very low	58.2	Low	80 Å²	80	94.5 Å²	94.5	66%	0.661	58%	0.579	S	S	*	*	S	Bend	trans	-174.3	125.2	141.1	0	0	0	0	0	106.7	S344	S344-A346 PolarHBondContact O-N 2.86Å
347	S	33.2	Very low	57.8	Low	118 Å²	118	92.1 Å²	92.1	83%	0.825	59%	0.585	S	S	*	*	S	Bend	trans	73.6	88.6	178.4	77.4	0	0	0	0	117
348	T	37.5	Very low	57.8	Low	141 Å²	141	95.7 Å²	95.7	87%	0.865	60%	0.596	S	S	*	*			trans	-175.3	55.6	155.6	15.4	0	0	0	0	109.8	S350	T348-S350 PolarHBondContact O-N 3.35Å
349	G	33.5	Very low	57.6	Low	66 Å²	66	101.2 Å²	101.2	68%	0.68	62%	0.618	S	S	*	*			trans	-78.8	101.1	151.8	0	0	0	0	0	105.2	T351	G349-T351 PolarHBondContact O-N 3.11Å
350	S	39.2	Very low	57.6	Low	119 Å²	119	96.1 Å²	96.1	83%	0.832	60%	0.6	S	S	*	*			trans	-64.7	80.5	151.8	36.7	0	0	0	0	105	T348 A352	T348-S350 PolarHBondContact O-N 3.35Å; S350-A352 PolarHBondContact O-N 3.12Å
351	T	51.4	Low	58.4	Low	87 Å²	87	95.5 Å²	95.5	53%	0.534	60%	0.595	S	S	.	*			trans	-48	103.3	159.5	28.3	0	0	0	0	103.7	G349 L353	G349-T351 PolarHBondContact O-N 3.11Å; T351-L353 PolarHBondContact O-N 2.8Å
352	A	58.1	Low	59.6	Low	52 Å²	52	94.4 Å²	94.4	43%	0.43	59%	0.587	S	S	.	*			trans	-58.4	101.8	173.8	0	0	0	0	0	104.2	S350 P360 I379	S350-A352 PolarHBondContact O-N 3.12Å; A352-P360 WeakPolarHBondContact O-CD 3.46Å; A352-P360 WeakPolarHBondContact O-CG 3.34Å; A352-I379 HydrophobicContact CB-CD1 3.69Å; A352-I379 HydrophobicContact CB-CG2 4.28Å; A352-I379 WeakPolarHBondContact O-CD1 3.11Å
353	L	77.6	Confident	61.2	Low	81 Å²	81	93.6 Å²	93.6	42%	0.424	58%	0.584	S	S	.	*			trans	-75.8	146.8	179.1	-71.1	167.5	0	0	0	106.5	T351 Q359	T351-L353 PolarHBondContact O-N 2.8Å; L353-Q359 HydrophobicContact CD2-CG 4.32Å
354	C	81.2	Confident	63.1	Low	3 Å²	3	88.3 Å²	88.3	2%	0.02	55%	0.553	C	S	.	*			trans	-58.1	154.5	164.9	-67.2	0	0	0	0	109.5	N356 G357 R358 C381	C354-N356 WeakPolarHBondContact CB-OD1 3.24Å; C354-N356 PolarHBondContact O-N 2.9Å; C354-G357 WeakPolarHBondContact O-CA 3.35Å; C354-G357 PolarHBondContact O-N 3.41Å; C354-R358 VanDerWaalsContact CB-O 3.3Å; C354-R358 WeakPolarHBondContact CB-O 3.45Å; C354-R358 PolarHBondContact N-O 3.45Å; C354-C381 WeakPolarHBondContact CA-SG 2.92Å; C354-C381 HydrophobicContact CB-CB 3.66Å; C354-C381 WeakPolarHBondContact CB-SG 2.93Å; C354-C381 WeakPolarHBondContact SG-CA 2.99Å; C354-C381 WeakPolarHBondContact SG-CB 3.33Å; C354-C381 CovalentContact SG-SG 2.03Å; C354-C381 PolarHBondContact SG-SG 2.7Å
355	P	73.3	Confident	65	Low	94 Å²	94	86.6 Å²	86.6	61%	0.61	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.2	-178	18.6	-29.4	0	0	0	113.5	G357 W376	P355-G357 VanDerWaalsContact C-N 3.34Å; P355-W376 HydrophobicContact CB-CZ2 4.28Å; P355-W376 HydrophobicContact CG-CD2 4.05Å; P355-W376 HydrophobicContact CG-CG 4.28Å; P355-W376 HydrophobicContact CG-CZ2 4.44Å
356	N	74.4	Confident	66.7	Low	63 Å²	63	89.5 Å²	89.5	34%	0.337	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	7.4	171.4	64.2	-2.2	0	0	0	114.6	C354 R358 D384	C354-N356 WeakPolarHBondContact CB-OD1 3.24Å; C354-N356 PolarHBondContact O-N 2.9Å; N356-R358 PolarHBondContact O-N 3.2Å; N356-R358 WeakPolarHBondContact OD1-CB 2.88Å; N356-R358 PolarHBondContact OD1-N 2.94Å; N356-R358 VanDerWaalsContact OD1-N 3.11Å; N356-D384 PolarHBondContact ND2-OD2 3.22Å
357	G	75.4	Confident	68.2	Low	49 Å²	49	92 Å²	92	51%	0.505	54%	0.544	S	S	.	.	S	Bend	trans	74.9	1.4	-176.6	0	0	0	0	0	115.1	C354 P355	C354-G357 WeakPolarHBondContact O-CA 3.35Å; C354-G357 PolarHBondContact O-N 3.41Å; P355-G357 VanDerWaalsContact C-N 3.34Å
358	R	81.9	Confident	70.4	Confident	151 Å²	151	93.2 Å²	93.2	57%	0.57	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-77.1	154.4	173.9	-68.9	-175	178.6	-103.3	1	111	C354 N356 P382	C354-R358 VanDerWaalsContact CB-O 3.3Å; C354-R358 WeakPolarHBondContact CB-O 3.45Å; C354-R358 PolarHBondContact N-O 3.45Å; N356-R358 PolarHBondContact O-N 3.2Å; N356-R358 WeakPolarHBondContact OD1-CB 2.88Å; N356-R358 PolarHBondContact OD1-N 2.94Å; N356-R358 VanDerWaalsContact OD1-N 3.11Å; R358-P382 HydrophobicContact CB-CG 4.46Å
359	Q	80.5	Confident	72.7	Confident	150 Å²	150	88.4 Å²	88.4	70%	0.701	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-68.1	139.3	171.5	-73.3	-178	-6	0	0	110.7	L353	L353-Q359 HydrophobicContact CD2-CG 4.32Å
360	P	81.5	Confident	75	Confident	37 Å²	37	89.4 Å²	89.4	24%	0.24	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-67.8	148.8	173.4	29.9	-35.5	0	0	0	110.8	A352 I379 C380	A352-P360 WeakPolarHBondContact O-CD 3.46Å; A352-P360 WeakPolarHBondContact O-CG 3.34Å; P360-I379 HydrophobicContact CB-CB 3.66Å; P360-I379 HydrophobicContact CB-CD1 3.89Å; P360-I379 HydrophobicContact CB-CG1 4.24Å; P360-I379 HydrophobicContact CB-CG2 4.16Å; P360-I379 HydrophobicContact CG-CB 4.28Å; P360-I379 HydrophobicContact CG-CD1 4.13Å; P360-I379 HydrophobicContact CG-CG2 4.28Å; P360-C380 WeakPolarHBondContact CA-O 3.08Å
361	S	84.6	Confident	76.8	Confident	64 Å²	64	89.8 Å²	89.8	45%	0.448	50%	0.504	S	S	.	.	S	Bend	trans	-75.3	-41.6	177.3	-177.1	0	0	0	0	112.3	C380	S361-C380 PolarHBondContact N-O 2.83Å
362	S	83.3	Confident	78.1	Confident	54 Å²	54	87.5 Å²	87.5	38%	0.378	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	176	-178.2	60.5	0	0	0	0	110.3	I379 C380	S362-I379 CarbonylContact O-C 3.48Å; S362-I379 WeakPolarHBondContact O-CA 3.04Å; S362-C380 PolarHBondContact O-N 2.02Å; S362-C380 WeakPolarHBondContact OG-CB 3.33Å; S362-C380 PolarHBondContact OG-SG 2.67Å
363	R	83.6	Confident	79.4	Confident	219 Å²	219	89.1 Å²	89.1	83%	0.826	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	149.4	162.4	-71.7	-179.8	-178	-124.7	1.1	109.7	G378 I379	R363-G378 CarbonylContact C-O 3.4Å; R363-G378 WeakPolarHBondContact CA-O 3.27Å; R363-G378 WeakPolarHBondContact CB-O 3.37Å; R363-I379 HydrophobicContact CG-CG2 4.33Å
364	C	83.7	Confident	79.6	Confident	15 Å²	15	88.6 Å²	88.6	10%	0.101	49%	0.493	C	S	.	.			trans	-119.4	144.7	172.5	44.7	0	0	0	0	110.7	E368 C375 G378 I379	C364-E368 WeakPolarHBondContact CB-O 3.11Å; C364-C375 HydrophobicContact CB-CB 3.73Å; C364-C375 WeakPolarHBondContact CB-SG 3.25Å; C364-C375 WeakPolarHBondContact SG-CA 3.38Å; C364-C375 WeakPolarHBondContact SG-CB 2.98Å; C364-C375 CovalentContact SG-SG 2.01Å; C364-C375 PolarHBondContact SG-SG 2.78Å; C364-G378 PolarHBondContact N-O 3.01Å; C364-G378 VanDerWaalsContact SG-CA 3.59Å; C364-I379 PolarHBondContact SG-N 3.11Å
365	A	79.1	Confident	79.8	Confident	67 Å²	67	89.8 Å²	89.8	55%	0.554	50%	0.501	S	S	*	.	S	Bend	trans	-119.4	144	162.9	0	0	0	0	0	107.4	N367 E368	A365-N367 VanDerWaalsContact C-N 3.25Å; A365-N367 PolarHBondContact O-N 3.46Å; A365-N367 VanDerWaalsContact O-N 3.14Å; A365-E368 PolarHBondContact O-N 3.16Å; A365-E368 VanDerWaalsContact O-N 3.17Å
366	M	71.6	Confident	80.2	Confident	169 Å²	169	89 Å²	89	83%	0.833	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	35.3	177.7	-57.8	-179.4	-70.5	0	0	115.1	E368	M366-E368 VanDerWaalsContact C-N 3.26Å; M366-E368 PolarHBondContact O-N 2.79Å
367	N	68.2	Low	80.4	Confident	132 Å²	132	91.6 Å²	91.6	71%	0.706	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	15.8	-179.4	-62.6	-38.3	0	0	0	116.5	A365 C369 C375	A365-N367 VanDerWaalsContact C-N 3.25Å; A365-N367 PolarHBondContact O-N 3.46Å; A365-N367 VanDerWaalsContact O-N 3.14Å; N367-C369 PolarHBondContact O-N 2.9Å; N367-C375 HydrophobicContact CB-CB 4.38Å
368	E	79.1	Confident	80.6	Confident	145 Å²	145	90.7 Å²	90.7	68%	0.678	49%	0.491	S	S	*	.			trans	-80.2	118.7	175.8	-73	-177.8	163.9	0	0	112.2	C364 A365 M366	C364-E368 WeakPolarHBondContact CB-O 3.11Å; A365-E368 PolarHBondContact O-N 3.16Å; A365-E368 VanDerWaalsContact O-N 3.17Å; M366-E368 VanDerWaalsContact C-N 3.26Å; M366-E368 PolarHBondContact O-N 2.79Å
369	C	85	Confident	80.9	Confident	39 Å²	39	84 Å²	84	26%	0.264	47%	0.466	S	S	.	.			trans	-140.4	155.5	172.6	-70.2	0	0	0	0	110.4	N367 C380	N367-C369 PolarHBondContact O-N 2.9Å; C369-C380 WeakPolarHBondContact CA-SG 3.27Å; C369-C380 HydrophobicContact CB-CB 3.85Å; C369-C380 WeakPolarHBondContact CB-SG 3Å; C369-C380 WeakPolarHBondContact SG-CA 3.38Å; C369-C380 WeakPolarHBondContact SG-CB 2.92Å; C369-C380 CovalentContact SG-SG 2.04Å; C369-C380 PolarHBondContact SG-SG 3.31Å
370	T	81.3	Confident	81.3	Confident	87 Å²	87	76.9 Å²	76.9	53%	0.534	43%	0.433	S	S	.	.			trans	-60.5	149.3	171	40.7	0	0	0	0	111.4	G372 Y373	T370-G372 PolarHBondContact O-N 3.12Å; T370-Y373 WeakPolarHBondContact O-CB 3.21Å; T370-Y373 PolarHBondContact O-N 3.32Å; T370-Y373 WeakPolarHBondContact OG1-CD2 3.45Å
371	S	77.3	Confident	81.6	Confident	128 Å²	128	75.3 Å²	75.3	90%	0.895	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	133.2	179.2	-55.5	0	0	0	0	111.8
372	G	80.4	Confident	81.5	Confident	38 Å²	38	73.8 Å²	73.8	39%	0.392	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	0.8	-174	0	0	0	0	0	114.6	T370 L383	T370-G372 PolarHBondContact O-N 3.12Å; G372-L383 WeakPolarHBondContact O-CB 3.12Å; G372-L383 PolarHBondContact O-N 3.3Å
373	Y	84.9	Confident	80.9	Confident	87 Å²	87	75.4 Å²	75.4	34%	0.341	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151	175.4	-63.8	-99.7	0	0	0	111.4	T370 C381 P382	T370-Y373 WeakPolarHBondContact O-CB 3.21Å; T370-Y373 PolarHBondContact O-N 3.32Å; T370-Y373 WeakPolarHBondContact OG1-CD2 3.45Å; Y373-C381 CarbonylContact C-O 3.51Å; Y373-C381 WeakPolarHBondContact CA-O 3.47Å; Y373-C381 VanDerWaalsContact CD1-C 3.45Å; Y373-P382 HydrophobicContact CD1-CB 4.05Å; Y373-P382 VanDerWaalsContact CD1-N 3.31Å; Y373-P382 HydrophobicContact CE1-CB 3.76Å; Y373-P382 HydrophobicContact CE1-CG 4.27Å
374	T	82.3	Confident	79.7	Confident	70 Å²	70	68.5 Å²	68.5	43%	0.429	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.3	174.3	-172.4	0	0	0	0	110.1	C381 L383	T374-C381 HydrophobicContact CG2-CB 4.47Å; T374-C381 PolarHBondContact N-O 3.32Å; T374-C381 PolarHBondContact O-N 3.18Å; T374-L383 HydrophobicContact CG2-CD2 4.08Å
375	C	84.5	Confident	78.2	Confident	27 Å²	27	75.1 Å²	75.1	18%	0.182	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	126.4	175.8	-173.3	0	0	0	0	109.7	C364 N367 I379	C364-C375 HydrophobicContact CB-CB 3.73Å; C364-C375 WeakPolarHBondContact CB-SG 3.25Å; C364-C375 WeakPolarHBondContact SG-CA 3.38Å; C364-C375 WeakPolarHBondContact SG-CB 2.98Å; C364-C375 CovalentContact SG-SG 2.01Å; C364-C375 PolarHBondContact SG-SG 2.78Å; N367-C375 HydrophobicContact CB-CB 4.38Å; C375-I379 CarbonylContact C-O 3.54Å; C375-I379 WeakPolarHBondContact CA-O 3.28Å
376	W	82.4	Confident	76.5	Confident	77 Å²	77	79.6 Å²	79.6	29%	0.292	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	119.6	177.2	-170.3	80.6	0	0	0	108	P355 G378 I379	P355-W376 HydrophobicContact CB-CZ2 4.28Å; P355-W376 HydrophobicContact CG-CD2 4.05Å; P355-W376 HydrophobicContact CG-CG 4.28Å; P355-W376 HydrophobicContact CG-CZ2 4.44Å; W376-G378 PolarHBondContact O-N 3.18Å; W376-I379 HydrophobicContact CE3-CD1 4.28Å; W376-I379 HydrophobicContact CE3-CG1 4.47Å; W376-I379 PolarHBondContact N-O 3.33Å; W376-I379 WeakPolarHBondContact O-CG1 3.3Å; W376-I379 PolarHBondContact O-N 3.43Å
377	N	77	Confident	75	Confident	119 Å²	119	73.9 Å²	73.9	64%	0.636	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	40.1	-177.3	-75.6	-19.3	0	0	0	115.1	I379	N377-I379 VanDerWaalsContact C-N 3.34Å; N377-I379 PolarHBondContact O-N 3.26Å
378	G	81.2	Confident	73.4	Confident	30 Å²	30	77.6 Å²	77.6	31%	0.309	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	13.1	179.9	0	0	0	0	0	115.2	R363 C364 W376	R363-G378 CarbonylContact C-O 3.4Å; R363-G378 WeakPolarHBondContact CA-O 3.27Å; R363-G378 WeakPolarHBondContact CB-O 3.37Å; C364-G378 PolarHBondContact N-O 3.01Å; C364-G378 VanDerWaalsContact SG-CA 3.59Å; W376-G378 PolarHBondContact O-N 3.18Å
379	I	87	Confident	71.5	Confident	11 Å²	11	76 Å²	76	6%	0.056	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.2	171.5	54.8	166.3	0	0	0	112.9	A352 P360 S362 R363 C364 C375 W376 N377	A352-I379 HydrophobicContact CB-CD1 3.69Å; A352-I379 HydrophobicContact CB-CG2 4.28Å; A352-I379 WeakPolarHBondContact O-CD1 3.11Å; P360-I379 HydrophobicContact CB-CB 3.66Å; P360-I379 HydrophobicContact CB-CD1 3.89Å; P360-I379 HydrophobicContact CB-CG1 4.24Å; P360-I379 HydrophobicContact CB-CG2 4.16Å; P360-I379 HydrophobicContact CG-CB 4.28Å; P360-I379 HydrophobicContact CG-CD1 4.13Å; P360-I379 HydrophobicContact CG-CG2 4.28Å; S362-I379 CarbonylContact O-C 3.48Å; S362-I379 WeakPolarHBondContact O-CA 3.04Å; R363-I379 HydrophobicContact CG-CG2 4.33Å; C364-I379 PolarHBondContact SG-N 3.11Å; C375-I379 CarbonylContact C-O 3.54Å; C375-I379 WeakPolarHBondContact CA-O 3.28Å; W376-I379 HydrophobicContact CE3-CD1 4.28Å; W376-I379 HydrophobicContact CE3-CG1 4.47Å; W376-I379 PolarHBondContact N-O 3.33Å; W376-I379 WeakPolarHBondContact O-CG1 3.3Å; W376-I379 PolarHBondContact O-N 3.43Å; N377-I379 VanDerWaalsContact C-N 3.34Å; N377-I379 PolarHBondContact O-N 3.26Å
380	C	90.3	Very high	69.1	Low	0 Å²	0	77.7 Å²	77.7	0%	0	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	113.8	177.8	-69.4	0	0	0	0	111.4	P360 S361 S362 C369	P360-C380 WeakPolarHBondContact CA-O 3.08Å; S361-C380 PolarHBondContact N-O 2.83Å; S362-C380 PolarHBondContact O-N 2.02Å; S362-C380 WeakPolarHBondContact OG-CB 3.33Å; S362-C380 PolarHBondContact OG-SG 2.67Å; C369-C380 WeakPolarHBondContact CA-SG 3.27Å; C369-C380 HydrophobicContact CB-CB 3.85Å; C369-C380 WeakPolarHBondContact CB-SG 3Å; C369-C380 WeakPolarHBondContact SG-CA 3.38Å; C369-C380 WeakPolarHBondContact SG-CB 2.92Å; C369-C380 CovalentContact SG-SG 2.04Å; C369-C380 PolarHBondContact SG-SG 3.31Å
381	C	86.7	Confident	67.2	Low	4 Å²	4	77.9 Å²	77.9	3%	0.027	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	136.9	-176.9	-72.5	0	0	0	0	112.4	C354 Y373 T374 L383	C354-C381 WeakPolarHBondContact CA-SG 2.92Å; C354-C381 HydrophobicContact CB-CB 3.66Å; C354-C381 WeakPolarHBondContact CB-SG 2.93Å; C354-C381 WeakPolarHBondContact SG-CA 2.99Å; C354-C381 WeakPolarHBondContact SG-CB 3.33Å; C354-C381 CovalentContact SG-SG 2.03Å; C354-C381 PolarHBondContact SG-SG 2.7Å; Y373-C381 CarbonylContact C-O 3.51Å; Y373-C381 WeakPolarHBondContact CA-O 3.47Å; Y373-C381 VanDerWaalsContact CD1-C 3.45Å; T374-C381 HydrophobicContact CG2-CB 4.47Å; T374-C381 PolarHBondContact N-O 3.32Å; T374-C381 PolarHBondContact O-N 3.18Å; C381-L383 PolarHBondContact O-N 2.81Å
382	P	81.7	Confident	65.5	Low	32 Å²	32	82.6 Å²	82.6	21%	0.208	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	131.5	-177.5	23.9	-31.2	0	0	0	110.2	R358 Y373 D384	R358-P382 HydrophobicContact CB-CG 4.46Å; Y373-P382 HydrophobicContact CD1-CB 4.05Å; Y373-P382 VanDerWaalsContact CD1-N 3.31Å; Y373-P382 HydrophobicContact CE1-CB 3.76Å; Y373-P382 HydrophobicContact CE1-CG 4.27Å; P382-D384 PolarHBondContact O-N 2.83Å
383	L	72	Confident	63.9	Low	88 Å²	88	88.2 Å²	88.2	46%	0.461	47%	0.467	S	S	.	.			trans	-64.4	106.3	168.9	-71.2	167.3	0	0	0	107	G372 T374 C381 N385	G372-L383 WeakPolarHBondContact O-CB 3.12Å; G372-L383 PolarHBondContact O-N 3.3Å; T374-L383 HydrophobicContact CG2-CD2 4.08Å; C381-L383 PolarHBondContact O-N 2.81Å; L383-N385 PolarHBondContact O-N 2.97Å
384	D	58.8	Low	62.4	Low	73 Å²	73	84.9 Å²	84.9	39%	0.39	46%	0.457	S	S	.	.			trans	-66.9	90.3	169.5	-83.6	-40.2	0	0	0	108.3	N356 P382 N386 A387	N356-D384 PolarHBondContact ND2-OD2 3.22Å; P382-D384 PolarHBondContact O-N 2.83Å; D384-N386 PolarHBondContact O-N 3.17Å; D384-A387 HydrophobicContact CB-CB 3.58Å; D384-A387 PolarHBondContact O-N 2.81Å
385	N	52.3	Low	61.5	Low	154 Å²	154	82.7 Å²	82.7	82%	0.824	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	6.2	172.2	-80.2	-17.1	0	0	0	113.2	L383	L383-N385 PolarHBondContact O-N 2.97Å
386	N	42.2	Very low	61	Low	161 Å²	161	82.5 Å²	82.5	86%	0.861	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-152.3	27.9	-176.5	-135.7	-16.4	0	0	0	114.3	D384 K388	D384-N386 PolarHBondContact O-N 3.17Å; N386-K388 PolarHBondContact O-N 3.15Å
387	A	40	Very low	60.4	Low	49 Å²	49	80.2 Å²	80.2	41%	0.405	44%	0.442	S	S	.	.			trans	-98.2	90.3	172.4	0	0	0	0	0	110.4	D384 V389	D384-A387 HydrophobicContact CB-CB 3.58Å; D384-A387 PolarHBondContact O-N 2.81Å; A387-V389 HydrophobicContact CB-CG2 3.46Å; A387-V389 VanDerWaalsContact CB-CG2 3.46Å; A387-V389 PolarHBondContact O-N 3.08Å
388	K	34.2	Very low	59.7	Low	210 Å²	210	80.2 Å²	80.2	91%	0.913	45%	0.448	S	S	*	.			trans	-56	74.8	139.5	-80.6	-179.6	175.2	-179.8	0	107.3	N386 A390	N386-K388 PolarHBondContact O-N 3.15Å; K388-A390 PolarHBondContact O-N 3.35Å
389	V	39.8	Very low	58.7	Low	112 Å²	112	81.1 Å²	81.1	68%	0.679	45%	0.447	S	S	*	.			trans	-75.8	86.4	165.9	-171.5	0	0	0	0	105.5	A387 N391	A387-V389 HydrophobicContact CB-CG2 3.46Å; A387-V389 VanDerWaalsContact CB-CG2 3.46Å; A387-V389 PolarHBondContact O-N 3.08Å; V389-N391 HydrophobicContact CG1-CB 4.37Å; V389-N391 PolarHBondContact O-N 2.91Å
390	A	35.7	Very low	57.2	Low	74 Å²	74	92 Å²	92	61%	0.612	49%	0.488	S	S	*	.			trans	-59.3	88.6	152.9	0	0	0	0	0	106.6	K388 R392	K388-A390 PolarHBondContact O-N 3.35Å; A390-R392 HydrophobicContact CB-CG 4.32Å; A390-R392 PolarHBondContact O-N 2.8Å
391	N	41	Very low	55.4	Low	92 Å²	92	96.7 Å²	96.7	49%	0.492	52%	0.521	S	S	.	.			trans	-74.6	77.1	165.1	-162.8	-11.5	0	0	0	107	V389 N393 S394	V389-N391 HydrophobicContact CG1-CB 4.37Å; V389-N391 PolarHBondContact O-N 2.91Å; N391-N393 PolarHBondContact O-N 2.02Å; N391-N393 VanDerWaalsContact O-N 3.11Å; N391-N393 PolarHBondContact OD1-N 2.6Å; N391-S394 WeakPolarHBondContact CB-OG 3.13Å; N391-S394 WeakPolarHBondContact ND2-CB 3.4Å; N391-S394 PolarHBondContact ND2-OG 2.84Å; N391-S394 PolarHBondContact OD1-N 2.63Å
392	R	41.1	Very low	53.9	Low	227 Å²	227	102.1 Å²	102.1	86%	0.857	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-4.5	175.8	-83.7	-176.9	170.3	-178.7	-3.3	112.4	A390	A390-R392 HydrophobicContact CB-CG 4.32Å; A390-R392 PolarHBondContact O-N 2.8Å
393	N	46.4	Very low	52.4	Low	155 Å²	155	105 Å²	105	83%	0.829	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	0.4	-172.7	-75	20	0	0	0	115.1	N391	N391-N393 PolarHBondContact O-N 2.02Å; N391-N393 VanDerWaalsContact O-N 3.11Å; N391-N393 PolarHBondContact OD1-N 2.6Å
394	S	53.9	Low	51.5	Low	18 Å²	18	106.2 Å²	106.2	13%	0.126	59%	0.586	C	S	.	*	S	Bend	trans	-98	129.7	160.5	59	0	0	0	0	107.1	N391 C396	N391-S394 WeakPolarHBondContact CB-OG 3.13Å; N391-S394 WeakPolarHBondContact ND2-CB 3.4Å; N391-S394 PolarHBondContact ND2-OG 2.84Å; N391-S394 PolarHBondContact OD1-N 2.63Å; S394-C396 PolarHBondContact O-N 2.85Å
395	G	64.2	Low	51.1	Low	24 Å²	24	112.3 Å²	112.3	25%	0.247	61%	0.609	C	S	.	*			trans	-64.7	24.8	177.2	0	0	0	0	0	115	T435 I438	G395-T435 WeakPolarHBondContact O-CG2 3.31Å; G395-I438 WeakPolarHBondContact O-CD1 3.31Å
396	C	73.9	Confident	51.2	Low	23 Å²	23	108.9 Å²	108.9	16%	0.155	61%	0.609	C	S	.	*	P	Polyproline II helix	trans	-86.1	140	-176.6	-65	0	0	0	0	112.3	S394 C424	S394-C396 PolarHBondContact O-N 2.85Å; C396-C424 WeakPolarHBondContact CA-SG 3.47Å; C396-C424 HydrophobicContact CB-CB 3.59Å; C396-C424 WeakPolarHBondContact CB-SG 3.32Å; C396-C424 WeakPolarHBondContact SG-CA 3.07Å; C396-C424 WeakPolarHBondContact SG-CB 3.43Å; C396-C424 CovalentContact SG-SG 2.03Å; C396-C424 PolarHBondContact SG-SG 2.86Å
397	P	69.9	Low	52.2	Low	29 Å²	29	103.3 Å²	103.3	19%	0.188	58%	0.578	C	S	.	*	P	Polyproline II helix	trans	-68.8	146.7	175.2	28	-33	0	0	0	111.8	V399 M433 V458	P397-V399 PolarHBondContact O-N 3.48Å; P397-M433 HydrophobicContact CG-CE 3.99Å; P397-M433 HydrophobicContact CG-SD 3.7Å; P397-V458 HydrophobicContact CB-CG2 4.42Å
398	P	60.7	Low	53.3	Low	118 Å²	118	105.2 Å²	105.2	77%	0.766	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-74.1	116.4	178.9	28.4	-33.1	0	0	0	111.8
399	V	60.8	Low	55.3	Low	49 Å²	49	99.8 Å²	99.8	30%	0.297	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-85	125.1	173.9	-137.2	0	0	0	0	110.3	P397 L402 P425	P397-V399 PolarHBondContact O-N 3.48Å; V399-L402 HydrophobicContact CB-CD1 4.25Å; V399-P425 VanDerWaalsContact CG2-C 3.49Å; V399-P425 HydrophobicContact CG2-CB 3.67Å; V399-P425 HydrophobicContact CG2-CG 3.65Å; V399-P425 WeakPolarHBondContact CG2-O 3.21Å
400	R	55	Low	57.3	Low	241 Å²	241	100.4 Å²	100.4	91%	0.909	56%	0.556	S	S	*	*	S	Bend	trans	-89.2	6.7	-177.2	-75.7	-171.7	176.8	-169.7	0.3	115.4
401	S	53.8	Low	59.6	Low	98 Å²	98	97.1 Å²	97.1	69%	0.685	53%	0.528	S	S	*	.			trans	-162.9	103	176.8	-73	0	0	0	0	111.7
402	L	53.6	Low	61.5	Low	117 Å²	117	96.5 Å²	96.5	61%	0.613	53%	0.525	S	S	*	.			trans	-91.1	110.3	165.8	-84.9	78	0	0	0	107.9	V399	V399-L402 HydrophobicContact CB-CD1 4.25Å
403	S	52.1	Low	63.3	Low	92 Å²	92	87.8 Å²	87.8	64%	0.643	50%	0.499	S	S	*	.			trans	-100.8	109.8	166.8	-155.8	0	0	0	0	108.2	K405 Q407	S403-K405 VanDerWaalsContact C-N 3.25Å; S403-K405 PolarHBondContact O-N 2.91Å; S403-K405 VanDerWaalsContact O-N 3.11Å; S403-Q407 PolarHBondContact O-NE2 2.83Å
404	S	53	Low	64.8	Low	115 Å²	115	84.1 Å²	84.1	80%	0.804	48%	0.479	S	S	*	.			trans	-80.9	22.4	-164.7	34.9	0	0	0	0	115.5
405	K	49.6	Very low	66	Low	201 Å²	201	88.3 Å²	88.3	87%	0.874	51%	0.508	S	S	*	.	S	Bend	trans	-117.9	111.9	175.4	-90.5	-174.8	174.4	-179.6	0	111.6	S403	S403-K405 VanDerWaalsContact C-N 3.25Å; S403-K405 PolarHBondContact O-N 2.91Å; S403-K405 VanDerWaalsContact O-N 3.11Å
406	G	55.2	Low	66.7	Low	81 Å²	81	90.4 Å²	90.4	84%	0.835	51%	0.514	S	S	*	.	S	Bend	trans	85.6	19	170.7	0	0	0	0	0	115.7
407	Q	61.7	Low	67.1	Low	45 Å²	45	90.1 Å²	90.1	21%	0.21	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-76.8	140.1	174	-79.8	179.8	-15.5	0	0	111.2	S403 A427 A428	S403-Q407 PolarHBondContact O-NE2 2.83Å; Q407-A427 PolarHBondContact NE2-O 2.83Å; Q407-A428 CarbonylContact C-O 3.57Å; Q407-A428 WeakPolarHBondContact CA-O 3.23Å; Q407-A428 WeakPolarHBondContact CB-O 3.17Å
408	V	62.8	Low	67.5	Low	88 Å²	88	93.4 Å²	93.4	53%	0.533	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-100.8	118.9	178.7	179.7	0	0	0	0	107.7	F410 A428 G429	V408-F410 HydrophobicContact CB-CE2 4.43Å; V408-F410 HydrophobicContact CB-CZ 4.34Å; V408-F410 HydrophobicContact CG1-CE1 4.05Å; V408-F410 HydrophobicContact CG1-CE2 4.32Å; V408-F410 HydrophobicContact CG1-CZ 3.94Å; V408-A428 PolarHBondContact N-O 3.42Å; V408-G429 WeakPolarHBondContact O-CA 3.41Å
409	H	77.9	Confident	67.9	Low	96 Å²	96	92.2 Å²	92.2	44%	0.444	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-89.9	119	176	-64.3	-74.3	0	0	0	109.4	R430	H409-R430 HydrophobicContact CB-CB 4.31Å; H409-R430 PolarHBondContact CE1-NE 3.28Å; H409-R430 WeakPolarHBondContact ND1-CB 3.34Å; H409-R430 WeakPolarHBondContact ND1-CG 3.44Å; H409-R430 PolarHBondContact ND1-N 3.12Å; H409-R430 VanDerWaalsContact ND1-N 3.13Å; H409-R430 PolarHBondContact ND1-NE 3.32Å
410	F	81.3	Confident	68.1	Low	125 Å²	125	93.1 Å²	93.1	55%	0.548	52%	0.519	S	S	.	.	S	Bend	trans	-92	-10.3	176	-59.4	-80	0	0	0	112.9	V408 R430 Q431	V408-F410 HydrophobicContact CB-CE2 4.43Å; V408-F410 HydrophobicContact CB-CZ 4.34Å; V408-F410 HydrophobicContact CG1-CE1 4.05Å; V408-F410 HydrophobicContact CG1-CE2 4.32Å; V408-F410 HydrophobicContact CG1-CZ 3.94Å; F410-R430 WeakPolarHBondContact CB-O 3.46Å; F410-R430 PolarHBondContact N-O 3.17Å; F410-Q431 HydrophobicContact CB-CG 4.27Å; F410-Q431 HydrophobicContact CD2-CB 4.16Å; F410-Q431 HydrophobicContact CD2-CG 4Å; F410-Q431 HydrophobicContact CG-CG 4.38Å
411	C	83.2	Confident	69.3	Low	5 Å²	5	84.3 Å²	84.3	3%	0.034	49%	0.488	C	S	.	.			trans	-150.5	151.7	174.2	60.7	0	0	0	0	109.3	D416 C423 R430 Q431 C432	C411-D416 HydrophobicContact CB-CB 3.93Å; C411-C423 HydrophobicContact CB-CB 3.74Å; C411-C423 WeakPolarHBondContact CB-SG 2.99Å; C411-C423 PolarHBondContact O-SG 2.9Å; C411-C423 WeakPolarHBondContact SG-CA 3.35Å; C411-C423 WeakPolarHBondContact SG-CB 3.4Å; C411-C423 CovalentContact SG-SG 2.03Å; C411-C423 PolarHBondContact SG-SG 3.36Å; C411-R430 WeakPolarHBondContact O-CB 3.07Å; C411-Q431 VanDerWaalsContact SG-CA 3.58Å; C411-Q431 PolarHBondContact SG-N 3.13Å; C411-Q431 VanDerWaalsContact SG-N 3.42Å; C411-C432 VanDerWaalsContact CB-SG 3.55Å
412	D	80.7	Confident	70.5	Confident	79 Å²	79	81 Å²	81	42%	0.422	46%	0.463	S	S	.	.	S	Bend	trans	-102.3	-29.8	174.1	-84.8	-46.1	0	0	0	112.7	D416 R430	D412-D416 VanDerWaalsContact CA-OD2 3.29Å; D412-D416 WeakPolarHBondContact CA-OD2 3.36Å; D412-D416 WeakPolarHBondContact CB-OD2 3.46Å; D412-D416 PolarHBondContact N-OD2 2.75Å; D412-R430 VanDerWaalsContact CA-NH1 3.27Å; D412-R430 PolarHBondContact O-NH1 3.41Å; D412-R430 IonicContact OD1-CZ 3.13Å; D412-R430 IonicContact OD1-NH1 3.03Å; D412-R430 PolarHBondContact OD1-NH1 3.49Å; D412-R430 IonicContact OD1-NH2 2.67Å; D412-R430 PolarHBondContact OD1-NH2 2.79Å
413	S	80.3	Confident	72	Confident	45 Å²	45	76.1 Å²	76.1	32%	0.315	44%	0.438	S	S	.	.	S	Bend	trans	-154	164.3	-171.6	62.2	0	0	0	0	110.9	S415 D416 C423	S413-S415 PolarHBondContact O-N 3.11Å; S413-S415 VanDerWaalsContact O-N 3.09Å; S413-S415 PolarHBondContact OG-OG 3.24Å; S413-D416 PolarHBondContact N-OD2 2.87Å; S413-D416 WeakPolarHBondContact O-CB 3.41Å; S413-D416 PolarHBondContact O-N 2.64Å; S413-D416 PolarHBondContact OG-OD2 2.03Å; S413-C423 VanDerWaalsContact O-CB 3.25Å; S413-C423 WeakPolarHBondContact O-CB 3.29Å
414	D	77.6	Confident	73.6	Confident	77 Å²	77	71.7 Å²	71.7	41%	0.412	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-59.1	-21.9	177.3	-66.7	-4.4	0	0	0	112.7	D416 C417 N422 C423	D414-D416 VanDerWaalsContact C-N 3.3Å; D414-D416 PolarHBondContact O-N 2.99Å; D414-C417 PolarHBondContact O-N 3.41Å; D414-N422 WeakPolarHBondContact OD1-CA 3.44Å; D414-N422 WeakPolarHBondContact OD1-CB 3.45Å; D414-N422 PolarHBondContact OD2-ND2 3.11Å; D414-C423 PolarHBondContact OD1-N 3.47Å
415	S	78.1	Confident	74.9	Confident	106 Å²	106	68.7 Å²	68.7	74%	0.741	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-73.8	-15.5	175	38.3	0	0	0	0	114.8	S413	S413-S415 PolarHBondContact O-N 3.11Å; S413-S415 VanDerWaalsContact O-N 3.09Å; S413-S415 PolarHBondContact OG-OG 3.24Å
416	D	79.2	Confident	76	Confident	69 Å²	69	59.7 Å²	59.7	37%	0.369	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-83.6	-3.4	175.1	-53.7	-53.5	0	0	0	112	C411 D412 S413 D414	C411-D416 HydrophobicContact CB-CB 3.93Å; D412-D416 VanDerWaalsContact CA-OD2 3.29Å; D412-D416 WeakPolarHBondContact CA-OD2 3.36Å; D412-D416 WeakPolarHBondContact CB-OD2 3.46Å; D412-D416 PolarHBondContact N-OD2 2.75Å; S413-D416 PolarHBondContact N-OD2 2.87Å; S413-D416 WeakPolarHBondContact O-CB 3.41Å; S413-D416 PolarHBondContact O-N 2.64Å; S413-D416 PolarHBondContact OG-OD2 2.03Å; D414-D416 VanDerWaalsContact C-N 3.3Å; D414-D416 PolarHBondContact O-N 2.99Å
417	C	83.3	Confident	76.7	Confident	16 Å²	16	59.6 Å²	59.6	11%	0.108	34%	0.338	C	S	.	.	S	Bend	trans	-105.1	158.3	-176.2	-58.3	0	0	0	0	111.9	D414 E421 C432	D414-C417 PolarHBondContact O-N 3.41Å; C417-E421 HydrophobicContact CB-CB 3.74Å; C417-C432 WeakPolarHBondContact CA-SG 3.33Å; C417-C432 HydrophobicContact CB-CB 3.59Å; C417-C432 WeakPolarHBondContact CB-SG 3.12Å; C417-C432 WeakPolarHBondContact SG-CA 3.21Å; C417-C432 WeakPolarHBondContact SG-CB 3.46Å; C417-C432 CovalentContact SG-SG 2.03Å; C417-C432 PolarHBondContact SG-SG 2.86Å
418	F	77.4	Confident	77.1	Confident	98 Å²	98	60 Å²	60	43%	0.43	35%	0.35	S	S	.	.			trans	-60.7	154.4	174.6	-75.8	-83	0	0	0	111	V268 N420 E421	V268-F418 HydrophobicContact CG2-CE1 3.6Å; V268-F418 HydrophobicContact CG2-CZ 3.48Å; V268-F418 VanDerWaalsContact CG2-CZ 3.48Å; F418-N420 PolarHBondContact O-N 3.06Å; F418-N420 VanDerWaalsContact O-N 3.12Å; F418-E421 HydrophobicContact CB-CG 4.46Å; F418-E421 PolarHBondContact O-N 2.99Å
419	P	68.5	Low	77.6	Confident	93 Å²	93	56 Å²	56	60%	0.604	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	125.1	165.9	-20.6	30.9	0	0	0	109.1
420	N	65.8	Low	77.9	Confident	69 Å²	69	54 Å²	54	37%	0.369	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	-0	-174.3	-46	-33.9	0	0	0	116.4	F418 N434 T435 R436	F418-N420 PolarHBondContact O-N 3.06Å; F418-N420 VanDerWaalsContact O-N 3.12Å; N420-N434 WeakPolarHBondContact O-CA 3.39Å; N420-N434 PolarHBondContact O-OD1 2.98Å; N420-T435 PolarHBondContact O-N 3.03Å; N420-R436 HydrophobicContact CB-CB 4.05Å; N420-R436 HydrophobicContact CB-CG 4.09Å; N420-R436 PolarHBondContact O-N 3.21Å; N420-R436 WeakPolarHBondContact OD1-CD 3.35Å; N420-R436 VanDerWaalsContact OD1-CZ 3.24Å; N420-R436 PolarHBondContact OD1-NE 3.17Å; N420-R436 PolarHBondContact OD1-NH1 3.26Å
421	E	79.2	Confident	78.1	Confident	55 Å²	55	50.9 Å²	50.9	26%	0.257	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	149.4	177.7	-61.4	-179.7	166.5	0	0	111.8	C417 F418 C432 M433 N434	C417-E421 HydrophobicContact CB-CB 3.74Å; F418-E421 HydrophobicContact CB-CG 4.46Å; F418-E421 PolarHBondContact O-N 2.99Å; E421-C432 HydrophobicContact CB-CB 4.27Å; E421-C432 VanDerWaalsContact OE2-CB 3.32Å; E421-C432 WeakPolarHBondContact OE2-CB 3.27Å; E421-M433 CarbonylContact C-O 3.46Å; E421-M433 WeakPolarHBondContact CA-O 3.47Å; E421-M433 WeakPolarHBondContact CB-O 2.97Å; E421-N434 HydrophobicContact CG-CB 4.23Å
422	N	79.7	Confident	78.1	Confident	29 Å²	29	52 Å²	52	16%	0.155	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	152.9	169.3	-62.6	22.3	0	0	0	109.7	D414 C424 C432 M433 T435	D414-N422 WeakPolarHBondContact OD1-CA 3.44Å; D414-N422 WeakPolarHBondContact OD1-CB 3.45Å; D414-N422 PolarHBondContact OD2-ND2 3.11Å; N422-C424 PolarHBondContact O-N 3.34Å; N422-C424 VanDerWaalsContact O-N 3.13Å; N422-C424 PolarHBondContact O-SG 2.84Å; N422-C432 WeakPolarHBondContact O-CA 3.32Å; N422-M433 PolarHBondContact N-O 2.78Å; N422-M433 PolarHBondContact O-N 2.84Å; N422-T435 HydrophobicContact CB-CG2 3.4Å; N422-T435 VanDerWaalsContact CB-CG2 3.4Å; N422-T435 VanDerWaalsContact CG-CG2 3.43Å; N422-T435 PolarHBondContact OD1-OG1 3.49Å
423	C	85.6	Confident	77.9	Confident	14 Å²	14	49.4 Å²	49.4	10%	0.095	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	98.7	176.6	-176.8	0	0	0	0	110	C411 S413 D414	C411-C423 HydrophobicContact CB-CB 3.74Å; C411-C423 WeakPolarHBondContact CB-SG 2.99Å; C411-C423 PolarHBondContact O-SG 2.9Å; C411-C423 WeakPolarHBondContact SG-CA 3.35Å; C411-C423 WeakPolarHBondContact SG-CB 3.4Å; C411-C423 CovalentContact SG-SG 2.03Å; C411-C423 PolarHBondContact SG-SG 3.36Å; S413-C423 VanDerWaalsContact O-CB 3.25Å; S413-C423 WeakPolarHBondContact O-CB 3.29Å; D414-C423 PolarHBondContact OD1-N 3.47Å
424	C	84.9	Confident	77.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	142.3	-173.4	-62.2	0	0	0	0	111.6	C396 N422 R430 Q431 M433	C396-C424 WeakPolarHBondContact CA-SG 3.47Å; C396-C424 HydrophobicContact CB-CB 3.59Å; C396-C424 WeakPolarHBondContact CB-SG 3.32Å; C396-C424 WeakPolarHBondContact SG-CA 3.07Å; C396-C424 WeakPolarHBondContact SG-CB 3.43Å; C396-C424 CovalentContact SG-SG 2.03Å; C396-C424 PolarHBondContact SG-SG 2.86Å; N422-C424 PolarHBondContact O-N 3.34Å; N422-C424 VanDerWaalsContact O-N 3.13Å; N422-C424 PolarHBondContact O-SG 2.84Å; C424-R430 CarbonylContact O-C 3.37Å; C424-R430 WeakPolarHBondContact O-CA 3.23Å; C424-Q431 PolarHBondContact N-O 2.96Å; C424-Q431 PolarHBondContact O-N 3.36Å; C424-M433 HydrophobicContact CB-CB 4.09Å; C424-M433 HydrophobicContact CB-CG 3.85Å; C424-M433 HydrophobicContact CB-SD 3.46Å; C424-M433 WeakPolarHBondContact CB-SD 3.4Å
425	P	79.8	Confident	76.8	Confident	51 Å²	51	47 Å²	47	33%	0.331	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	138.1	169.9	28.8	-32.8	0	0	0	109.9	V399	V399-P425 VanDerWaalsContact CG2-C 3.49Å; V399-P425 HydrophobicContact CG2-CB 3.67Å; V399-P425 HydrophobicContact CG2-CG 3.65Å; V399-P425 WeakPolarHBondContact CG2-O 3.21Å
426	T	73.5	Confident	75.6	Confident	12 Å²	12	50 Å²	50	7%	0.074	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	171.9	174.7	73.4	0	0	0	0	109.6	A428 G429 Q431 M433	T426-A428 PolarHBondContact O-N 3.02Å; T426-A428 PolarHBondContact OG1-N 2.82Å; T426-G429 PolarHBondContact N-O 3.33Å; T426-G429 PolarHBondContact O-N 3.49Å; T426-G429 PolarHBondContact OG1-N 3.38Å; T426-G429 PolarHBondContact OG1-O 2.8Å; T426-Q431 HydrophobicContact CG2-CB 4.01Å; T426-M433 HydrophobicContact CG2-CE 4.13Å
427	A	70.8	Confident	74.3	Confident	79 Å²	79	52.2 Å²	52.2	65%	0.653	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.3	174.6	0	0	0	0	0	113.1	Q407	Q407-A427 PolarHBondContact NE2-O 2.83Å
428	A	69.2	Low	72.5	Confident	55 Å²	55	54.5 Å²	54.5	46%	0.455	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-13	179.9	0	0	0	0	0	113.9	Q407 V408 T426	Q407-A428 CarbonylContact C-O 3.57Å; Q407-A428 WeakPolarHBondContact CA-O 3.23Å; Q407-A428 WeakPolarHBondContact CB-O 3.17Å; V408-A428 PolarHBondContact N-O 3.42Å; T426-A428 PolarHBondContact O-N 3.02Å; T426-A428 PolarHBondContact OG1-N 2.82Å
429	G	74	Confident	70.5	Confident	3 Å²	3	53.8 Å²	53.8	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145	-142.4	-177.9	0	0	0	0	0	111.6	V408 T426	V408-G429 WeakPolarHBondContact O-CA 3.41Å; T426-G429 PolarHBondContact N-O 3.33Å; T426-G429 PolarHBondContact O-N 3.49Å; T426-G429 PolarHBondContact OG1-N 3.38Å; T426-G429 PolarHBondContact OG1-O 2.8Å
430	R	83.5	Confident	69	Low	55 Å²	55	55.2 Å²	55.2	21%	0.208	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	135.9	171.4	-79.6	178.2	-80.1	162.6	9.7	108.1	H409 F410 C411 D412 C424	H409-R430 HydrophobicContact CB-CB 4.31Å; H409-R430 PolarHBondContact CE1-NE 3.28Å; H409-R430 WeakPolarHBondContact ND1-CB 3.34Å; H409-R430 WeakPolarHBondContact ND1-CG 3.44Å; H409-R430 PolarHBondContact ND1-N 3.12Å; H409-R430 VanDerWaalsContact ND1-N 3.13Å; H409-R430 PolarHBondContact ND1-NE 3.32Å; F410-R430 WeakPolarHBondContact CB-O 3.46Å; F410-R430 PolarHBondContact N-O 3.17Å; C411-R430 WeakPolarHBondContact O-CB 3.07Å; D412-R430 VanDerWaalsContact CA-NH1 3.27Å; D412-R430 PolarHBondContact O-NH1 3.41Å; D412-R430 IonicContact OD1-CZ 3.13Å; D412-R430 IonicContact OD1-NH1 3.03Å; D412-R430 PolarHBondContact OD1-NH1 3.49Å; D412-R430 IonicContact OD1-NH2 2.67Å; D412-R430 PolarHBondContact OD1-NH2 2.79Å; C424-R430 CarbonylContact O-C 3.37Å; C424-R430 WeakPolarHBondContact O-CA 3.23Å
431	Q	85.1	Confident	67.6	Low	58 Å²	58	56.1 Å²	56.1	27%	0.271	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	144.6	-179.6	-164.4	175.2	4.6	0	0	110.5	F410 C411 C424 T426 M433	F410-Q431 HydrophobicContact CB-CG 4.27Å; F410-Q431 HydrophobicContact CD2-CB 4.16Å; F410-Q431 HydrophobicContact CD2-CG 4Å; F410-Q431 HydrophobicContact CG-CG 4.38Å; C411-Q431 VanDerWaalsContact SG-CA 3.58Å; C411-Q431 PolarHBondContact SG-N 3.13Å; C411-Q431 VanDerWaalsContact SG-N 3.42Å; C424-Q431 PolarHBondContact N-O 2.96Å; C424-Q431 PolarHBondContact O-N 3.36Å; T426-Q431 HydrophobicContact CG2-CB 4.01Å; Q431-M433 PolarHBondContact O-N 3.35Å
432	C	84.5	Confident	65.8	Low	30 Å²	30	56.9 Å²	56.9	20%	0.203	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	123.9	174.5	-62.8	0	0	0	0	110.2	C411 C417 E421 N422	C411-C432 VanDerWaalsContact CB-SG 3.55Å; C417-C432 WeakPolarHBondContact CA-SG 3.33Å; C417-C432 HydrophobicContact CB-CB 3.59Å; C417-C432 WeakPolarHBondContact CB-SG 3.12Å; C417-C432 WeakPolarHBondContact SG-CA 3.21Å; C417-C432 WeakPolarHBondContact SG-CB 3.46Å; C417-C432 CovalentContact SG-SG 2.03Å; C417-C432 PolarHBondContact SG-SG 2.86Å; E421-C432 HydrophobicContact CB-CB 4.27Å; E421-C432 VanDerWaalsContact OE2-CB 3.32Å; E421-C432 WeakPolarHBondContact OE2-CB 3.27Å; N422-C432 WeakPolarHBondContact O-CA 3.32Å
433	M	76.2	Confident	64	Low	23 Å²	23	61 Å²	61	11%	0.113	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137.1	176.4	-71.1	-177.3	138.1	0	0	108.9	P397 E421 N422 C424 T426 Q431 T435 V458 Y460	P397-M433 HydrophobicContact CG-CE 3.99Å; P397-M433 HydrophobicContact CG-SD 3.7Å; E421-M433 CarbonylContact C-O 3.46Å; E421-M433 WeakPolarHBondContact CA-O 3.47Å; E421-M433 WeakPolarHBondContact CB-O 2.97Å; N422-M433 PolarHBondContact N-O 2.78Å; N422-M433 PolarHBondContact O-N 2.84Å; C424-M433 HydrophobicContact CB-CB 4.09Å; C424-M433 HydrophobicContact CB-CG 3.85Å; C424-M433 HydrophobicContact CB-SD 3.46Å; C424-M433 WeakPolarHBondContact CB-SD 3.4Å; T426-M433 HydrophobicContact CG2-CE 4.13Å; Q431-M433 PolarHBondContact O-N 3.35Å; M433-T435 PolarHBondContact O-N 3.34Å; M433-V458 HydrophobicContact CE-CG1 4.26Å; M433-Y460 HydrophobicContact CE-CE2 4.28Å; M433-Y460 WeakPolarHBondContact CE-OH 3.14Å
434	N	73	Confident	61.5	Low	63 Å²	63	64.8 Å²	64.8	34%	0.337	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	106.7	173.3	-163.4	-59.6	0	0	0	109.9	N420 E421 R436 T437	N420-N434 WeakPolarHBondContact O-CA 3.39Å; N420-N434 PolarHBondContact O-OD1 2.98Å; E421-N434 HydrophobicContact CG-CB 4.23Å; N434-R436 PolarHBondContact OD1-N 2.77Å; N434-R436 VanDerWaalsContact OD1-N 3.16Å; N434-T437 PolarHBondContact O-OG1 3.16Å; N434-T437 PolarHBondContact OD1-N 3.44Å; N434-T437 PolarHBondContact OD1-OG1 3.47Å
435	T	61.8	Low	59.4	Low	10 Å²	10	68.5 Å²	68.5	6%	0.061	43%	0.43	C	S	.	.			trans	-96.5	-7.8	177.9	58.9	0	0	0	0	111.7	G395 N420 N422 M433 I438 S439	G395-T435 WeakPolarHBondContact O-CG2 3.31Å; N420-T435 PolarHBondContact O-N 3.03Å; N422-T435 HydrophobicContact CB-CG2 3.4Å; N422-T435 VanDerWaalsContact CB-CG2 3.4Å; N422-T435 VanDerWaalsContact CG-CG2 3.43Å; N422-T435 PolarHBondContact OD1-OG1 3.49Å; M433-T435 PolarHBondContact O-N 3.34Å; T435-I438 CarbonylContact O-C 3.6Å; T435-I438 WeakPolarHBondContact O-CA 3.1Å; T435-I438 WeakPolarHBondContact O-CB 3.34Å; T435-I438 PolarHBondContact O-N 2.75Å; T435-I438 VanDerWaalsContact O-O 3.09Å; T435-S439 PolarHBondContact O-N 3.37Å
436	R	53.6	Low	57.9	Low	168 Å²	168	70 Å²	70	63%	0.634	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.7	175.9	-68.9	-163.2	-167	176.7	-10.1	113.7	N420 N434	N420-R436 HydrophobicContact CB-CB 4.05Å; N420-R436 HydrophobicContact CB-CG 4.09Å; N420-R436 PolarHBondContact O-N 3.21Å; N420-R436 WeakPolarHBondContact OD1-CD 3.35Å; N420-R436 VanDerWaalsContact OD1-CZ 3.24Å; N420-R436 PolarHBondContact OD1-NE 3.17Å; N420-R436 PolarHBondContact OD1-NH1 3.26Å; N434-R436 PolarHBondContact OD1-N 2.77Å; N434-R436 VanDerWaalsContact OD1-N 3.16Å
437	T	50	Low	57	Low	115 Å²	115	73.8 Å²	73.8	71%	0.706	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-4.5	153.4	44.6	0	0	0	0	112.8	N434	N434-T437 PolarHBondContact O-OG1 3.16Å; N434-T437 PolarHBondContact OD1-N 3.44Å; N434-T437 PolarHBondContact OD1-OG1 3.47Å
438	I	46.3	Very low	56.7	Low	65 Å²	65	77.1 Å²	77.1	33%	0.333	45%	0.445	S	S	.	.	S	Bend	trans	-122.6	44.2	-179	-42.4	176.6	0	0	0	109.3	G395 T435 S440	G395-I438 WeakPolarHBondContact O-CD1 3.31Å; T435-I438 CarbonylContact O-C 3.6Å; T435-I438 WeakPolarHBondContact O-CA 3.1Å; T435-I438 WeakPolarHBondContact O-CB 3.34Å; T435-I438 PolarHBondContact O-N 2.75Å; T435-I438 VanDerWaalsContact O-O 3.09Å; I438-S440 PolarHBondContact O-N 2.99Å
439	S	36.3	Very low	56.8	Low	82 Å²	82	74.8 Å²	74.8	57%	0.573	43%	0.425	S	S	*	.			trans	-84.5	104.8	-178.8	-146.1	0	0	0	0	111.2	T435 S441	T435-S439 PolarHBondContact O-N 3.37Å; S439-S441 PolarHBondContact O-N 3.29Å; S439-S441 VanDerWaalsContact O-N 3.13Å
440	S	36.1	Very low	56.5	Low	124 Å²	124	78 Å²	78	87%	0.867	45%	0.447	S	S	*	.	S	Bend	trans	64.4	9.2	153.5	61.6	0	0	0	0	121.8	I438	I438-S440 PolarHBondContact O-N 2.99Å
441	S	37.2	Very low	55.6	Low	88 Å²	88	79.3 Å²	79.3	62%	0.615	46%	0.458	S	S	*	.	S	Bend	trans	-129.5	1.7	176.3	55.6	0	0	0	0	117.4	S439 V445	S439-S441 PolarHBondContact O-N 3.29Å; S439-S441 VanDerWaalsContact O-N 3.13Å; S441-V445 WeakPolarHBondContact O-CG2 3.34Å
442	I	40.7	Very low	54.6	Low	70 Å²	70	78.3 Å²	78.3	36%	0.359	46%	0.464	S	S	.	.			trans	-122.2	33.6	-169.8	-49.2	-171.4	0	0	0	114.2	A444 V445	I442-A444 PolarHBondContact O-N 3.29Å; I442-V445 HydrophobicContact CB-CB 3.93Å; I442-V445 HydrophobicContact CB-CG2 4.15Å; I442-V445 HydrophobicContact CD1-CB 4Å; I442-V445 HydrophobicContact CD1-CG1 4.34Å; I442-V445 HydrophobicContact CD1-CG2 4.25Å; I442-V445 HydrophobicContact CG1-CB 3.7Å; I442-V445 HydrophobicContact CG1-CG2 3.63Å; I442-V445 HydrophobicContact CG2-CB 3.47Å; I442-V445 VanDerWaalsContact CG2-CB 3.47Å; I442-V445 HydrophobicContact CG2-CG1 4.48Å; I442-V445 HydrophobicContact CG2-CG2 4.25Å; I442-V445 WeakPolarHBondContact CG2-O 3.29Å
443	A	40.9	Very low	53.8	Low	115 Å²	115	78.8 Å²	78.8	95%	0.95	47%	0.468	S	S	*	.	S	Bend	trans	-72.1	1.6	155.8	0	0	0	0	0	112
444	A	34.6	Very low	53.2	Low	94 Å²	94	86.4 Å²	86.4	78%	0.777	50%	0.495	S	S	*	.	S	Bend	trans	-148.3	4.8	-178.1	0	0	0	0	0	115.6	I442 Q446	I442-A444 PolarHBondContact O-N 3.29Å; A444-Q446 PolarHBondContact O-N 3.12Å
445	V	39.8	Very low	52.9	Low	78 Å²	78	84.3 Å²	84.3	47%	0.473	49%	0.486	S	S	.	.			trans	-88.6	109.1	176.2	-177.7	0	0	0	0	108	S441 I442 H447	S441-V445 WeakPolarHBondContact O-CG2 3.34Å; I442-V445 HydrophobicContact CB-CB 3.93Å; I442-V445 HydrophobicContact CB-CG2 4.15Å; I442-V445 HydrophobicContact CD1-CB 4Å; I442-V445 HydrophobicContact CD1-CG1 4.34Å; I442-V445 HydrophobicContact CD1-CG2 4.25Å; I442-V445 HydrophobicContact CG1-CB 3.7Å; I442-V445 HydrophobicContact CG1-CG2 3.63Å; I442-V445 HydrophobicContact CG2-CB 3.47Å; I442-V445 VanDerWaalsContact CG2-CB 3.47Å; I442-V445 HydrophobicContact CG2-CG1 4.48Å; I442-V445 HydrophobicContact CG2-CG2 4.25Å; I442-V445 WeakPolarHBondContact CG2-O 3.29Å; V445-H447 PolarHBondContact O-N 2.04Å
446	Q	48.9	Very low	53	Low	84 Å²	84	88.1 Å²	88.1	39%	0.393	51%	0.509	S	S	.	.			trans	-40	110.6	166.1	-76.2	161.2	-17.4	0	0	108	A444 R448 R454	A444-Q446 PolarHBondContact O-N 3.12Å; Q446-R448 VanDerWaalsContact C-N 3.26Å; Q446-R448 HydrophobicContact CB-CG 4.1Å; Q446-R448 WeakPolarHBondContact O-CG 3.48Å; Q446-R448 PolarHBondContact O-N 2.85Å; Q446-R454 VanDerWaalsContact NE2-NH2 3.17Å
447	H	54.9	Low	53.9	Low	91 Å²	91	83.9 Å²	83.9	42%	0.421	50%	0.496	S	S	.	.			trans	-59.9	101.4	170.3	-68.4	-72.3	0	0	0	105.7	V445 S455 L475	V445-H447 PolarHBondContact O-N 2.04Å; H447-S455 WeakPolarHBondContact CB-OG 3.41Å; H447-S455 WeakPolarHBondContact O-CB 3.03Å; H447-S455 PolarHBondContact O-N 3.44Å; H447-S455 PolarHBondContact O-OG 3.37Å; H447-S455 VanDerWaalsContact O-OG 3.12Å; H447-L475 HydrophobicContact CB-CD1 3.99Å; H447-L475 HydrophobicContact CB-CD2 3.97Å
448	R	64.1	Low	55.2	Low	148 Å²	148	81 Å²	81	56%	0.558	48%	0.478	S	S	*	.	B	Isolated β-bridge	trans	-97.5	133.4	179.9	-74.5	-179.2	-174.5	-166.8	1.9	106.6	Q446 G452 S453	Q446-R448 VanDerWaalsContact C-N 3.26Å; Q446-R448 HydrophobicContact CB-CG 4.1Å; Q446-R448 WeakPolarHBondContact O-CG 3.48Å; Q446-R448 PolarHBondContact O-N 2.85Å; R448-G452 WeakPolarHBondContact CD-O 2.91Å; R448-G452 WeakPolarHBondContact CG-O 3.32Å; R448-S453 CarbonylContact C-O 3.54Å; R448-S453 WeakPolarHBondContact CA-O 3.38Å
449	C	70.4	Confident	56.9	Low	6 Å²	6	78 Å²	78	4%	0.041	46%	0.463	C	S	.	.			trans	-59.5	166.5	164.9	-66	0	0	0	0	109.4	D451 G452 S453 C477	C449-D451 WeakPolarHBondContact CB-OD1 3.23Å; C449-D451 PolarHBondContact O-N 3.45Å; C449-G452 PolarHBondContact O-N 2.75Å; C449-S453 WeakPolarHBondContact CB-OG 3.46Å; C449-S453 PolarHBondContact N-O 3.31Å; C449-C477 VanDerWaalsContact CA-SG 3.53Å; C449-C477 HydrophobicContact CB-CB 3.78Å; C449-C477 WeakPolarHBondContact CB-SG 3.33Å; C449-C477 WeakPolarHBondContact SG-CA 3.45Å; C449-C477 WeakPolarHBondContact SG-CB 3.25Å; C449-C477 CovalentContact SG-SG 2.02Å; C449-C477 PolarHBondContact SG-SG 2.94Å
450	S	68.1	Low	58.8	Low	72 Å²	72	79.6 Å²	79.6	50%	0.503	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-16.7	-179.3	-49.8	0	0	0	0	113.4	E472	S450-E472 VanDerWaalsContact CB-OE1 3.23Å; S450-E472 WeakPolarHBondContact CB-OE1 3.4Å; S450-E472 PolarHBondContact OG-OE1 2.9Å
451	D	64.8	Low	60.6	Low	81 Å²	81	75.9 Å²	75.9	43%	0.433	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	1.2	175.4	66.4	-1.8	0	0	0	114.8	C449 S453	C449-D451 WeakPolarHBondContact CB-OD1 3.23Å; C449-D451 PolarHBondContact O-N 3.45Å; D451-S453 VanDerWaalsContact C-N 3.3Å; D451-S453 VanDerWaalsContact CG-OG 3.31Å; D451-S453 PolarHBondContact O-N 2.03Å; D451-S453 WeakPolarHBondContact OD1-CB 3.31Å; D451-S453 PolarHBondContact OD1-N 2.02Å; D451-S453 PolarHBondContact OD1-OG 3.08Å; D451-S453 PolarHBondContact OD2-OG 3.35Å
452	G	63.7	Low	62.5	Low	38 Å²	38	76 Å²	76	39%	0.392	43%	0.425	S	S	.	.	S	Bend	trans	83.3	-4.5	-176	0	0	0	0	0	115.1	R448 C449	R448-G452 WeakPolarHBondContact CD-O 2.91Å; R448-G452 WeakPolarHBondContact CG-O 3.32Å; C449-G452 PolarHBondContact O-N 2.75Å
453	S	69	Low	64.2	Low	40 Å²	40	80.6 Å²	80.6	28%	0.28	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-70.4	153.9	176.2	72.1	0	0	0	0	111.1	R448 C449 D451 S455	R448-S453 CarbonylContact C-O 3.54Å; R448-S453 WeakPolarHBondContact CA-O 3.38Å; C449-S453 WeakPolarHBondContact CB-OG 3.46Å; C449-S453 PolarHBondContact N-O 3.31Å; D451-S453 VanDerWaalsContact C-N 3.3Å; D451-S453 VanDerWaalsContact CG-OG 3.31Å; D451-S453 PolarHBondContact O-N 2.03Å; D451-S453 WeakPolarHBondContact OD1-CB 3.31Å; D451-S453 PolarHBondContact OD1-N 2.02Å; D451-S453 PolarHBondContact OD1-OG 3.08Å; D451-S453 PolarHBondContact OD2-OG 3.35Å; S453-S455 PolarHBondContact O-N 2.03Å
454	R	63.7	Low	65.7	Low	182 Å²	182	79.4 Å²	79.4	69%	0.687	42%	0.424	S	S	*	.	B	Isolated β-bridge	trans	-72.3	120.2	178.9	-72.2	-176.1	179.5	-166.3	2.2	109.6	Q446	Q446-R454 VanDerWaalsContact NE2-NH2 3.17Å
455	S	65.2	Low	67.8	Low	20 Å²	20	75.6 Å²	75.6	14%	0.14	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-67.4	149.2	168.9	79.1	0	0	0	0	110.5	H447 S453	H447-S455 WeakPolarHBondContact CB-OG 3.41Å; H447-S455 WeakPolarHBondContact O-CB 3.03Å; H447-S455 PolarHBondContact O-N 3.44Å; H447-S455 PolarHBondContact O-OG 3.37Å; H447-S455 VanDerWaalsContact O-OG 3.12Å; S453-S455 PolarHBondContact O-N 2.03Å
456	V	65	Low	69.5	Low	90 Å²	90	78.5 Å²	78.5	55%	0.545	40%	0.398	S	S	.	.			trans	-91.8	-35.3	-173.5	179.4	0	0	0	0	112	M469 C476	V456-M469 HydrophobicContact CB-CE 3.67Å; V456-M469 HydrophobicContact CB-SD 3.64Å; V456-M469 HydrophobicContact CG1-CE 3.81Å; V456-M469 HydrophobicContact CG1-SD 4.4Å; V456-M469 HydrophobicContact CG2-CE 3.8Å; V456-M469 HydrophobicContact CG2-SD 3.33Å; V456-M469 WeakPolarHBondContact CG2-SD 3.44Å; V456-C476 PolarHBondContact N-O 3.15Å; V456-C476 VanDerWaalsContact N-O 3.11Å
457	Q	71.3	Confident	70.3	Confident	79 Å²	79	81.3 Å²	81.3	37%	0.369	42%	0.416	S	S	.	.			trans	-163	172	178.3	66.9	178.2	35	0	0	110.8	E464 L475 C476	Q457-E464 PolarHBondContact NE2-O 2.72Å; Q457-L475 CarbonylContact O-C 3.32Å; Q457-L475 WeakPolarHBondContact O-CA 2.99Å; Q457-C476 HydrophobicContact CG-CB 3.77Å; Q457-C476 WeakPolarHBondContact CG-SG 3.32Å; Q457-C476 PolarHBondContact NE2-SG 3.44Å; Q457-C476 VanDerWaalsContact NE2-SG 3.35Å; Q457-C476 PolarHBondContact O-N 3.31Å
458	V	78.9	Confident	70.8	Confident	55 Å²	55	79.5 Å²	79.5	33%	0.333	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-80.5	149.8	168.5	-176.8	0	0	0	0	109.6	P397 M433 G474 L475	P397-V458 HydrophobicContact CB-CG2 4.42Å; M433-V458 HydrophobicContact CE-CG1 4.26Å; V458-G474 CarbonylContact C-O 3.5Å; V458-G474 WeakPolarHBondContact CA-O 3.36Å; V458-G474 WeakPolarHBondContact CG1-O 3.23Å; V458-L475 HydrophobicContact CG2-CD2 4.17Å
459	C	81.7	Confident	71.3	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.014	40%	0.399	C	S	.	.			trans	-145.6	159.2	179.2	57.5	0	0	0	0	112.4	E464 C465 C471 G474 L475 C476	C459-E464 WeakPolarHBondContact CA-OE2 3.02Å; C459-E464 HydrophobicContact CB-CB 4.26Å; C459-C465 VanDerWaalsContact CB-SG 3.54Å; C459-C465 VanDerWaalsContact SG-SG 3.66Å; C459-C471 HydrophobicContact CB-CB 3.82Å; C459-C471 WeakPolarHBondContact CB-SG 3.32Å; C459-C471 PolarHBondContact O-SG 3.1Å; C459-C471 VanDerWaalsContact O-SG 3.34Å; C459-C471 WeakPolarHBondContact SG-CA 3.41Å; C459-C471 WeakPolarHBondContact SG-CB 3.27Å; C459-C471 CovalentContact SG-SG 2.02Å; C459-C471 PolarHBondContact SG-SG 2.84Å; C459-G474 PolarHBondContact N-O 2.84Å; C459-G474 CarbonylContact O-C 3.6Å; C459-G474 WeakPolarHBondContact O-CA 3.49Å; C459-L475 PolarHBondContact SG-N 2.78Å; C459-L475 VanDerWaalsContact SG-N 3.41Å; C459-C476 VanDerWaalsContact CB-SG 3.5Å
460	Y	75.4	Confident	71.8	Confident	114 Å²	114	75.6 Å²	75.6	45%	0.447	41%	0.413	S	S	.	.	S	Bend	trans	-114.2	-17.8	171.9	-64.4	-84.1	0	0	0	112.8	M433 E464	M433-Y460 HydrophobicContact CE-CE2 4.28Å; M433-Y460 WeakPolarHBondContact CE-OH 3.14Å; Y460-E464 WeakPolarHBondContact CD2-OE2 3.39Å; Y460-E464 PolarHBondContact N-OE2 3.06Å
461	S	74.4	Confident	72.5	Confident	46 Å²	46	73.4 Å²	73.4	32%	0.322	40%	0.397	S	S	.	.	S	Bend	trans	-153.5	162.2	174.5	68.1	0	0	0	0	110.4	L463 E464	S461-L463 PolarHBondContact O-N 2.86Å; S461-L463 VanDerWaalsContact O-N 3.12Å; S461-E464 PolarHBondContact O-N 2.86Å; S461-E464 VanDerWaalsContact O-N 3.11Å
462	D	76.3	Confident	73.1	Confident	92 Å²	92	72.3 Å²	72.3	49%	0.492	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-58.8	-25	178.3	-63.1	-23.7	0	0	0	113.2	E464 C465 V470 C471	D462-E464 PolarHBondContact O-N 2.91Å; D462-C465 PolarHBondContact O-N 3.3Å; D462-V470 WeakPolarHBondContact OD1-CG1 3.41Å; D462-C471 WeakPolarHBondContact OD1-CB 2.99Å; D462-C471 PolarHBondContact OD1-N 3.03Å
463	L	76.5	Confident	73.5	Confident	166 Å²	166	76.2 Å²	76.2	87%	0.869	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-68.1	-22.8	179.1	-79.9	103.4	0	0	0	113.7	S461 C465	S461-L463 PolarHBondContact O-N 2.86Å; S461-L463 VanDerWaalsContact O-N 3.12Å; L463-C465 VanDerWaalsContact C-N 3.3Å
464	E	72.1	Confident	73.7	Confident	89 Å²	89	75.6 Å²	75.6	42%	0.416	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-80.6	-20	-179	-65.6	175.6	179.8	0	0	111.4	Q457 C459 Y460 S461 D462	Q457-E464 PolarHBondContact NE2-O 2.72Å; C459-E464 WeakPolarHBondContact CA-OE2 3.02Å; C459-E464 HydrophobicContact CB-CB 4.26Å; Y460-E464 WeakPolarHBondContact CD2-OE2 3.39Å; Y460-E464 PolarHBondContact N-OE2 3.06Å; S461-E464 PolarHBondContact O-N 2.86Å; S461-E464 VanDerWaalsContact O-N 3.11Å; D462-E464 PolarHBondContact O-N 2.91Å
465	C	79.9	Confident	74.6	Confident	14 Å²	14	68.1 Å²	68.1	10%	0.095	38%	0.375	C	S	.	.	S	Bend	trans	-80.9	125.7	-175.8	-67.8	0	0	0	0	112.8	C459 D462 L463 M469 C476	C459-C465 VanDerWaalsContact CB-SG 3.54Å; C459-C465 VanDerWaalsContact SG-SG 3.66Å; D462-C465 PolarHBondContact O-N 3.3Å; L463-C465 VanDerWaalsContact C-N 3.3Å; C465-M469 HydrophobicContact CB-CB 3.77Å; C465-M469 WeakPolarHBondContact CB-O 3.43Å; C465-C476 WeakPolarHBondContact CA-SG 2.96Å; C465-C476 HydrophobicContact CB-CB 3.77Å; C465-C476 WeakPolarHBondContact CB-SG 3.22Å; C465-C476 WeakPolarHBondContact SG-CA 3.41Å; C465-C476 WeakPolarHBondContact SG-CB 3.38Å; C465-C476 CovalentContact SG-SG 2.04Å; C465-C476 PolarHBondContact SG-SG 2.75Å
466	K	75.4	Confident	75.4	Confident	139 Å²	139	67.2 Å²	67.2	60%	0.604	37%	0.368	S	S	*	.	S	Bend	trans	-70.3	143.8	-179.7	-163.5	174.2	-178.7	-179.9	0	110.5	M469	K466-M469 HydrophobicContact CB-CE 3.87Å; K466-M469 WeakPolarHBondContact O-CB 3.29Å; K466-M469 WeakPolarHBondContact O-CE 3.2Å; K466-M469 WeakPolarHBondContact O-CG 3.05Å; K466-M469 PolarHBondContact O-N 2.95Å
467	N	65.5	Low	76.3	Confident	144 Å²	144	63.1 Å²	63.1	77%	0.77	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	63.1	166.9	-62.4	-7.1	0	0	0	115.6	M469	N467-M469 PolarHBondContact O-N 3.06Å; N467-M469 VanDerWaalsContact O-N 3.11Å
468	G	65.1	Low	76.4	Confident	52 Å²	52	63 Å²	63	54%	0.536	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	23.7	170.8	0	0	0	0	0	114	Q479	G468-Q479 WeakPolarHBondContact O-CB 3Å; G468-Q479 PolarHBondContact O-N 3.4Å
469	M	75.7	Confident	75.6	Confident	20 Å²	20	66 Å²	66	10%	0.099	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	144	168.1	-70.6	-171.3	-81	0	0	109.1	V456 C465 K466 N467 C476 C477	V456-M469 HydrophobicContact CB-CE 3.67Å; V456-M469 HydrophobicContact CB-SD 3.64Å; V456-M469 HydrophobicContact CG1-CE 3.81Å; V456-M469 HydrophobicContact CG1-SD 4.4Å; V456-M469 HydrophobicContact CG2-CE 3.8Å; V456-M469 HydrophobicContact CG2-SD 3.33Å; V456-M469 WeakPolarHBondContact CG2-SD 3.44Å; C465-M469 HydrophobicContact CB-CB 3.77Å; C465-M469 WeakPolarHBondContact CB-O 3.43Å; K466-M469 HydrophobicContact CB-CE 3.87Å; K466-M469 WeakPolarHBondContact O-CB 3.29Å; K466-M469 WeakPolarHBondContact O-CE 3.2Å; K466-M469 WeakPolarHBondContact O-CG 3.05Å; K466-M469 PolarHBondContact O-N 2.95Å; N467-M469 PolarHBondContact O-N 3.06Å; N467-M469 VanDerWaalsContact O-N 3.11Å; M469-C476 HydrophobicContact CB-CB 4.14Å; M469-C476 HydrophobicContact CE-CB 4.42Å; M469-C476 HydrophobicContact SD-CB 4.13Å; M469-C477 CarbonylContact C-O 3.52Å; M469-C477 WeakPolarHBondContact CA-O 3.44Å; M469-C477 VanDerWaalsContact CB-O 3.27Å; M469-C477 WeakPolarHBondContact CB-O 3.01Å
470	V	79.4	Confident	74.1	Confident	53 Å²	53	69.2 Å²	69.2	32%	0.321	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	145.8	177	176.2	0	0	0	0	108.7	D462 E472 C477 Q479	D462-V470 WeakPolarHBondContact OD1-CG1 3.41Å; V470-E472 PolarHBondContact O-N 3.07Å; V470-C477 PolarHBondContact N-O 3.49Å; V470-C477 PolarHBondContact O-N 3.07Å; V470-Q479 HydrophobicContact CG2-CB 3.97Å; V470-Q479 HydrophobicContact CG2-CG 4Å
471	C	82.6	Confident	72.6	Confident	26 Å²	26	69.5 Å²	69.5	18%	0.176	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	93.5	176.3	-169.7	0	0	0	0	110.6	C459 D462	C459-C471 HydrophobicContact CB-CB 3.82Å; C459-C471 WeakPolarHBondContact CB-SG 3.32Å; C459-C471 PolarHBondContact O-SG 3.1Å; C459-C471 VanDerWaalsContact O-SG 3.34Å; C459-C471 WeakPolarHBondContact SG-CA 3.41Å; C459-C471 WeakPolarHBondContact SG-CB 3.27Å; C459-C471 CovalentContact SG-SG 2.02Å; C459-C471 PolarHBondContact SG-SG 2.84Å; D462-C471 WeakPolarHBondContact OD1-CB 2.99Å; D462-C471 PolarHBondContact OD1-N 3.03Å
472	E	77.8	Confident	71.1	Confident	57 Å²	57	74 Å²	74	27%	0.266	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.1	179.1	-169	-179.6	178.1	0	0	109.6	S450 V470 G474 L475 C477	S450-E472 VanDerWaalsContact CB-OE1 3.23Å; S450-E472 WeakPolarHBondContact CB-OE1 3.4Å; S450-E472 PolarHBondContact OG-OE1 2.9Å; V470-E472 PolarHBondContact O-N 3.07Å; E472-G474 PolarHBondContact O-N 2.89Å; E472-G474 VanDerWaalsContact O-N 3.16Å; E472-L475 PolarHBondContact N-O 3.21Å; E472-L475 PolarHBondContact O-N 2.69Å; E472-C477 HydrophobicContact CB-CB 4.39Å
473	N	72.6	Confident	69.7	Low	120 Å²	120	71.1 Å²	71.1	64%	0.642	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	36.8	-179.8	-61.5	-35.5	0	0	0	113.8	L475	N473-L475 VanDerWaalsContact C-N 3.29Å; N473-L475 PolarHBondContact O-N 3.44Å
474	G	73.7	Confident	68.4	Low	27 Å²	27	65.6 Å²	65.6	28%	0.278	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	15.2	-177.9	0	0	0	0	0	114.4	V458 C459 E472	V458-G474 CarbonylContact C-O 3.5Å; V458-G474 WeakPolarHBondContact CA-O 3.36Å; V458-G474 WeakPolarHBondContact CG1-O 3.23Å; C459-G474 PolarHBondContact N-O 2.84Å; C459-G474 CarbonylContact O-C 3.6Å; C459-G474 WeakPolarHBondContact O-CA 3.49Å; E472-G474 PolarHBondContact O-N 2.89Å; E472-G474 VanDerWaalsContact O-N 3.16Å
475	L	81.8	Confident	67.8	Low	26 Å²	26	62.1 Å²	62.1	14%	0.136	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.4	176.1	-64.1	175.1	0	0	0	110.8	H447 Q457 V458 C459 E472 N473 C477	H447-L475 HydrophobicContact CB-CD1 3.99Å; H447-L475 HydrophobicContact CB-CD2 3.97Å; Q457-L475 CarbonylContact O-C 3.32Å; Q457-L475 WeakPolarHBondContact O-CA 2.99Å; V458-L475 HydrophobicContact CG2-CD2 4.17Å; C459-L475 PolarHBondContact SG-N 2.78Å; C459-L475 VanDerWaalsContact SG-N 3.41Å; E472-L475 PolarHBondContact N-O 3.21Å; E472-L475 PolarHBondContact O-N 2.69Å; N473-L475 VanDerWaalsContact C-N 3.29Å; N473-L475 PolarHBondContact O-N 3.44Å; L475-C477 PolarHBondContact O-N 2.89Å
476	C	83.1	Confident	67.4	Low	0 Å²	0	68 Å²	68	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	110.1	170.7	-67	0	0	0	0	110	V456 Q457 C459 C465 M469	V456-C476 PolarHBondContact N-O 3.15Å; V456-C476 VanDerWaalsContact N-O 3.11Å; Q457-C476 HydrophobicContact CG-CB 3.77Å; Q457-C476 WeakPolarHBondContact CG-SG 3.32Å; Q457-C476 PolarHBondContact NE2-SG 3.44Å; Q457-C476 VanDerWaalsContact NE2-SG 3.35Å; Q457-C476 PolarHBondContact O-N 3.31Å; C459-C476 VanDerWaalsContact CB-SG 3.5Å; C465-C476 WeakPolarHBondContact CA-SG 2.96Å; C465-C476 HydrophobicContact CB-CB 3.77Å; C465-C476 WeakPolarHBondContact CB-SG 3.22Å; C465-C476 WeakPolarHBondContact SG-CA 3.41Å; C465-C476 WeakPolarHBondContact SG-CB 3.38Å; C465-C476 CovalentContact SG-SG 2.04Å; C465-C476 PolarHBondContact SG-SG 2.75Å; M469-C476 HydrophobicContact CB-CB 4.14Å; M469-C476 HydrophobicContact CE-CB 4.42Å; M469-C476 HydrophobicContact SD-CB 4.13Å
477	C	82.1	Confident	67.5	Low	5 Å²	5	63.3 Å²	63.3	3%	0.034	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	135.5	-179.3	-68.6	0	0	0	0	109.2	C449 M469 V470 E472 L475 Q479	C449-C477 VanDerWaalsContact CA-SG 3.53Å; C449-C477 HydrophobicContact CB-CB 3.78Å; C449-C477 WeakPolarHBondContact CB-SG 3.33Å; C449-C477 WeakPolarHBondContact SG-CA 3.45Å; C449-C477 WeakPolarHBondContact SG-CB 3.25Å; C449-C477 CovalentContact SG-SG 2.02Å; C449-C477 PolarHBondContact SG-SG 2.94Å; M469-C477 CarbonylContact C-O 3.52Å; M469-C477 WeakPolarHBondContact CA-O 3.44Å; M469-C477 VanDerWaalsContact CB-O 3.27Å; M469-C477 WeakPolarHBondContact CB-O 3.01Å; V470-C477 PolarHBondContact N-O 3.49Å; V470-C477 PolarHBondContact O-N 3.07Å; E472-C477 HydrophobicContact CB-CB 4.39Å; L475-C477 PolarHBondContact O-N 2.89Å; C477-Q479 PolarHBondContact O-N 3.11Å; C477-Q479 VanDerWaalsContact O-N 3.08Å
478	S	73.6	Confident	67.8	Low	75 Å²	75	58 Å²	58	52%	0.524	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.4	121.7	171.9	-66.6	0	0	0	0	108.6	K480	S478-K480 PolarHBondContact O-N 3.14Å
479	Q	62.3	Low	67.8	Low	120 Å²	120	63 Å²	63	56%	0.561	34%	0.344	S	S	*	.			trans	-51.8	117.5	174.8	-177.2	176.6	49.6	0	0	106	G468 V470 C477 T481	G468-Q479 WeakPolarHBondContact O-CB 3Å; G468-Q479 PolarHBondContact O-N 3.4Å; V470-Q479 HydrophobicContact CG2-CB 3.97Å; V470-Q479 HydrophobicContact CG2-CG 4Å; C477-Q479 PolarHBondContact O-N 3.11Å; C477-Q479 VanDerWaalsContact O-N 3.08Å; Q479-T481 VanDerWaalsContact C-N 3.29Å; Q479-T481 PolarHBondContact O-N 3.34Å
480	K	51	Low	67	Low	69 Å²	69	67.2 Å²	67.2	30%	0.3	37%	0.365	S	S	.	.			trans	-51.6	98.9	173.2	-93.7	175.3	-177.4	154.6	0	107.9	S478 E482 S484	S478-K480 PolarHBondContact O-N 3.14Å; K480-E482 VanDerWaalsContact CB-O 3.23Å; K480-E482 WeakPolarHBondContact CB-O 3.33Å; K480-E482 WeakPolarHBondContact CG-O 3.09Å; K480-E482 PolarHBondContact O-N 3.25Å; K480-S484 WeakPolarHBondContact CD-OG 3.15Å; K480-S484 VanDerWaalsContact CE-OG 3.25Å; K480-S484 WeakPolarHBondContact CE-OG 2.94Å; K480-S484 PolarHBondContact NZ-OG 3.31Å
481	T	43.9	Very low	65.6	Low	120 Å²	120	74.2 Å²	74.2	74%	0.736	39%	0.387	S	S	*	.	S	Bend	trans	-73.4	18.2	155.6	56.5	0	0	0	0	110.5	Q479	Q479-T481 VanDerWaalsContact C-N 3.29Å; Q479-T481 PolarHBondContact O-N 3.34Å
482	E	42.7	Very low	64.4	Low	139 Å²	139	78.3 Å²	78.3	65%	0.65	40%	0.399	S	S	*	.	S	Bend	trans	-138.6	108.6	168.9	-75.7	-171.9	154.1	0	0	107.2	K480 S484	K480-E482 VanDerWaalsContact CB-O 3.23Å; K480-E482 WeakPolarHBondContact CB-O 3.33Å; K480-E482 WeakPolarHBondContact CG-O 3.09Å; K480-E482 PolarHBondContact O-N 3.25Å; E482-S484 PolarHBondContact O-N 3.43Å
483	R	47.8	Very low	62.8	Low	33 Å²	33	83.6 Å²	83.6	13%	0.125	42%	0.424	C	S	.	.			trans	-47.3	122.4	176.3	-69	172.9	-171.4	-152.1	-7.5	109.4	G485 D506 C509 D511 R514 K515	R483-G485 PolarHBondContact O-N 2.85Å; R483-D506 HydrophobicContact CG-CB 4.2Å; R483-D506 PolarHBondContact NE-O 3.28Å; R483-D506 PolarHBondContact NH1-O 3.26Å; R483-D506 PolarHBondContact NH2-O 2.57Å; R483-C509 PolarHBondContact NH1-O 3.34Å; R483-C509 PolarHBondContact NH2-O 3.09Å; R483-D511 PolarHBondContact NH1-O 3.26Å; R483-R514 WeakPolarHBondContact CD-O 3.32Å; R483-R514 PolarHBondContact NH1-O 3.28Å; R483-K515 HydrophobicContact CB-CD 4.35Å; R483-K515 HydrophobicContact CB-CG 3.8Å; R483-K515 WeakPolarHBondContact O-CD 3.36Å; R483-K515 PolarHBondContact O-NZ 3.34Å
484	S	48.8	Very low	61.7	Low	49 Å²	49	84 Å²	84	34%	0.343	43%	0.433	S	S	.	.	S	Bend	trans	-50.6	135	-176.6	-47.3	0	0	0	0	110.7	K480 E482 H528	K480-S484 WeakPolarHBondContact CD-OG 3.15Å; K480-S484 VanDerWaalsContact CE-OG 3.25Å; K480-S484 WeakPolarHBondContact CE-OG 2.94Å; K480-S484 PolarHBondContact NZ-OG 3.31Å; E482-S484 PolarHBondContact O-N 3.43Å; S484-H528 PolarHBondContact O-CD2 2.91Å; S484-H528 PolarHBondContact O-CE1 2.73Å; S484-H528 PolarHBondContact O-ND1 3.13Å; S484-H528 PolarHBondContact O-NE2 3.03Å; S484-H528 VanDerWaalsContact O-NE2 3.07Å
485	G	58.1	Low	60.8	Low	17 Å²	17	87.3 Å²	87.3	18%	0.175	45%	0.448	C	S	.	.	S	Bend	trans	112.1	159.1	174.3	0	0	0	0	0	114.6	R483 K515	R483-G485 PolarHBondContact O-N 2.85Å; G485-K515 WeakPolarHBondContact O-CD 3.27Å; G485-K515 VanDerWaalsContact O-CE 3.28Å; G485-K515 WeakPolarHBondContact O-CE 3.5Å; G485-K515 PolarHBondContact O-NZ 3.03Å; G485-K515 VanDerWaalsContact O-NZ 3.14Å
486	Q	72.9	Confident	59.6	Low	137 Å²	137	94.6 Å²	94.6	64%	0.64	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-93.4	151.8	-176.8	-90.9	73.9	-1.6	0	0	110.9	H528 T529	Q486-H528 CarbonylContact O-C 3.59Å; Q486-H528 WeakPolarHBondContact O-CA 3.28Å; Q486-T529 VanDerWaalsContact CB-OG1 3.28Å; Q486-T529 WeakPolarHBondContact CB-OG1 2.97Å; Q486-T529 PolarHBondContact O-N 2.79Å; Q486-T529 PolarHBondContact O-OG1 3.32Å
487	C	76.4	Confident	58.3	Low	40 Å²	40	97.8 Å²	97.8	27%	0.27	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-63.9	140.2	165.8	-73	0	0	0	0	109.7	Q489 C517	C487-Q489 PolarHBondContact O-N 3.28Å; C487-C517 WeakPolarHBondContact CA-SG 3.36Å; C487-C517 HydrophobicContact CB-CB 3.66Å; C487-C517 WeakPolarHBondContact CB-SG 3.39Å; C487-C517 WeakPolarHBondContact SG-CA 3.23Å; C487-C517 WeakPolarHBondContact SG-CB 3.43Å; C487-C517 CovalentContact SG-SG 2.03Å; C487-C517 PolarHBondContact SG-SG 3.06Å
488	P	73.1	Confident	57.1	Low	34 Å²	34	107.5 Å²	107.5	22%	0.221	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-58	126.8	174.9	24.6	-32.4	0	0	0	109	M490 L526 F527 T529	P488-M490 HydrophobicContact CB-CE 4.19Å; P488-M490 HydrophobicContact CG-CE 4.14Å; P488-M490 PolarHBondContact O-N 3.26Å; P488-L526 HydrophobicContact CG-CB 4.35Å; P488-L526 HydrophobicContact CG-CD1 3.85Å; P488-F527 WeakPolarHBondContact CD-O 3.11Å; P488-T529 HydrophobicContact CB-CG2 3.91Å
489	Q	63.4	Low	56.6	Low	155 Å²	155	107.3 Å²	107.3	72%	0.724	55%	0.552	S	S	*	*			trans	-68.1	107	-176.9	-163.7	179.3	1.2	0	0	108.7	C487 Y491	C487-Q489 PolarHBondContact O-N 3.28Å; Q489-Y491 HydrophobicContact CG-CE2 4.43Å
490	M	59.1	Low	57.1	Low	109 Å²	109	111.3 Å²	111.3	54%	0.537	56%	0.562	S	S	.	*			trans	-98.1	120.5	175.2	-65.1	-70.9	168.7	0	0	108.4	P488 Y492	P488-M490 HydrophobicContact CB-CE 4.19Å; P488-M490 HydrophobicContact CG-CE 4.14Å; P488-M490 PolarHBondContact O-N 3.26Å; M490-Y492 HydrophobicContact CB-CD1 3.97Å; M490-Y492 HydrophobicContact CB-CE1 4.23Å
491	Y	49.9	Very low	58.6	Low	201 Å²	201	111.9 Å²	111.9	79%	0.788	57%	0.569	S	S	*	*			trans	-83.1	118	168.9	-78.4	-91.2	0	0	0	108.7	Q489	Q489-Y491 HydrophobicContact CG-CE2 4.43Å
492	Y	59.2	Low	60.5	Low	111 Å²	111	112 Å²	112	44%	0.435	56%	0.561	S	S	.	*			trans	-145.4	147.9	172.4	57.9	-90.2	0	0	0	113.2	M490 L520	M490-Y492 HydrophobicContact CB-CD1 3.97Å; M490-Y492 HydrophobicContact CB-CE1 4.23Å; Y492-L520 VanDerWaalsContact CB-CD2 3.48Å; Y492-L520 HydrophobicContact CD1-CD2 4.48Å; Y492-L520 HydrophobicContact CD1-CG 4.29Å; Y492-L520 HydrophobicContact CD2-CD2 3.57Å; Y492-L520 HydrophobicContact CD2-CG 4.22Å; Y492-L520 HydrophobicContact CE2-CD2 4.41Å; Y492-L520 HydrophobicContact CG-CD2 3.61Å; Y492-L520 HydrophobicContact CG-CG 3.86Å
493	Q	44.3	Very low	62.6	Low	168 Å²	168	105.4 Å²	105.4	79%	0.785	53%	0.53	S	S	*	.			trans	-83.3	142.6	171.2	-69.3	-179.6	-19.1	0	0	109.5	T495	Q493-T495 PolarHBondContact O-N 3.04Å
494	P	48.1	Very low	64.4	Low	128 Å²	128	108.4 Å²	108.4	83%	0.831	55%	0.552	S	S	*	*			trans	-65.3	128.3	-178.1	-12.8	27.1	0	0	0	110.3
495	T	55.7	Low	66.1	Low	98 Å²	98	108.1 Å²	108.1	60%	0.601	55%	0.55	S	S	*	*			trans	-108.4	142.3	164.8	57.2	0	0	0	0	108.7	Q493 A497	Q493-T495 PolarHBondContact O-N 3.04Å; T495-A497 PolarHBondContact O-N 3.49Å
496	D	55.3	Low	67.1	Low	179 Å²	179	108.6 Å²	108.6	96%	0.957	55%	0.549	S	S	*	.	S	Bend	trans	-70	13.1	-174.9	-65.8	-50.5	0	0	0	115
497	A	56.7	Low	67.4	Low	66 Å²	66	107.9 Å²	107.9	55%	0.545	55%	0.549	S	S	.	.			trans	-86.9	114.4	179.4	0	0	0	0	0	109.7	T495 P499	T495-A497 PolarHBondContact O-N 3.49Å; A497-P499 WeakPolarHBondContact O-CD 3.47Å; A497-P499 WeakPolarHBondContact O-CG 2.94Å
498	K	57.1	Low	67.7	Low	209 Å²	209	110.2 Å²	110.2	91%	0.909	56%	0.556	S	S	*	*			trans	-54.6	107.3	170.3	-94.2	-178.3	179.1	177.5	0	109.5
499	P	63	Low	68.3	Low	72 Å²	72	108.7 Å²	108.7	47%	0.468	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-76.1	149.7	-177.2	-10.6	28.7	0	0	0	110.2	A497	A497-P499 WeakPolarHBondContact O-CD 3.47Å; A497-P499 WeakPolarHBondContact O-CG 2.94Å
500	R	72.8	Confident	69	Low	203 Å²	203	110.2 Å²	110.2	77%	0.766	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-93.7	119	176.4	-169.1	175.4	-177.8	169.2	0.3	109.5	H502	R500-H502 PolarHBondContact O-CD2 2.03Å
501	D	83.5	Confident	69.5	Low	81 Å²	81	107.7 Å²	107.7	43%	0.433	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-73.5	130.2	176.7	-69.1	-15.9	0	0	0	110.4	K523	D501-K523 HydrophobicContact CB-CB 4.01Å; D501-K523 HydrophobicContact CB-CG 4.49Å; D501-K523 WeakPolarHBondContact OD1-CB 3.42Å; D501-K523 WeakPolarHBondContact OD1-CG 3.09Å; D501-K523 PolarHBondContact OD1-N 3.23Å
502	H	82.7	Confident	70.3	Confident	123 Å²	123	105 Å²	105	57%	0.569	55%	0.546	S	S	*	.	S	Bend	trans	-103.4	-4.8	174.4	-75.1	-91.2	0	0	0	112.8	R500 K523 R524	R500-H502 PolarHBondContact O-CD2 2.03Å; H502-K523 PolarHBondContact N-O 3.05Å; H502-R524 PolarHBondContact CD2-NH1 3Å
503	C	87.5	Confident	70.9	Confident	1 Å²	1	106.8 Å²	106.8	1%	0.007	55%	0.552	C	S	.	*			trans	-149.9	147.8	169.5	59.2	0	0	0	0	107.6	E508 C516 K523 R524	C503-E508 WeakPolarHBondContact CA-OE2 3.37Å; C503-E508 HydrophobicContact CB-CB 4.1Å; C503-C516 HydrophobicContact CB-CB 3.82Å; C503-C516 WeakPolarHBondContact CB-SG 3.38Å; C503-C516 PolarHBondContact O-SG 3.33Å; C503-C516 WeakPolarHBondContact SG-CA 3.43Å; C503-C516 WeakPolarHBondContact SG-CB 3.16Å; C503-C516 CovalentContact SG-SG 2.04Å; C503-C516 PolarHBondContact SG-SG 3.42Å; C503-K523 WeakPolarHBondContact O-CB 3.31Å; C503-K523 WeakPolarHBondContact O-CD 3.45Å; C503-R524 VanDerWaalsContact SG-C 3.55Å
504	T	85.1	Confident	72.6	Confident	96 Å²	96	103.4 Å²	103.4	59%	0.589	53%	0.532	S	S	*	.	S	Bend	trans	-108.3	-24	171.7	73.5	0	0	0	0	112.7	E508	T504-E508 WeakPolarHBondContact CA-OE1 3.33Å; T504-E508 WeakPolarHBondContact CB-OE1 3.27Å; T504-E508 PolarHBondContact N-OE1 3.37Å; T504-E508 PolarHBondContact N-OE2 2.95Å; T504-E508 PolarHBondContact OG1-OE1 3.33Å
505	S	84.4	Confident	74.2	Confident	43 Å²	43	98.5 Å²	98.5	30%	0.301	50%	0.497	S	S	.	.	S	Bend	trans	-136.6	160.7	179	63.5	0	0	0	0	111.6	D507 E508 C516	S505-D507 PolarHBondContact O-N 3.32Å; S505-E508 PolarHBondContact N-OE1 2.99Å; S505-E508 PolarHBondContact O-N 3.3Å; S505-E508 PolarHBondContact OG-OE1 2.95Å; S505-C516 VanDerWaalsContact C-CB 3.47Å; S505-C516 VanDerWaalsContact O-CB 3.29Å; S505-C516 WeakPolarHBondContact O-CB 3.21Å
506	D	80	Confident	75.7	Confident	27 Å²	27	94.7 Å²	94.7	14%	0.144	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-57.3	-32.3	174	-80	-7.7	0	0	0	111.7	R483 E508 C509 K515 C516	R483-D506 HydrophobicContact CG-CB 4.2Å; R483-D506 PolarHBondContact NE-O 3.28Å; R483-D506 PolarHBondContact NH1-O 3.26Å; R483-D506 PolarHBondContact NH2-O 2.57Å; D506-E508 VanDerWaalsContact C-N 3.25Å; D506-E508 PolarHBondContact O-N 3.02Å; D506-C509 WeakPolarHBondContact O-CB 3.23Å; D506-C509 PolarHBondContact O-N 3.26Å; D506-C509 VanDerWaalsContact O-N 3.16Å; D506-K515 WeakPolarHBondContact OD1-CA 3.44Å; D506-K515 WeakPolarHBondContact OD1-CB 2.95Å; D506-K515 WeakPolarHBondContact OD2-CE 3.4Å; D506-K515 IonicContact OD2-NZ 3.93Å; D506-K515 PolarHBondContact OD2-NZ 3.13Å; D506-C516 PolarHBondContact OD1-N 3.26Å
507	D	78.9	Confident	77.3	Confident	121 Å²	121	86.2 Å²	86.2	65%	0.647	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-65.7	-24.1	-176.1	-60.8	-39.2	0	0	0	113.9	S505 C509	S505-D507 PolarHBondContact O-N 3.32Å; D507-C509 PolarHBondContact O-N 3.47Å
508	E	82.2	Confident	78.5	Confident	90 Å²	90	86.6 Å²	86.6	42%	0.421	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-73.2	-10.6	177.4	-73.3	163.7	-116.2	0	0	113.5	C503 T504 S505 D506	C503-E508 WeakPolarHBondContact CA-OE2 3.37Å; C503-E508 HydrophobicContact CB-CB 4.1Å; T504-E508 WeakPolarHBondContact CA-OE1 3.33Å; T504-E508 WeakPolarHBondContact CB-OE1 3.27Å; T504-E508 PolarHBondContact N-OE1 3.37Å; T504-E508 PolarHBondContact N-OE2 2.95Å; T504-E508 PolarHBondContact OG1-OE1 3.33Å; S505-E508 PolarHBondContact N-OE1 2.99Å; S505-E508 PolarHBondContact O-N 3.3Å; S505-E508 PolarHBondContact OG-OE1 2.95Å; D506-E508 VanDerWaalsContact C-N 3.25Å; D506-E508 PolarHBondContact O-N 3.02Å
509	C	85.4	Confident	79.6	Confident	1 Å²	1	78 Å²	78	1%	0.007	39%	0.391	C	S	.	.			trans	-87.5	111.3	-179.4	-63	0	0	0	0	110.5	R483 D506 D507 D511 R514 C525	R483-C509 PolarHBondContact NH1-O 3.34Å; R483-C509 PolarHBondContact NH2-O 3.09Å; D506-C509 WeakPolarHBondContact O-CB 3.23Å; D506-C509 PolarHBondContact O-N 3.26Å; D506-C509 VanDerWaalsContact O-N 3.16Å; D507-C509 PolarHBondContact O-N 3.47Å; C509-D511 PolarHBondContact O-N 3.3Å; C509-R514 HydrophobicContact CB-CB 4.18Å; C509-C525 WeakPolarHBondContact CA-SG 3.46Å; C509-C525 HydrophobicContact CB-CB 3.69Å; C509-C525 WeakPolarHBondContact CB-SG 3.49Å; C509-C525 WeakPolarHBondContact SG-CA 3.03Å; C509-C525 WeakPolarHBondContact SG-CB 3.3Å; C509-C525 CovalentContact SG-SG 2.02Å; C509-C525 PolarHBondContact SG-SG 3.46Å
510	L	78.1	Confident	80.1	Confident	187 Å²	187	79.4 Å²	79.4	98%	0.979	39%	0.394	S	S	*	.	S	Bend	trans	-55.7	-22.8	-175.1	-66.2	168.3	0	0	0	115.9
511	D	70.9	Confident	80.2	Confident	57 Å²	57	72.6 Å²	72.6	31%	0.305	38%	0.378	S	S	.	.	S	Bend	trans	-103.9	116.5	-176.7	-179.4	-5.6	0	0	0	110.7	R483 C509 R513 R514	R483-D511 PolarHBondContact NH1-O 3.26Å; C509-D511 PolarHBondContact O-N 3.3Å; D511-R513 PolarHBondContact O-N 3Å; D511-R513 WeakPolarHBondContact OD1-CB 3.37Å; D511-R513 PolarHBondContact OD1-N 2.68Å; D511-R514 HydrophobicContact CB-CG 3.98Å; D511-R514 WeakPolarHBondContact O-CB 2.96Å; D511-R514 PolarHBondContact O-N 2.62Å; D511-R514 IonicContact OD2-NE 3.91Å
512	L	66.1	Low	79.9	Confident	145 Å²	145	69 Å²	69	76%	0.759	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-19.4	178.6	-74.9	150.8	0	0	0	114.1
513	R	71.6	Confident	80	Confident	148 Å²	148	67 Å²	67	56%	0.558	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-3.1	176.8	-57.3	-179.9	179.4	-166.4	-1.2	114.2	D511 F527 H528	D511-R513 PolarHBondContact O-N 3Å; D511-R513 WeakPolarHBondContact OD1-CB 3.37Å; D511-R513 PolarHBondContact OD1-N 2.68Å; R513-F527 HydrophobicContact CB-CD1 3.91Å; R513-F527 HydrophobicContact CB-CE1 4.02Å; R513-F527 WeakPolarHBondContact O-CA 3.4Å; R513-H528 PolarHBondContact O-CD2 2.92Å; R513-H528 PolarHBondContact O-N 2.86Å
514	R	80	Confident	80	Confident	97 Å²	97	70.9 Å²	70.9	37%	0.366	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139.2	-175.8	-61.6	-175.8	-177	-156.8	-1.5	112.2	R483 C509 D511 C525 L526 F527	R483-R514 WeakPolarHBondContact CD-O 3.32Å; R483-R514 PolarHBondContact NH1-O 3.28Å; C509-R514 HydrophobicContact CB-CB 4.18Å; D511-R514 HydrophobicContact CB-CG 3.98Å; D511-R514 WeakPolarHBondContact O-CB 2.96Å; D511-R514 PolarHBondContact O-N 2.62Å; D511-R514 IonicContact OD2-NE 3.91Å; R514-C525 HydrophobicContact CB-CB 4.14Å; R514-L526 CarbonylContact C-O 3.52Å; R514-L526 WeakPolarHBondContact CA-O 3.21Å; R514-F527 HydrophobicContact CG-CD1 4.05Å; R514-F527 HydrophobicContact CG-CE1 4.03Å; R514-F527 HydrophobicContact CG-CG 4.46Å; R514-F527 HydrophobicContact CG-CZ 4.43Å
515	K	80.7	Confident	80.1	Confident	25 Å²	25	67.8 Å²	67.8	11%	0.109	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	153.3	172.1	-72.1	-175.3	73.8	118.2	0	111.1	R483 G485 D506 C517 C525 L526 H528	R483-K515 HydrophobicContact CB-CD 4.35Å; R483-K515 HydrophobicContact CB-CG 3.8Å; R483-K515 WeakPolarHBondContact O-CD 3.36Å; R483-K515 PolarHBondContact O-NZ 3.34Å; G485-K515 WeakPolarHBondContact O-CD 3.27Å; G485-K515 VanDerWaalsContact O-CE 3.28Å; G485-K515 WeakPolarHBondContact O-CE 3.5Å; G485-K515 PolarHBondContact O-NZ 3.03Å; G485-K515 VanDerWaalsContact O-NZ 3.14Å; D506-K515 WeakPolarHBondContact OD1-CA 3.44Å; D506-K515 WeakPolarHBondContact OD1-CB 2.95Å; D506-K515 WeakPolarHBondContact OD2-CE 3.4Å; D506-K515 IonicContact OD2-NZ 3.93Å; D506-K515 PolarHBondContact OD2-NZ 3.13Å; K515-C517 PolarHBondContact O-N 2.74Å; K515-C517 PolarHBondContact O-SG 2.7Å; K515-C525 CarbonylContact O-C 3.55Å; K515-C525 VanDerWaalsContact O-CA 3.29Å; K515-C525 WeakPolarHBondContact O-CA 3.45Å; K515-L526 PolarHBondContact N-O 2.91Å; K515-L526 PolarHBondContact O-N 3.37Å; K515-H528 HydrophobicContact CD-CB 3.71Å; K515-H528 HydrophobicContact CG-CB 3.99Å
516	C	88.4	Confident	80	Confident	17 Å²	17	68 Å²	68	12%	0.115	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	92.8	173.9	-172.5	0	0	0	0	110	C503 S505 D506	C503-C516 HydrophobicContact CB-CB 3.82Å; C503-C516 WeakPolarHBondContact CB-SG 3.38Å; C503-C516 PolarHBondContact O-SG 3.33Å; C503-C516 WeakPolarHBondContact SG-CA 3.43Å; C503-C516 WeakPolarHBondContact SG-CB 3.16Å; C503-C516 CovalentContact SG-SG 2.04Å; C503-C516 PolarHBondContact SG-SG 3.42Å; S505-C516 VanDerWaalsContact C-CB 3.47Å; S505-C516 VanDerWaalsContact O-CB 3.29Å; S505-C516 WeakPolarHBondContact O-CB 3.21Å; D506-C516 PolarHBondContact OD1-N 3.26Å
517	C	87.9	Confident	80	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.007	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	142.8	-169.9	-66.5	0	0	0	0	112.3	C487 K515 T519 K523 R524 L526	C487-C517 WeakPolarHBondContact CA-SG 3.36Å; C487-C517 HydrophobicContact CB-CB 3.66Å; C487-C517 WeakPolarHBondContact CB-SG 3.39Å; C487-C517 WeakPolarHBondContact SG-CA 3.23Å; C487-C517 WeakPolarHBondContact SG-CB 3.43Å; C487-C517 CovalentContact SG-SG 2.03Å; C487-C517 PolarHBondContact SG-SG 3.06Å; K515-C517 PolarHBondContact O-N 2.74Å; K515-C517 PolarHBondContact O-SG 2.7Å; C517-T519 PolarHBondContact O-N 3.45Å; C517-K523 WeakPolarHBondContact O-CA 3.15Å; C517-R524 PolarHBondContact N-O 3.37Å; C517-R524 PolarHBondContact O-N 3.38Å; C517-L526 HydrophobicContact CB-CB 3.91Å; C517-L526 HydrophobicContact CB-CD1 3.7Å; C517-L526 HydrophobicContact CB-CG 3.9Å
518	P	83.3	Confident	79.5	Confident	75 Å²	75	67.4 Å²	67.4	49%	0.487	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	130.2	174.4	28.6	-33.2	0	0	0	110.4
519	T	78.9	Confident	78.5	Confident	27 Å²	27	67.6 Å²	67.6	17%	0.166	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	167.1	173.3	75.8	0	0	0	0	110.6	C517 S521 G522 R524 L526	C517-T519 PolarHBondContact O-N 3.45Å; T519-S521 PolarHBondContact O-N 3.45Å; T519-S521 PolarHBondContact OG1-N 3.1Å; T519-S521 VanDerWaalsContact OG1-N 3.16Å; T519-G522 WeakPolarHBondContact CB-O 2.87Å; T519-G522 PolarHBondContact N-O 2.99Å; T519-G522 PolarHBondContact O-N 3.39Å; T519-G522 PolarHBondContact OG1-N 2.76Å; T519-G522 PolarHBondContact OG1-O 2.72Å; T519-R524 HydrophobicContact CG2-CB 3.83Å; T519-R524 HydrophobicContact CG2-CG 3.89Å; T519-L526 HydrophobicContact CG2-CD1 3.77Å; T519-L526 HydrophobicContact CG2-CG 4.29Å
520	L	74.2	Confident	76.9	Confident	102 Å²	102	69 Å²	69	53%	0.534	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-20.7	169.2	-82.5	170.3	0	0	0	114	Y492	Y492-L520 VanDerWaalsContact CB-CD2 3.48Å; Y492-L520 HydrophobicContact CD1-CD2 4.48Å; Y492-L520 HydrophobicContact CD1-CG 4.29Å; Y492-L520 HydrophobicContact CD2-CD2 3.57Å; Y492-L520 HydrophobicContact CD2-CG 4.22Å; Y492-L520 HydrophobicContact CE2-CD2 4.41Å; Y492-L520 HydrophobicContact CG-CD2 3.61Å; Y492-L520 HydrophobicContact CG-CG 3.86Å
521	S	74.8	Confident	75.4	Confident	61 Å²	61	64.9 Å²	64.9	43%	0.427	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	13.4	-179.1	-54.5	0	0	0	0	113.7	T519 R524	T519-S521 PolarHBondContact O-N 3.45Å; T519-S521 PolarHBondContact OG1-N 3.1Å; T519-S521 VanDerWaalsContact OG1-N 3.16Å; S521-R524 PolarHBondContact O-NH1 3.09Å
522	G	77.2	Confident	73.7	Confident	5 Å²	5	66.3 Å²	66.3	5%	0.052	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	106.6	-175.6	-178.3	0	0	0	0	0	112.4	T519 R524	T519-G522 WeakPolarHBondContact CB-O 2.87Å; T519-G522 PolarHBondContact N-O 2.99Å; T519-G522 PolarHBondContact O-N 3.39Å; T519-G522 PolarHBondContact OG1-N 2.76Å; T519-G522 PolarHBondContact OG1-O 2.72Å; G522-R524 PolarHBondContact O-N 3.12Å
523	K	85.2	Confident	72.3	Confident	81 Å²	81	64.6 Å²	64.6	35%	0.352	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	128.7	176.1	-68	-178.2	178.8	-172.2	0	111	D501 H502 C503 C517	D501-K523 HydrophobicContact CB-CB 4.01Å; D501-K523 HydrophobicContact CB-CG 4.49Å; D501-K523 WeakPolarHBondContact OD1-CB 3.42Å; D501-K523 WeakPolarHBondContact OD1-CG 3.09Å; D501-K523 PolarHBondContact OD1-N 3.23Å; H502-K523 PolarHBondContact N-O 3.05Å; C503-K523 WeakPolarHBondContact O-CB 3.31Å; C503-K523 WeakPolarHBondContact O-CD 3.45Å; C517-K523 WeakPolarHBondContact O-CA 3.15Å
524	R	86.1	Confident	71	Confident	82 Å²	82	63 Å²	63	31%	0.309	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	148.4	-178.7	-65.8	-85.3	-150	-77.4	2.5	110.1	H502 C503 C517 T519 S521 G522 L526	H502-R524 PolarHBondContact CD2-NH1 3Å; C503-R524 VanDerWaalsContact SG-C 3.55Å; C517-R524 PolarHBondContact N-O 3.37Å; C517-R524 PolarHBondContact O-N 3.38Å; T519-R524 HydrophobicContact CG2-CB 3.83Å; T519-R524 HydrophobicContact CG2-CG 3.89Å; S521-R524 PolarHBondContact O-NH1 3.09Å; G522-R524 PolarHBondContact O-N 3.12Å; R524-L526 PolarHBondContact O-N 3.08Å; R524-L526 VanDerWaalsContact O-N 3.15Å
525	C	87.4	Confident	68.9	Low	32 Å²	32	70.1 Å²	70.1	22%	0.216	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	101.4	171.9	-63	0	0	0	0	111.7	C509 R514 K515	C509-C525 WeakPolarHBondContact CA-SG 3.46Å; C509-C525 HydrophobicContact CB-CB 3.69Å; C509-C525 WeakPolarHBondContact CB-SG 3.49Å; C509-C525 WeakPolarHBondContact SG-CA 3.03Å; C509-C525 WeakPolarHBondContact SG-CB 3.3Å; C509-C525 CovalentContact SG-SG 2.02Å; C509-C525 PolarHBondContact SG-SG 3.46Å; R514-C525 HydrophobicContact CB-CB 4.14Å; K515-C525 CarbonylContact O-C 3.55Å; K515-C525 VanDerWaalsContact O-CA 3.29Å; K515-C525 WeakPolarHBondContact O-CA 3.45Å
526	L	83.9	Confident	66.7	Low	46 Å²	46	72.1 Å²	72.1	24%	0.241	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	152	179	-63	-175.1	0	0	0	111.8	P488 R514 K515 C517 T519 R524	P488-L526 HydrophobicContact CG-CB 4.35Å; P488-L526 HydrophobicContact CG-CD1 3.85Å; R514-L526 CarbonylContact C-O 3.52Å; R514-L526 WeakPolarHBondContact CA-O 3.21Å; K515-L526 PolarHBondContact N-O 2.91Å; K515-L526 PolarHBondContact O-N 3.37Å; C517-L526 HydrophobicContact CB-CB 3.91Å; C517-L526 HydrophobicContact CB-CD1 3.7Å; C517-L526 HydrophobicContact CB-CG 3.9Å; T519-L526 HydrophobicContact CG2-CD1 3.77Å; T519-L526 HydrophobicContact CG2-CG 4.29Å; R524-L526 PolarHBondContact O-N 3.08Å; R524-L526 VanDerWaalsContact O-N 3.15Å
527	F	79.7	Confident	64.2	Low	114 Å²	114	78 Å²	78	50%	0.5	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	136.9	172.6	-66.3	-77.9	0	0	0	111.5	P488 R513 R514	P488-F527 WeakPolarHBondContact CD-O 3.11Å; R513-F527 HydrophobicContact CB-CD1 3.91Å; R513-F527 HydrophobicContact CB-CE1 4.02Å; R513-F527 WeakPolarHBondContact O-CA 3.4Å; R514-F527 HydrophobicContact CG-CD1 4.05Å; R514-F527 HydrophobicContact CG-CE1 4.03Å; R514-F527 HydrophobicContact CG-CG 4.46Å; R514-F527 HydrophobicContact CG-CZ 4.43Å
528	H	68.5	Low	62.1	Low	23 Å²	23	85.9 Å²	85.9	11%	0.106	46%	0.464	C	S	.	.			trans	-81.8	143.6	180	60.5	75.4	0	0	0	112.3	S484 Q486 R513 K515 G530 V531	S484-H528 PolarHBondContact O-CD2 2.91Å; S484-H528 PolarHBondContact O-CE1 2.73Å; S484-H528 PolarHBondContact O-ND1 3.13Å; S484-H528 PolarHBondContact O-NE2 3.03Å; S484-H528 VanDerWaalsContact O-NE2 3.07Å; Q486-H528 CarbonylContact O-C 3.59Å; Q486-H528 WeakPolarHBondContact O-CA 3.28Å; R513-H528 PolarHBondContact O-CD2 2.92Å; R513-H528 PolarHBondContact O-N 2.86Å; K515-H528 HydrophobicContact CD-CB 3.71Å; K515-H528 HydrophobicContact CG-CB 3.99Å; H528-G530 PolarHBondContact O-N 3.28Å; H528-V531 WeakPolarHBondContact CE1-CG2 3.2Å; H528-V531 PolarHBondContact ND1-N 3.14Å
529	T	59.8	Low	60.6	Low	94 Å²	94	87.3 Å²	87.3	58%	0.577	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	11.2	179.7	52.3	0	0	0	0	114.2	Q486 P488	Q486-T529 VanDerWaalsContact CB-OG1 3.28Å; Q486-T529 WeakPolarHBondContact CB-OG1 2.97Å; Q486-T529 PolarHBondContact O-N 2.79Å; Q486-T529 PolarHBondContact O-OG1 3.32Å; P488-T529 HydrophobicContact CB-CG2 3.91Å
530	G	51.8	Low	59.8	Low	31 Å²	31	89.8 Å²	89.8	32%	0.32	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	17.3	176.9	0	0	0	0	0	115.8	H528 S532	H528-G530 PolarHBondContact O-N 3.28Å; G530-S532 VanDerWaalsContact C-N 3.31Å; G530-S532 PolarHBondContact O-N 3.23Å
531	V	46.9	Very low	59.5	Low	99 Å²	99	90.7 Å²	90.7	60%	0.6	48%	0.477	S	S	*	.			trans	-82.9	82.5	165.3	-171.3	0	0	0	0	107.9	H528	H528-V531 WeakPolarHBondContact CE1-CG2 3.2Å; H528-V531 PolarHBondContact ND1-N 3.14Å
532	S	36.1	Very low	59.5	Low	87 Å²	87	88.1 Å²	88.1	61%	0.608	46%	0.458	S	S	*	.			trans	-113	110.2	158.7	54.6	0	0	0	0	107.8	G530	G530-S532 VanDerWaalsContact C-N 3.31Å; G530-S532 PolarHBondContact O-N 3.23Å
533	D	36.7	Very low	59.1	Low	110 Å²	110	96.5 Å²	96.5	59%	0.588	49%	0.494	S	S	*	.	S	Bend	trans	56.3	72.3	144.8	-52.2	-16.7	0	0	0	120.1	R547	D533-R547 IonicContact OD1-NH1 2.72Å; D533-R547 IonicContact OD2-NH1 3.89Å; D533-R547 PolarHBondContact OD2-NH1 2.98Å; D533-R547 VanDerWaalsContact OD2-NH1 3.15Å
534	I	43.4	Very low	58.3	Low	113 Å²	113	94.4 Å²	94.4	58%	0.579	49%	0.487	S	S	*	.	S	Bend	trans	-144.5	35.4	160.3	-35.5	175.1	0	0	0	114.5
535	Y	36.1	Very low	57.5	Low	247 Å²	247	92.6 Å²	92.6	97%	0.969	49%	0.493	S	S	*	.			trans	-156.8	82.1	155	-82.8	-74.8	0	0	0	107.3
536	S	35.3	Very low	56.9	Low	67 Å²	67	92.7 Å²	92.7	47%	0.469	49%	0.494	S	S	.	.			trans	-132.2	84.6	168.6	175.6	0	0	0	0	107.5	E539	S536-E539 VanDerWaalsContact OG-CA 3.31Å; S536-E539 WeakPolarHBondContact OG-CA 3.25Å; S536-E539 PolarHBondContact OG-N 3.07Å
537	T	34.3	Very low	56.6	Low	142 Å²	142	97.8 Å²	97.8	87%	0.871	51%	0.51	S	S	*	.	S	Bend	trans	-83.1	109.3	139.3	48.5	0	0	0	0	104.4
538	E	45.4	Very low	56.5	Low	166 Å²	166	94 Å²	94	78%	0.776	50%	0.497	S	S	*	.	S	Bend	trans	82.5	87.4	-175.6	-53.1	-172.3	163.7	0	0	115.3	H540	E538-H540 PolarHBondContact O-N 3.23Å
539	E	50.2	Low	57.2	Low	105 Å²	105	95.6 Å²	95.6	49%	0.491	51%	0.514	S	S	.	.			trans	-68.2	94.7	168.3	-124.1	-179.4	177.5	0	0	107.4	S536 M541 R547	S536-E539 VanDerWaalsContact OG-CA 3.31Å; S536-E539 WeakPolarHBondContact OG-CA 3.25Å; S536-E539 PolarHBondContact OG-N 3.07Å; E539-M541 VanDerWaalsContact C-N 3.35Å; E539-M541 PolarHBondContact O-N 2.88Å; E539-R547 IonicContact OE1-CZ 2.75Å; E539-R547 VanDerWaalsContact OE1-CZ 3.25Å; E539-R547 IonicContact OE1-NH1 3.85Å; E539-R547 PolarHBondContact OE1-NH1 2.91Å; E539-R547 IonicContact OE1-NH2 3.15Å; E539-R547 PolarHBondContact OE1-NH2 3.5Å; E539-R547 IonicContact OE2-NH2 3.25Å
540	H	62.5	Low	58.2	Low	79 Å²	79	92.6 Å²	92.6	37%	0.366	50%	0.502	S	S	.	.			trans	-62	101.2	168.1	-105.1	-57.4	0	0	0	108.2	E538 P548 D565 Y567	E538-H540 PolarHBondContact O-N 3.23Å; H540-P548 VanDerWaalsContact O-CD 3.25Å; H540-P548 WeakPolarHBondContact O-CD 3.49Å; H540-P548 WeakPolarHBondContact O-CG 3.37Å; H540-D565 IonicContact CE1-OD2 3.56Å; H540-Y567 HydrophobicContact CB-CD2 3.71Å; H540-Y567 HydrophobicContact CB-CE2 3.61Å; H540-Y567 HydrophobicContact CB-CG 4.26Å; H540-Y567 AromaticContact CD2-CD2 3.93Å; H540-Y567 AromaticContact CD2-CE2 3.31Å; H540-Y567 WeakPolarHBondContact CD2-CE2 3.33Å; H540-Y567 AromaticContact CG-CD2 3.93Å; H540-Y567 AromaticContact CG-CE2 3.69Å
541	M	69.5	Low	59.6	Low	121 Å²	121	94.3 Å²	94.3	60%	0.596	51%	0.513	S	S	*	.			trans	-77.9	140	164.1	-63.9	-150.8	-68.1	0	0	108	E539	E539-M541 VanDerWaalsContact C-N 3.35Å; E539-M541 PolarHBondContact O-N 2.88Å
542	C	73.9	Confident	61.3	Low	6 Å²	6	90.2 Å²	90.2	4%	0.041	49%	0.489	C	S	.	.			trans	-56.2	156.8	165.9	-63	0	0	0	0	109.2	D544 G545 S546 C569	C542-D544 WeakPolarHBondContact CB-OD1 3.39Å; C542-D544 PolarHBondContact O-N 2.98Å; C542-G545 PolarHBondContact O-N 3.03Å; C542-S546 WeakPolarHBondContact CB-O 3.35Å; C542-S546 WeakPolarHBondContact CB-OG 3.28Å; C542-S546 PolarHBondContact N-O 2.8Å; C542-S546 PolarHBondContact SG-O 2.75Å; C542-C569 WeakPolarHBondContact CA-SG 3.42Å; C542-C569 HydrophobicContact CB-CB 3.66Å; C542-C569 WeakPolarHBondContact CB-SG 2.97Å; C542-C569 WeakPolarHBondContact SG-CA 3.39Å; C542-C569 WeakPolarHBondContact SG-CB 3.49Å; C542-C569 CovalentContact SG-SG 2.02Å; C542-C569 PolarHBondContact SG-SG 3.06Å
543	F	69.3	Low	63.3	Low	181 Å²	181	96.6 Å²	96.6	79%	0.794	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-20.6	-177.8	-154.1	-87.9	0	0	0	113.2	E564	F543-E564 WeakPolarHBondContact CB-OE1 3.18Å
544	D	68.1	Low	65.3	Low	38 Å²	38	99.3 Å²	99.3	20%	0.203	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.3	176.3	69.1	-10.5	0	0	0	115.8	C542 S546 R572	C542-D544 WeakPolarHBondContact CB-OD1 3.39Å; C542-D544 PolarHBondContact O-N 2.98Å; D544-S546 VanDerWaalsContact CG-OG 3.23Å; D544-S546 WeakPolarHBondContact OD1-CA 3.5Å; D544-S546 WeakPolarHBondContact OD1-CB 3.23Å; D544-S546 PolarHBondContact OD1-N 2.89Å; D544-S546 PolarHBondContact OD1-OG 3.36Å; D544-S546 PolarHBondContact OD2-OG 3.43Å; D544-R572 HydrophobicContact CB-CG 3.53Å
545	G	68.5	Low	66.7	Low	43 Å²	43	100.1 Å²	100.1	44%	0.443	52%	0.519	S	S	.	.	S	Bend	trans	77.8	3.3	-173	0	0	0	0	0	113.6	C542	C542-G545 PolarHBondContact O-N 3.03Å
546	S	75.4	Confident	68.7	Low	34 Å²	34	93.4 Å²	93.4	24%	0.238	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-77.2	150	175.2	74.1	0	0	0	0	111	C542 D544	C542-S546 WeakPolarHBondContact CB-O 3.35Å; C542-S546 WeakPolarHBondContact CB-OG 3.28Å; C542-S546 PolarHBondContact N-O 2.8Å; C542-S546 PolarHBondContact SG-O 2.75Å; D544-S546 VanDerWaalsContact CG-OG 3.23Å; D544-S546 WeakPolarHBondContact OD1-CA 3.5Å; D544-S546 WeakPolarHBondContact OD1-CB 3.23Å; D544-S546 PolarHBondContact OD1-N 2.89Å; D544-S546 PolarHBondContact OD1-OG 3.36Å; D544-S546 PolarHBondContact OD2-OG 3.43Å
547	R	76.7	Confident	70.9	Confident	153 Å²	153	91.7 Å²	91.7	58%	0.577	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-72.4	130.4	172.2	-72.3	-178.6	171.3	-121.4	-15.7	109	D533 E539	D533-R547 IonicContact OD1-NH1 2.72Å; D533-R547 IonicContact OD2-NH1 3.89Å; D533-R547 PolarHBondContact OD2-NH1 2.98Å; D533-R547 VanDerWaalsContact OD2-NH1 3.15Å; E539-R547 IonicContact OE1-CZ 2.75Å; E539-R547 VanDerWaalsContact OE1-CZ 3.25Å; E539-R547 IonicContact OE1-NH1 3.85Å; E539-R547 PolarHBondContact OE1-NH1 2.91Å; E539-R547 IonicContact OE1-NH2 3.15Å; E539-R547 PolarHBondContact OE1-NH2 3.5Å; E539-R547 IonicContact OE2-NH2 3.25Å
548	P	78.5	Confident	73.1	Confident	35 Å²	35	88.5 Å²	88.5	23%	0.227	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-64.5	146.9	176.1	25.3	-32.6	0	0	0	111.5	H540 G550 Y567 C568	H540-P548 VanDerWaalsContact O-CD 3.25Å; H540-P548 WeakPolarHBondContact O-CD 3.49Å; H540-P548 WeakPolarHBondContact O-CG 3.37Å; P548-G550 PolarHBondContact O-N 3.13Å; P548-Y567 HydrophobicContact CB-CD1 4.2Å; P548-Y567 HydrophobicContact CB-CG 4.28Å; P548-Y567 HydrophobicContact CG-CD1 3.87Å; P548-Y567 HydrophobicContact CG-CG 4.18Å; P548-C568 CarbonylContact C-O 3.48Å; P548-C568 WeakPolarHBondContact CA-O 3.02Å
549	A	82.5	Confident	74.4	Confident	56 Å²	56	86.5 Å²	86.5	46%	0.463	48%	0.477	S	S	.	.	S	Bend	trans	-69.8	-9.8	176.8	0	0	0	0	0	114.1	Y561 C568	A549-Y561 HydrophobicContact CB-CD1 3.52Å; A549-Y561 HydrophobicContact CB-CD2 4.44Å; A549-Y561 HydrophobicContact CB-CE1 3.39Å; A549-Y561 HydrophobicContact CB-CE2 4.32Å; A549-Y561 HydrophobicContact CB-CG 4.09Å; A549-C568 HydrophobicContact CB-CB 4.18Å; A549-C568 PolarHBondContact N-O 2.72Å
550	G	81.2	Confident	75.4	Confident	31 Å²	31	84.1 Å²	84.1	32%	0.32	48%	0.481	S	S	.	.	S	Bend	trans	151.9	175.3	179.4	0	0	0	0	0	111.3	P548 Y567 C568	P548-G550 PolarHBondContact O-N 3.13Å; G550-Y567 CarbonylContact O-C 2.9Å; G550-Y567 WeakPolarHBondContact O-CA 3.33Å; G550-C568 PolarHBondContact O-N 3.17Å
551	A	80.8	Confident	76.3	Confident	67 Å²	67	84.3 Å²	84.3	55%	0.554	48%	0.479	S	S	*	.	B	Isolated β-bridge	trans	-75.5	136.2	172.3	0	0	0	0	0	110.5	G566	A551-G566 CarbonylContact C-O 3.45Å; A551-G566 WeakPolarHBondContact CA-O 3.29Å
552	C	82.1	Confident	76.9	Confident	14 Å²	14	82.3 Å²	82.3	10%	0.095	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-93	128.8	169.7	33.9	0	0	0	0	110.4	V556 C563 G566 Y567	C552-V556 WeakPolarHBondContact CB-O 3.19Å; C552-C563 HydrophobicContact CB-CB 3.73Å; C552-C563 WeakPolarHBondContact CB-SG 3.38Å; C552-C563 WeakPolarHBondContact SG-CA 3.37Å; C552-C563 WeakPolarHBondContact SG-CB 3.38Å; C552-C563 CovalentContact SG-SG 2.01Å; C552-C563 PolarHBondContact SG-SG 3.15Å; C552-G566 PolarHBondContact N-O 2.54Å; C552-G566 PolarHBondContact SG-O 2.83Å; C552-G566 VanDerWaalsContact SG-O 3.41Å; C552-Y567 PolarHBondContact SG-N 2.96Å
553	R	78.8	Confident	77.4	Confident	221 Å²	221	83.6 Å²	83.6	83%	0.834	47%	0.473	S	S	*	.	S	Bend	trans	-99.7	137.1	159.6	-87.7	-171.5	166.4	173.3	-3.2	108.4	N555 V556	R553-N555 VanDerWaalsContact C-N 3.26Å; R553-N555 PolarHBondContact O-N 3Å; R553-V556 PolarHBondContact O-N 3.48Å
554	L	78.4	Confident	77.9	Confident	167 Å²	167	77.3 Å²	77.3	87%	0.874	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	33.2	177.4	-56.3	167.6	0	0	0	113.8	V556	L554-V556 HydrophobicContact CB-CG2 4.33Å; L554-V556 PolarHBondContact O-N 2.85Å; L554-V556 VanDerWaalsContact O-N 3.16Å
555	N	72.5	Confident	78.4	Confident	130 Å²	130	81.5 Å²	81.5	70%	0.695	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	20.3	-177	-62.8	-41.6	0	0	0	115.3	R553 C563	R553-N555 VanDerWaalsContact C-N 3.26Å; R553-N555 PolarHBondContact O-N 3Å; N555-C563 HydrophobicContact CB-CB 4.19Å; N555-C563 PolarHBondContact OD1-SG 3.37Å
556	V	78.9	Confident	79	Confident	105 Å²	105	81 Å²	81	64%	0.636	46%	0.464	S	S	*	.			trans	-90.1	120.7	179.3	-174.7	0	0	0	0	110	C552 R553 L554	C552-V556 WeakPolarHBondContact CB-O 3.19Å; R553-V556 PolarHBondContact O-N 3.48Å; L554-V556 HydrophobicContact CB-CG2 4.33Å; L554-V556 PolarHBondContact O-N 2.85Å; L554-V556 VanDerWaalsContact O-N 3.16Å
557	C	82.2	Confident	79.5	Confident	32 Å²	32	83.2 Å²	83.2	22%	0.216	47%	0.467	C	S	.	.			trans	-131.2	157.6	176.5	-72.6	0	0	0	0	111.9	C568	C557-C568 WeakPolarHBondContact CA-SG 3.32Å; C557-C568 HydrophobicContact CB-CB 3.83Å; C557-C568 WeakPolarHBondContact CB-SG 3.37Å; C557-C568 WeakPolarHBondContact SG-CA 3.29Å; C557-C568 WeakPolarHBondContact SG-CB 3.48Å; C557-C568 CovalentContact SG-SG 2.04Å; C557-C568 PolarHBondContact SG-SG 2.84Å
558	P	79.4	Confident	80	Confident	75 Å²	75	76.1 Å²	76.1	49%	0.487	44%	0.441	S	S	.	.			trans	-58.3	155.3	171.3	-18.1	29.9	0	0	0	111.7	G560 Y561	P558-G560 PolarHBondContact O-N 3.07Å; P558-Y561 HydrophobicContact CB-CD2 4.13Å; P558-Y561 PolarHBondContact O-N 3.07Å; P558-Y561 VanDerWaalsContact O-N 3.07Å
559	S	72.2	Confident	80.3	Confident	124 Å²	124	74.5 Å²	74.5	87%	0.867	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	126.8	176.8	-55.5	0	0	0	0	111.5
560	G	71.2	Confident	80.1	Confident	55 Å²	55	78.7 Å²	78.7	57%	0.567	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	-1.1	-177.5	0	0	0	0	0	115.6	P558 R571	P558-G560 PolarHBondContact O-N 3.07Å; G560-R571 PolarHBondContact O-N 3.25Å
561	Y	82.8	Confident	79.1	Confident	82 Å²	82	84.3 Å²	84.3	32%	0.322	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	154.7	178	-63.8	-98.1	0	0	0	111.4	A549 P558 C568 C569 R570	A549-Y561 HydrophobicContact CB-CD1 3.52Å; A549-Y561 HydrophobicContact CB-CD2 4.44Å; A549-Y561 HydrophobicContact CB-CE1 3.39Å; A549-Y561 HydrophobicContact CB-CE2 4.32Å; A549-Y561 HydrophobicContact CB-CG 4.09Å; P558-Y561 HydrophobicContact CB-CD2 4.13Å; P558-Y561 PolarHBondContact O-N 3.07Å; P558-Y561 VanDerWaalsContact O-N 3.07Å; Y561-C568 WeakPolarHBondContact CD1-O 3.4Å; Y561-C569 CarbonylContact C-O 3.57Å; Y561-C569 WeakPolarHBondContact CA-O 3.45Å; Y561-C569 WeakPolarHBondContact CB-O 2.99Å; Y561-R570 HydrophobicContact CD1-CB 3.96Å; Y561-R570 HydrophobicContact CE1-CB 3.64Å; Y561-R570 HydrophobicContact CE1-CG 4.16Å
562	Y	81.5	Confident	77.8	Confident	80 Å²	80	88.8 Å²	88.8	31%	0.314	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	153.2	174.7	67.1	-82.2	0	0	0	110	E564 C568 C569 R571	Y562-E564 HydrophobicContact CD2-CB 4.14Å; Y562-E564 HydrophobicContact CE2-CB 3.66Å; Y562-E564 HydrophobicContact CE2-CG 4.21Å; Y562-E564 WeakPolarHBondContact CE2-OE2 3.36Å; Y562-E564 VanDerWaalsContact CZ-OE2 3.31Å; Y562-E564 PolarHBondContact OH-OE2 3.42Å; Y562-C568 CarbonylContact O-C 3.57Å; Y562-C568 WeakPolarHBondContact O-CA 2.96Å; Y562-C569 HydrophobicContact CD1-CB 4.37Å; Y562-C569 WeakPolarHBondContact CD1-O 3.43Å; Y562-C569 HydrophobicContact CE1-CB 3.8Å; Y562-C569 WeakPolarHBondContact CE1-O 3.45Å; Y562-C569 HydrophobicContact CE2-CB 4.11Å; Y562-C569 PolarHBondContact N-O 3.41Å; Y562-C569 PolarHBondContact O-N 2.95Å; Y562-R571 HydrophobicContact CD1-CG 3.99Å; Y562-R571 HydrophobicContact CE1-CG 4.45Å
563	C	84.1	Confident	75.8	Confident	32 Å²	32	95 Å²	95	22%	0.216	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	118.9	-179.9	-170.5	0	0	0	0	110.2	C552 N555 Y567	C552-C563 HydrophobicContact CB-CB 3.73Å; C552-C563 WeakPolarHBondContact CB-SG 3.38Å; C552-C563 WeakPolarHBondContact SG-CA 3.37Å; C552-C563 WeakPolarHBondContact SG-CB 3.38Å; C552-C563 CovalentContact SG-SG 2.01Å; C552-C563 PolarHBondContact SG-SG 3.15Å; N555-C563 HydrophobicContact CB-CB 4.19Å; N555-C563 PolarHBondContact OD1-SG 3.37Å; C563-Y567 CarbonylContact C-O 3.42Å; C563-Y567 WeakPolarHBondContact CA-O 3Å
564	E	80.7	Confident	73.7	Confident	49 Å²	49	87.8 Å²	87.8	23%	0.229	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120.7	178.3	-174.1	166	-154.1	0	0	108.2	F543 Y562 G566 Y567 C569	F543-E564 WeakPolarHBondContact CB-OE1 3.18Å; Y562-E564 HydrophobicContact CD2-CB 4.14Å; Y562-E564 HydrophobicContact CE2-CB 3.66Å; Y562-E564 HydrophobicContact CE2-CG 4.21Å; Y562-E564 WeakPolarHBondContact CE2-OE2 3.36Å; Y562-E564 VanDerWaalsContact CZ-OE2 3.31Å; Y562-E564 PolarHBondContact OH-OE2 3.42Å; E564-G566 PolarHBondContact O-N 3.14Å; E564-Y567 PolarHBondContact N-O 2.02Å; E564-Y567 WeakPolarHBondContact O-CA 3.01Å; E564-Y567 WeakPolarHBondContact O-CB 3.29Å; E564-Y567 PolarHBondContact O-N 2.99Å; E564-C569 HydrophobicContact CB-CB 4.24Å
565	D	77.5	Confident	71.5	Confident	126 Å²	126	88.8 Å²	88.8	67%	0.674	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	34.2	-176.7	-69.3	-18.8	0	0	0	115.2	H540 Y567	H540-D565 IonicContact CE1-OD2 3.56Å; D565-Y567 WeakPolarHBondContact O-CD2 3.47Å; D565-Y567 WeakPolarHBondContact O-CE2 3.04Å
566	G	82.2	Confident	69.6	Low	32 Å²	32	89.3 Å²	89.3	33%	0.33	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	11.3	-177.9	0	0	0	0	0	114.4	A551 C552 E564	A551-G566 CarbonylContact C-O 3.45Å; A551-G566 WeakPolarHBondContact CA-O 3.29Å; C552-G566 PolarHBondContact N-O 2.54Å; C552-G566 PolarHBondContact SG-O 2.83Å; C552-G566 VanDerWaalsContact SG-O 3.41Å; E564-G566 PolarHBondContact O-N 3.14Å
567	Y	86.2	Confident	67.3	Low	81 Å²	81	87.4 Å²	87.4	32%	0.318	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	141.9	178.1	-63.5	-87.8	0	0	0	113.3	H540 P548 G550 C552 C563 E564 D565 C569	H540-Y567 HydrophobicContact CB-CD2 3.71Å; H540-Y567 HydrophobicContact CB-CE2 3.61Å; H540-Y567 HydrophobicContact CB-CG 4.26Å; H540-Y567 AromaticContact CD2-CD2 3.93Å; H540-Y567 AromaticContact CD2-CE2 3.31Å; H540-Y567 WeakPolarHBondContact CD2-CE2 3.33Å; H540-Y567 AromaticContact CG-CD2 3.93Å; H540-Y567 AromaticContact CG-CE2 3.69Å; P548-Y567 HydrophobicContact CB-CD1 4.2Å; P548-Y567 HydrophobicContact CB-CG 4.28Å; P548-Y567 HydrophobicContact CG-CD1 3.87Å; P548-Y567 HydrophobicContact CG-CG 4.18Å; G550-Y567 CarbonylContact O-C 2.9Å; G550-Y567 WeakPolarHBondContact O-CA 3.33Å; C552-Y567 PolarHBondContact SG-N 2.96Å; C563-Y567 CarbonylContact C-O 3.42Å; C563-Y567 WeakPolarHBondContact CA-O 3Å; E564-Y567 PolarHBondContact N-O 2.02Å; E564-Y567 WeakPolarHBondContact O-CA 3.01Å; E564-Y567 WeakPolarHBondContact O-CB 3.29Å; E564-Y567 PolarHBondContact O-N 2.99Å; D565-Y567 WeakPolarHBondContact O-CD2 3.47Å; D565-Y567 WeakPolarHBondContact O-CE2 3.04Å; Y567-C569 PolarHBondContact O-N 3.16Å
568	C	86.3	Confident	65.1	Low	4 Å²	4	91.5 Å²	91.5	3%	0.027	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	98.5	178.6	-70.5	0	0	0	0	111.1	P548 A549 G550 C557 Y561 Y562	P548-C568 CarbonylContact C-O 3.48Å; P548-C568 WeakPolarHBondContact CA-O 3.02Å; A549-C568 HydrophobicContact CB-CB 4.18Å; A549-C568 PolarHBondContact N-O 2.72Å; G550-C568 PolarHBondContact O-N 3.17Å; C557-C568 WeakPolarHBondContact CA-SG 3.32Å; C557-C568 HydrophobicContact CB-CB 3.83Å; C557-C568 WeakPolarHBondContact CB-SG 3.37Å; C557-C568 WeakPolarHBondContact SG-CA 3.29Å; C557-C568 WeakPolarHBondContact SG-CB 3.48Å; C557-C568 CovalentContact SG-SG 2.04Å; C557-C568 PolarHBondContact SG-SG 2.84Å; Y561-C568 WeakPolarHBondContact CD1-O 3.4Å; Y562-C568 CarbonylContact O-C 3.57Å; Y562-C568 WeakPolarHBondContact O-CA 2.96Å
569	C	85	Confident	62.7	Low	2 Å²	2	98.3 Å²	98.3	1%	0.014	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	140	-179.6	-71.7	0	0	0	0	112.2	C542 Y561 Y562 E564 Y567 R571	C542-C569 WeakPolarHBondContact CA-SG 3.42Å; C542-C569 HydrophobicContact CB-CB 3.66Å; C542-C569 WeakPolarHBondContact CB-SG 2.97Å; C542-C569 WeakPolarHBondContact SG-CA 3.39Å; C542-C569 WeakPolarHBondContact SG-CB 3.49Å; C542-C569 CovalentContact SG-SG 2.02Å; C542-C569 PolarHBondContact SG-SG 3.06Å; Y561-C569 CarbonylContact C-O 3.57Å; Y561-C569 WeakPolarHBondContact CA-O 3.45Å; Y561-C569 WeakPolarHBondContact CB-O 2.99Å; Y562-C569 HydrophobicContact CD1-CB 4.37Å; Y562-C569 WeakPolarHBondContact CD1-O 3.43Å; Y562-C569 HydrophobicContact CE1-CB 3.8Å; Y562-C569 WeakPolarHBondContact CE1-O 3.45Å; Y562-C569 HydrophobicContact CE2-CB 4.11Å; Y562-C569 PolarHBondContact N-O 3.41Å; Y562-C569 PolarHBondContact O-N 2.95Å; E564-C569 HydrophobicContact CB-CB 4.24Å; Y567-C569 PolarHBondContact O-N 3.16Å; C569-R571 PolarHBondContact O-N 3.05Å
570	R	78.2	Confident	61	Low	143 Å²	143	100.7 Å²	100.7	54%	0.54	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	133	178.2	-169.5	170.8	177	165.4	-2.5	106.9	Y561 R572	Y561-R570 HydrophobicContact CD1-CB 3.96Å; Y561-R570 HydrophobicContact CE1-CB 3.64Å; Y561-R570 HydrophobicContact CE1-CG 4.16Å; R570-R572 PolarHBondContact O-N 3.15Å
571	R	61.1	Low	59.4	Low	150 Å²	150	100.7 Å²	100.7	57%	0.566	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-52.6	121.2	169.9	-95.3	-170.1	-179.3	175.2	1	108.2	G560 Y562 C569 Q573	G560-R571 PolarHBondContact O-N 3.25Å; Y562-R571 HydrophobicContact CD1-CG 3.99Å; Y562-R571 HydrophobicContact CE1-CG 4.45Å; C569-R571 PolarHBondContact O-N 3.05Å; R571-Q573 PolarHBondContact O-N 3.43Å
572	R	52.3	Low	57.7	Low	161 Å²	161	100.2 Å²	100.2	61%	0.608	48%	0.484	S	S	*	.			trans	-49.7	110.1	164	-113.8	-175.1	178.6	-178.5	10.6	106.8	D544 R570 S574	D544-R572 HydrophobicContact CB-CG 3.53Å; R570-R572 PolarHBondContact O-N 3.15Å; R572-S574 PolarHBondContact O-N 2.04Å
573	Q	41.5	Very low	56.9	Low	143 Å²	143	99.7 Å²	99.7	67%	0.668	48%	0.484	S	S	*	.			trans	-66.5	80.5	141.8	-75.4	177.8	-0.4	0	0	105.1	R571 Y575	R571-Q573 PolarHBondContact O-N 3.43Å; Q573-Y575 HydrophobicContact CB-CD2 4.39Å; Q573-Y575 PolarHBondContact O-N 3.05Å
574	S	33.8	Very low	55.9	Low	71 Å²	71	100.3 Å²	100.3	50%	0.497	49%	0.488	S	S	.	.			trans	-59.9	99.4	133.8	56.6	0	0	0	0	104.4	R572 D576	R572-S574 PolarHBondContact O-N 2.04Å; S574-D576 PolarHBondContact O-N 2.83Å; S574-D576 VanDerWaalsContact O-N 3.16Å
575	Y	33	Very low	55.3	Low	188 Å²	188	100.1 Å²	100.1	74%	0.737	49%	0.492	S	S	*	.	S	Bend	trans	-41.5	119.4	139.8	-86	-102.7	0	0	0	105.7	Q573	Q573-Y575 HydrophobicContact CB-CD2 4.39Å; Q573-Y575 PolarHBondContact O-N 3.05Å
576	D	31	Very low	54.3	Low	141 Å²	141	98.1 Å²	98.1	75%	0.754	49%	0.487	S	S	*	.	S	Bend	trans	81.5	61.9	171.6	-48.6	-39.1	0	0	0	119.6	S574	S574-D576 PolarHBondContact O-N 2.83Å; S574-D576 VanDerWaalsContact O-N 3.16Å
577	A	31.2	Very low	53	Low	65 Å²	65	102.8 Å²	102.8	54%	0.537	50%	0.504	S	S	.	.	S	Bend	trans	-157.9	15.6	153	0	0	0	0	0	117.5
578	V	36	Very low	51.3	Low	117 Å²	117	106.7 Å²	106.7	71%	0.709	53%	0.531	S	S	*	.	S	Bend	trans	-138.7	45.8	151.4	-162.6	0	0	0	0	109.5
579	R	30.3	Very low	49.5	Very low	218 Å²	218	115.1 Å²	115.1	82%	0.823	57%	0.567	S	S	*	*	S	Bend	trans	-87.9	6.9	139.4	-101.6	-168.1	-171.3	-163.8	4.6	111.7
580	H	34.9	Very low	47.7	Very low	174 Å²	174	116.7 Å²	116.7	81%	0.806	58%	0.575	S	S	*	*	S	Bend	trans	-109.5	49.1	168.3	-79.1	-74.3	0	0	0	111.7
581	N	37.6	Very low	46.2	Very low	56 Å²	56	119.3 Å²	119.3	30%	0.299	59%	0.59	S	S	.	*				-137.9	112.5	120.4	-132.2	13.9	0	0	0	103.2	Q583 V610	N581-Q583 HydrophobicContact CB-CB 4.37Å; N581-Q583 PolarHBondContact O-N 3.15Å; N581-Q583 PolarHBondContact OD1-OE1 2.74Å; N581-V610 VanDerWaalsContact ND2-CG1 3.3Å; N581-V610 WeakPolarHBondContact ND2-CG1 3.45Å
582	S	48.7	Very low	45.5	Very low	71 Å²	71	119.3 Å²	119.3	50%	0.497	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.1	31	178	-37.7	0	0	0	0	111.9
583	Q	63.5	Low	45.3	Very low	69 Å²	69	113.1 Å²	113.1	32%	0.322	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-131.7	-20.2	-160.7	-88.1	95.7	5.6	0	0	113.4	N581 P585 V610 A623 E624	N581-Q583 HydrophobicContact CB-CB 4.37Å; N581-Q583 PolarHBondContact O-N 3.15Å; N581-Q583 PolarHBondContact OD1-OE1 2.74Å; Q583-P585 WeakPolarHBondContact O-CD 3.33Å; Q583-V610 HydrophobicContact CB-CG1 4.17Å; Q583-V610 HydrophobicContact CB-CG2 4.01Å; Q583-A623 HydrophobicContact CB-CB 3.71Å; Q583-A623 HydrophobicContact CG-CB 3.24Å; Q583-A623 CarbonylContact O-C 3.55Å; Q583-A623 WeakPolarHBondContact O-CA 3.32Å; Q583-E624 PolarHBondContact O-N 2.77Å
584	C	64.3	Low	45.6	Very low	45 Å²	45	115.9 Å²	115.9	30%	0.304	59%	0.593	S	S	.	*	S	Bend	trans	-78.9	121.6	176.3	-74.4	0	0	0	0	110.9	C612	C584-C612 VanDerWaalsContact CA-SG 3.51Å; C584-C612 HydrophobicContact CB-CB 4Å; C584-C612 WeakPolarHBondContact CB-SG 3.48Å; C584-C612 WeakPolarHBondContact SG-CB 3.11Å; C584-C612 CovalentContact SG-SG 2.04Å; C584-C612 PolarHBondContact SG-SG 3.24Å
585	P	66.1	Low	46.8	Very low	46 Å²	46	117.5 Å²	117.5	30%	0.299	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-68.2	150	-179.8	26.9	-33.2	0	0	0	112.6	Q583 V621 E624	Q583-P585 WeakPolarHBondContact O-CD 3.33Å; P585-V621 HydrophobicContact CG-CG2 4.17Å; P585-E624 WeakPolarHBondContact CA-OE1 2.98Å; P585-E624 HydrophobicContact CB-CG 4.16Å
586	S	58.4	Low	48.2	Very low	83 Å²	83	112.3 Å²	112.3	58%	0.58	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-63.2	141.8	-177	-80.7	0	0	0	0	113.5	N588 F589 E624	S586-N588 PolarHBondContact O-N 3.23Å; S586-F589 PolarHBondContact O-N 3.07Å; S586-E624 PolarHBondContact N-OE1 2.8Å
587	L	53.5	Low	50.3	Low	130 Å²	130	109 Å²	109	68%	0.681	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-55.2	-3.3	-173.7	-87.5	157.5	0	0	0	116.9	F589 M590	L587-F589 VanDerWaalsContact C-N 3.27Å; L587-F589 PolarHBondContact O-N 2.98Å; L587-M590 HydrophobicContact CD2-CE 3.2Å; L587-M590 HydrophobicContact CG-CE 4.01Å
588	N	50.9	Low	52.7	Low	164 Å²	164	110.4 Å²	110.4	88%	0.877	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-77.5	-9.1	176.9	-76.4	-15	0	0	0	113.8	S586	S586-N588 PolarHBondContact O-N 3.23Å
589	F	48.4	Very low	54.9	Low	181 Å²	181	105.3 Å²	105.3	79%	0.794	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-96.5	-4.6	-177.9	-139.1	-95.9	0	0	0	114.8	S586 L587 K591	S586-F589 PolarHBondContact O-N 3.07Å; L587-F589 VanDerWaalsContact C-N 3.27Å; L587-F589 PolarHBondContact O-N 2.98Å; F589-K591 PolarHBondContact O-N 3.41Å
590	M	47.6	Very low	57.3	Low	35 Å²	35	102.7 Å²	102.7	17%	0.172	55%	0.548	C	S	.	.			trans	-97.2	28.8	-163.3	-72.3	-160.9	-75	0	0	116.8	L587 N592 L593 P613 A614	L587-M590 HydrophobicContact CD2-CE 3.2Å; L587-M590 HydrophobicContact CG-CE 4.01Å; M590-N592 VanDerWaalsContact C-N 3.29Å; M590-N592 PolarHBondContact O-N 2.03Å; M590-L593 HydrophobicContact CB-CD1 4.42Å; M590-L593 HydrophobicContact CG-CD1 4.25Å; M590-P613 WeakPolarHBondContact CE-O 3.39Å; M590-A614 HydrophobicContact CE-CB 4.33Å; M590-A614 HydrophobicContact SD-CB 3.61Å
591	K	47.3	Very low	59.5	Low	198 Å²	198	96.9 Å²	96.9	86%	0.861	53%	0.527	S	S	*	.	S	Bend	trans	-74.7	-9	177.3	-86.3	-177.6	176.4	177.8	0	115.1	F589	F589-K591 PolarHBondContact O-N 3.41Å
592	N	44.9	Very low	61.3	Low	150 Å²	150	98.2 Å²	98.2	80%	0.802	53%	0.534	S	S	*	.	S	Bend	trans	-142.4	55.3	-171	-70.8	-36	0	0	0	114.6	M590	M590-N592 VanDerWaalsContact C-N 3.29Å; M590-N592 PolarHBondContact O-N 2.03Å
593	L	48.5	Very low	62.7	Low	30 Å²	30	99.5 Å²	99.5	16%	0.157	54%	0.543	C	S	.	.			trans	-123	63	-177.4	-79.8	86.8	0	0	0	114	M590 F596 V621	M590-L593 HydrophobicContact CB-CD1 4.42Å; M590-L593 HydrophobicContact CG-CD1 4.25Å; L593-F596 HydrophobicContact CB-CD2 3.75Å; L593-F596 HydrophobicContact CB-CE2 4.26Å; L593-F596 HydrophobicContact CD1-CE2 4.27Å; L593-F596 HydrophobicContact CD2-CB 4.17Å; L593-F596 HydrophobicContact CD2-CD1 4.14Å; L593-F596 HydrophobicContact CD2-CD2 2.99Å; L593-F596 HydrophobicContact CD2-CE1 4.26Å; L593-F596 HydrophobicContact CD2-CE2 3.17Å; L593-F596 HydrophobicContact CD2-CG 3.49Å; L593-F596 VanDerWaalsContact CD2-CG 3.49Å; L593-F596 HydrophobicContact CD2-CZ 3.79Å; L593-F596 HydrophobicContact CG-CD2 3.21Å; L593-F596 HydrophobicContact CG-CE2 3.27Å; L593-F596 HydrophobicContact CG-CG 4.18Å; L593-F596 HydrophobicContact CG-CZ 4.26Å; L593-V621 HydrophobicContact CD2-CG1 4.39Å
594	E	49	Very low	63.3	Low	201 Å²	201	99.9 Å²	99.9	94%	0.939	55%	0.547	S	S	*	.	S	Bend	trans	-75	-10.2	158.7	-70.7	-170.4	150.4	0	0	112.2
595	S	58.5	Low	64	Low	106 Å²	106	98.5 Å²	98.5	74%	0.741	54%	0.538	S	S	*	.	S	Bend	trans	-98.1	-5.1	-168.9	-178.4	0	0	0	0	116.6
596	F	62.9	Low	64.7	Low	78 Å²	78	102.4 Å²	102.4	34%	0.342	56%	0.555	S	S	.	*	S	Bend	trans	-96	140.8	-170.7	-73	-99.2	0	0	0	112.9	L593 K619 C620	L593-F596 HydrophobicContact CB-CD2 3.75Å; L593-F596 HydrophobicContact CB-CE2 4.26Å; L593-F596 HydrophobicContact CD1-CE2 4.27Å; L593-F596 HydrophobicContact CD2-CB 4.17Å; L593-F596 HydrophobicContact CD2-CD1 4.14Å; L593-F596 HydrophobicContact CD2-CD2 2.99Å; L593-F596 HydrophobicContact CD2-CE1 4.26Å; L593-F596 HydrophobicContact CD2-CE2 3.17Å; L593-F596 HydrophobicContact CD2-CG 3.49Å; L593-F596 VanDerWaalsContact CD2-CG 3.49Å; L593-F596 HydrophobicContact CD2-CZ 3.79Å; L593-F596 HydrophobicContact CG-CD2 3.21Å; L593-F596 HydrophobicContact CG-CE2 3.27Å; L593-F596 HydrophobicContact CG-CG 4.18Å; L593-F596 HydrophobicContact CG-CZ 4.26Å; F596-K619 HydrophobicContact CB-CB 3.98Å; F596-K619 HydrophobicContact CB-CD 3.88Å; F596-K619 HydrophobicContact CB-CG 4.21Å; F596-K619 WeakPolarHBondContact O-CD 3.43Å; F596-K619 PolarHBondContact O-NZ 3.38Å; F596-C620 WeakPolarHBondContact CD1-O 3.15Å
597	P	73.6	Confident	65.2	Low	71 Å²	71	105.2 Å²	105.2	46%	0.461	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-59.6	140.1	177.8	-19	29.5	0	0	0	111	K619 C620	P597-K619 CarbonylContact O-C 3.46Å; P597-K619 VanDerWaalsContact O-CA 3.31Å; P597-K619 WeakPolarHBondContact O-CA 2.96Å; P597-C620 HydrophobicContact CB-CB 4.46Å; P597-C620 PolarHBondContact O-N 2.76Å
598	S	82.3	Confident	65.9	Low	96 Å²	96	102.1 Å²	102.1	67%	0.671	56%	0.563	S	S	*	*	B	Isolated β-bridge	trans	-76	141.1	174.3	-43.5	0	0	0	0	108.9	S618	S598-S618 WeakPolarHBondContact CA-O 3.46Å
599	C	82.9	Confident	67.3	Low	10 Å²	10	95.3 Å²	95.3	7%	0.068	53%	0.527	C	S	.	.			trans	-137.3	151.2	179.1	57.2	0	0	0	0	111.3	D604 C611 S618 C620	C599-D604 HydrophobicContact CB-CB 3.98Å; C599-C611 VanDerWaalsContact C-SG 3.55Å; C599-C611 HydrophobicContact CB-CB 3.79Å; C599-C611 WeakPolarHBondContact CB-SG 2.92Å; C599-C611 WeakPolarHBondContact SG-CA 3.37Å; C599-C611 WeakPolarHBondContact SG-CB 3.43Å; C599-C611 CovalentContact SG-SG 2.03Å; C599-C611 PolarHBondContact SG-SG 3.43Å; C599-S618 PolarHBondContact N-O 2.02Å; C599-S618 VanDerWaalsContact N-O 3.13Å; C599-S618 WeakPolarHBondContact O-CB 3.31Å; C599-C620 VanDerWaalsContact CB-SG 3.52Å
600	I	78.8	Confident	68.9	Low	163 Å²	163	87.3 Å²	87.3	84%	0.836	49%	0.493	S	S	*	.	S	Bend	trans	-101.9	-33.7	172.4	-57.6	173.6	0	0	0	108.9	D604	I600-D604 VanDerWaalsContact CA-OD2 3.29Å; I600-D604 WeakPolarHBondContact CA-OD2 3.07Å; I600-D604 VanDerWaalsContact CB-OD2 3.29Å; I600-D604 WeakPolarHBondContact CB-OD2 3.49Å; I600-D604 PolarHBondContact N-OD2 3.48Å
601	S	81.4	Confident	70.7	Confident	52 Å²	52	86.8 Å²	86.8	36%	0.364	49%	0.493	S	S	.	.	S	Bend	trans	-147.6	176.8	173.9	90.2	0	0	0	0	112.6	S603 D604 C611	S601-S603 PolarHBondContact O-N 2.65Å; S601-S603 PolarHBondContact OG-N 3.45Å; S601-S603 PolarHBondContact OG-OG 3.39Å; S601-D604 PolarHBondContact N-OD2 3.3Å; S601-D604 WeakPolarHBondContact O-CB 3.14Å; S601-D604 PolarHBondContact O-N 3.35Å; S601-D604 VanDerWaalsContact O-N 3.1Å; S601-C611 WeakPolarHBondContact O-CB 3.33Å
602	N	76.2	Confident	72.3	Confident	84 Å²	84	77.7 Å²	77.7	45%	0.449	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-60	-22.2	175.5	-69.3	-20.2	0	0	0	113.3	D604 C605 C611	N602-D604 PolarHBondContact O-N 2.9Å; N602-C605 PolarHBondContact O-N 2.96Å; N602-C611 PolarHBondContact OD1-N 3.25Å
603	S	77.1	Confident	73.5	Confident	97 Å²	97	73.6 Å²	73.6	68%	0.678	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-68.8	-20	176.7	63.4	0	0	0	0	113.4	S601 C605	S601-S603 PolarHBondContact O-N 2.65Å; S601-S603 PolarHBondContact OG-N 3.45Å; S601-S603 PolarHBondContact OG-OG 3.39Å; S603-C605 VanDerWaalsContact C-N 3.26Å
604	D	76.9	Confident	74.3	Confident	77 Å²	77	73.1 Å²	73.1	41%	0.412	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-88.3	-3.3	-177.7	-49.1	-32.5	0	0	0	111.6	C599 I600 S601 N602	C599-D604 HydrophobicContact CB-CB 3.98Å; I600-D604 VanDerWaalsContact CA-OD2 3.29Å; I600-D604 WeakPolarHBondContact CA-OD2 3.07Å; I600-D604 VanDerWaalsContact CB-OD2 3.29Å; I600-D604 WeakPolarHBondContact CB-OD2 3.49Å; I600-D604 PolarHBondContact N-OD2 3.48Å; S601-D604 PolarHBondContact N-OD2 3.3Å; S601-D604 WeakPolarHBondContact O-CB 3.14Å; S601-D604 PolarHBondContact O-N 3.35Å; S601-D604 VanDerWaalsContact O-N 3.1Å; N602-D604 PolarHBondContact O-N 2.9Å
605	C	79.5	Confident	74.8	Confident	17 Å²	17	71.3 Å²	71.3	12%	0.115	43%	0.432	C	S	.	.			trans	-103.3	124.8	-176.8	-66.8	0	0	0	0	110.8	N602 S603 T609 C620	N602-C605 PolarHBondContact O-N 2.96Å; S603-C605 VanDerWaalsContact C-N 3.26Å; C605-T609 WeakPolarHBondContact CB-O 3Å; C605-T609 WeakPolarHBondContact CB-OG1 2.93Å; C605-C620 WeakPolarHBondContact CA-SG 3.44Å; C605-C620 HydrophobicContact CB-CB 3.86Å; C605-C620 WeakPolarHBondContact CB-SG 3.13Å; C605-C620 WeakPolarHBondContact SG-CA 3.33Å; C605-C620 WeakPolarHBondContact SG-CB 3.48Å; C605-C620 CovalentContact SG-SG 2.05Å; C605-C620 PolarHBondContact SG-SG 3.39Å
606	I	79.3	Confident	75.1	Confident	128 Å²	128	70 Å²	70	66%	0.656	42%	0.422	S	S	*	.			trans	-91.5	155.8	177	34.6	172.2	0	0	0	110.5	G608 T609	I606-G608 PolarHBondContact O-N 3.2Å; I606-T609 PolarHBondContact O-OG1 3.04Å
607	N	69.8	Low	75.2	Confident	142 Å²	142	68.2 Å²	68.2	76%	0.759	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	39.4	172.7	-57.7	-22.4	0	0	0	115.7	T609	N607-T609 PolarHBondContact O-N 3.21Å
608	G	67.9	Low	75.5	Confident	64 Å²	64	66.9 Å²	66.9	66%	0.66	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	17.9	174.5	0	0	0	0	0	114	I606	I606-G608 PolarHBondContact O-N 3.2Å
609	T	80.3	Confident	75.5	Confident	21 Å²	21	63.2 Å²	63.2	13%	0.129	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	149	169.3	55	0	0	0	0	109.9	C605 I606 N607 V621	C605-T609 WeakPolarHBondContact CB-O 3Å; C605-T609 WeakPolarHBondContact CB-OG1 2.93Å; I606-T609 PolarHBondContact O-OG1 3.04Å; N607-T609 PolarHBondContact O-N 3.21Å; T609-V621 CarbonylContact C-O 3.43Å; T609-V621 VanDerWaalsContact CA-O 3.22Å; T609-V621 WeakPolarHBondContact CA-O 2.82Å; T609-V621 VanDerWaalsContact CB-O 3.3Å; T609-V621 WeakPolarHBondContact CB-O 3.2Å
610	V	81.4	Confident	75.5	Confident	14 Å²	14	63 Å²	63	9%	0.085	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	144.2	-179.8	-78.1	0	0	0	0	109.3	N581 Q583 C612 C620 V621	N581-V610 VanDerWaalsContact ND2-CG1 3.3Å; N581-V610 WeakPolarHBondContact ND2-CG1 3.45Å; Q583-V610 HydrophobicContact CB-CG1 4.17Å; Q583-V610 HydrophobicContact CB-CG2 4.01Å; V610-C612 PolarHBondContact O-N 3.49Å; V610-C620 WeakPolarHBondContact O-CA 3.4Å; V610-V621 HydrophobicContact CG2-CG2 4.34Å; V610-V621 WeakPolarHBondContact CG2-O 3.13Å; V610-V621 PolarHBondContact N-O 2.58Å; V610-V621 PolarHBondContact O-N 3.22Å
611	C	86.6	Confident	75.6	Confident	24 Å²	24	55.7 Å²	55.7	16%	0.162	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	107.3	-179.5	-172.2	0	0	0	0	109.7	C599 S601 N602	C599-C611 VanDerWaalsContact C-SG 3.55Å; C599-C611 HydrophobicContact CB-CB 3.79Å; C599-C611 WeakPolarHBondContact CB-SG 2.92Å; C599-C611 WeakPolarHBondContact SG-CA 3.37Å; C599-C611 WeakPolarHBondContact SG-CB 3.43Å; C599-C611 CovalentContact SG-SG 2.03Å; C599-C611 PolarHBondContact SG-SG 3.43Å; S601-C611 WeakPolarHBondContact O-CB 3.33Å; N602-C611 PolarHBondContact OD1-N 3.25Å
612	C	81.5	Confident	75.4	Confident	6 Å²	6	59.3 Å²	59.3	4%	0.041	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	144.2	-176.3	-57.7	0	0	0	0	111.5	C584 V610 A614 S618 K619 V621	C584-C612 VanDerWaalsContact CA-SG 3.51Å; C584-C612 HydrophobicContact CB-CB 4Å; C584-C612 WeakPolarHBondContact CB-SG 3.48Å; C584-C612 WeakPolarHBondContact SG-CB 3.11Å; C584-C612 CovalentContact SG-SG 2.04Å; C584-C612 PolarHBondContact SG-SG 3.24Å; V610-C612 PolarHBondContact O-N 3.49Å; C612-A614 PolarHBondContact O-N 2.85Å; C612-S618 WeakPolarHBondContact O-CA 3.4Å; C612-K619 PolarHBondContact N-O 3.07Å; C612-K619 PolarHBondContact O-N 3.11Å; C612-V621 HydrophobicContact CB-CG2 3.44Å; C612-V621 VanDerWaalsContact CB-CG2 3.44Å; C612-V621 WeakPolarHBondContact SG-CG2 2.98Å
613	P	69	Low	74.9	Confident	65 Å²	65	57.1 Å²	57.1	42%	0.422	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.5	-178.9	27.1	-32.6	0	0	0	111.7	M590	M590-P613 WeakPolarHBondContact CE-O 3.39Å
614	A	64.9	Low	74.1	Confident	20 Å²	20	57.4 Å²	57.4	17%	0.165	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	171.6	173.4	0	0	0	0	0	112.3	M590 C612 S616 G617 K619	M590-A614 HydrophobicContact CE-CB 4.33Å; M590-A614 HydrophobicContact SD-CB 3.61Å; C612-A614 PolarHBondContact O-N 2.85Å; A614-S616 PolarHBondContact O-N 3.5Å; A614-G617 CarbonylContact C-O 3.39Å; A614-G617 WeakPolarHBondContact CA-O 3.48Å; A614-G617 VanDerWaalsContact CB-O 3.29Å; A614-G617 WeakPolarHBondContact CB-O 3.01Å; A614-G617 PolarHBondContact N-O 3.12Å; A614-G617 PolarHBondContact O-N 3.25Å; A614-K619 HydrophobicContact CB-CB 4.23Å; A614-K619 HydrophobicContact CB-CG 3.65Å
615	L	60.4	Low	72.6	Confident	163 Å²	163	58.6 Å²	58.6	85%	0.853	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.4	179	-81.5	155.7	0	0	0	113.7
616	S	63.9	Low	70.4	Confident	77 Å²	77	65 Å²	65	54%	0.538	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	27.6	178.5	66.2	0	0	0	0	113.5	A614 K619	A614-S616 PolarHBondContact O-N 3.5Å; S616-K619 WeakPolarHBondContact OG-CE 3.37Å
617	G	66.5	Low	68	Low	41 Å²	41	65.5 Å²	65.5	42%	0.423	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100.5	179.4	-174.8	0	0	0	0	0	112.7	A614	A614-G617 CarbonylContact C-O 3.39Å; A614-G617 WeakPolarHBondContact CA-O 3.48Å; A614-G617 VanDerWaalsContact CB-O 3.29Å; A614-G617 WeakPolarHBondContact CB-O 3.01Å; A614-G617 PolarHBondContact N-O 3.12Å; A614-G617 PolarHBondContact O-N 3.25Å
618	S	79.8	Confident	66.3	Low	43 Å²	43	64.3 Å²	64.3	30%	0.301	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130.3	178.3	-64.5	0	0	0	0	111	S598 C599 C612	S598-S618 WeakPolarHBondContact CA-O 3.46Å; C599-S618 PolarHBondContact N-O 2.02Å; C599-S618 VanDerWaalsContact N-O 3.13Å; C599-S618 WeakPolarHBondContact O-CB 3.31Å; C612-S618 WeakPolarHBondContact O-CA 3.4Å
619	K	81.2	Confident	64.4	Low	20 Å²	20	72.3 Å²	72.3	9%	0.087	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.4	-175.3	-64.7	-64.5	-169.4	-171.6	0	110.6	F596 P597 C612 A614 S616 V621	F596-K619 HydrophobicContact CB-CB 3.98Å; F596-K619 HydrophobicContact CB-CD 3.88Å; F596-K619 HydrophobicContact CB-CG 4.21Å; F596-K619 WeakPolarHBondContact O-CD 3.43Å; F596-K619 PolarHBondContact O-NZ 3.38Å; P597-K619 CarbonylContact O-C 3.46Å; P597-K619 VanDerWaalsContact O-CA 3.31Å; P597-K619 WeakPolarHBondContact O-CA 2.96Å; C612-K619 PolarHBondContact N-O 3.07Å; C612-K619 PolarHBondContact O-N 3.11Å; A614-K619 HydrophobicContact CB-CB 4.23Å; A614-K619 HydrophobicContact CB-CG 3.65Å; S616-K619 WeakPolarHBondContact OG-CE 3.37Å; K619-V621 HydrophobicContact CB-CG1 4.39Å; K619-V621 PolarHBondContact O-N 3.39Å
620	C	83.5	Confident	62	Low	4 Å²	4	77.2 Å²	77.2	3%	0.027	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	120.6	168.8	-66.5	0	0	0	0	109.9	F596 P597 C599 C605 V610	F596-C620 WeakPolarHBondContact CD1-O 3.15Å; P597-C620 HydrophobicContact CB-CB 4.46Å; P597-C620 PolarHBondContact O-N 2.76Å; C599-C620 VanDerWaalsContact CB-SG 3.52Å; C605-C620 WeakPolarHBondContact CA-SG 3.44Å; C605-C620 HydrophobicContact CB-CB 3.86Å; C605-C620 WeakPolarHBondContact CB-SG 3.13Å; C605-C620 WeakPolarHBondContact SG-CA 3.33Å; C605-C620 WeakPolarHBondContact SG-CB 3.48Å; C605-C620 CovalentContact SG-SG 2.05Å; C605-C620 PolarHBondContact SG-SG 3.39Å; V610-C620 WeakPolarHBondContact O-CA 3.4Å
621	V	80.4	Confident	59.7	Low	10 Å²	10	84.3 Å²	84.3	6%	0.061	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	157.3	179.5	-60.6	0	0	0	0	111.3	P585 L593 T609 V610 C612 K619	P585-V621 HydrophobicContact CG-CG2 4.17Å; L593-V621 HydrophobicContact CD2-CG1 4.39Å; T609-V621 CarbonylContact C-O 3.43Å; T609-V621 VanDerWaalsContact CA-O 3.22Å; T609-V621 WeakPolarHBondContact CA-O 2.82Å; T609-V621 VanDerWaalsContact CB-O 3.3Å; T609-V621 WeakPolarHBondContact CB-O 3.2Å; V610-V621 HydrophobicContact CG2-CG2 4.34Å; V610-V621 WeakPolarHBondContact CG2-O 3.13Å; V610-V621 PolarHBondContact N-O 2.58Å; V610-V621 PolarHBondContact O-N 3.22Å; C612-V621 HydrophobicContact CB-CG2 3.44Å; C612-V621 VanDerWaalsContact CB-CG2 3.44Å; C612-V621 WeakPolarHBondContact SG-CG2 2.98Å; K619-V621 HydrophobicContact CB-CG1 4.39Å; K619-V621 PolarHBondContact O-N 3.39Å
622	H	77.1	Confident	57	Low	128 Å²	128	89.5 Å²	89.5	59%	0.593	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	137	177.1	-86.4	-73.5	0	0	0	111.9	E624	H622-E624 PolarHBondContact O-N 3.49Å
623	A	65.2	Low	54.6	Low	38 Å²	38	93.6 Å²	93.6	31%	0.314	52%	0.524	S	S	.	.			trans	-52	122.4	170.5	0	0	0	0	0	112.8	Q583 S625	Q583-A623 HydrophobicContact CB-CB 3.71Å; Q583-A623 HydrophobicContact CG-CB 3.24Å; Q583-A623 CarbonylContact O-C 3.55Å; Q583-A623 WeakPolarHBondContact O-CA 3.32Å; A623-S625 PolarHBondContact O-N 3.49Å
624	E	60.4	Low	52.8	Low	104 Å²	104	95.1 Å²	95.1	49%	0.486	54%	0.536	S	S	.	.			trans	-62.3	115.5	171.8	-134.9	172.1	-140	0	0	109.3	Q583 P585 S586 H622 N626	Q583-E624 PolarHBondContact O-N 2.77Å; P585-E624 WeakPolarHBondContact CA-OE1 2.98Å; P585-E624 HydrophobicContact CB-CG 4.16Å; S586-E624 PolarHBondContact N-OE1 2.8Å; H622-E624 PolarHBondContact O-N 3.49Å; E624-N626 PolarHBondContact O-N 3.34Å
625	S	45.4	Very low	51.3	Low	102 Å²	102	100.4 Å²	100.4	71%	0.713	56%	0.562	S	S	*	*			trans	-73.7	116.4	177.7	62.6	0	0	0	0	109.3	A623 N627	A623-S625 PolarHBondContact O-N 3.49Å; S625-N627 PolarHBondContact O-N 3.16Å
626	N	33	Very low	50	Low	150 Å²	150	99.1 Å²	99.1	80%	0.802	56%	0.561	S	S	*	*			trans	-61	80	167.3	-93.5	-33.5	0	0	0	110.4	E624	E624-N626 PolarHBondContact O-N 3.34Å
627	N	30.7	Very low	48.3	Very low	140 Å²	140	101.2 Å²	101.2	75%	0.749	57%	0.574	S	S	*	*			trans	-159	85.9	166.5	-148.7	14.5	0	0	0	110.3	S625	S625-N627 PolarHBondContact O-N 3.16Å
628	S	32.2	Very low	46.6	Very low	116 Å²	116	107.7 Å²	107.7	81%	0.811	59%	0.593	S	S	*	*			trans	166.4	113.5	134.8	-72.7	0	0	0	0	110.8
629	R	29.3	Very low	44.3	Very low	233 Å²	233	112 Å²	112	88%	0.879	62%	0.618	S	S	*	*			trans	-62.3	164.6	161.9	-71.7	172.6	172.3	150.4	-3.3	110.5
630	N	29.9	Very low	41.8	Very low	124 Å²	124	114.3 Å²	114.3	66%	0.663	65%	0.647	S	S	*	*			trans	100.5	126.2	146.7	-77.5	-8.2	0	0	0	118.6
631	Q	31.9	Very low	39.4	Very low	163 Å²	163	120.5 Å²	120.5	76%	0.762	69%	0.69	S	S	*	*			trans	75.3	141	139.5	-71.3	157.9	1.5	0	0	115.5
632	D	30.6	Very low	37.1	Very low	132 Å²	132	129.7 Å²	129.7	71%	0.706	73%	0.73	S	S	*	*			cis	-169.2	156.6	-12.2	-141.6	-39.4	0	0	0	104.4
633	S	30.4	Very low	35.2	Very low	93 Å²	93	129 Å²	129	65%	0.65	74%	0.736	S	S	*	*			trans	18.2	130.4	147.1	-56.4	0	0	0	0	122.4
634	S	31.9	Very low	33.5	Very low	96 Å²	96	135.3 Å²	135.3	67%	0.671	76%	0.764	S	S	*	*			trans	72.7	144	131.1	85.7	0	0	0	0	122
635	D	33	Very low	32.1	Very low	132 Å²	132	133.7 Å²	133.7	71%	0.706	78%	0.775	S	S	*	*			trans	97.2	125.9	144.5	-60.8	-38.9	0	0	0	121.2
636	T	33.2	Very low	31.3	Very low	136 Å²	136	136.6 Å²	136.6	83%	0.834	78%	0.782	S	S	*	*			trans	84.5	122.3	139.6	47.8	0	0	0	0	121.5
637	C	29.1	Very low	31.6	Very low	121 Å²	121	135.8 Å²	135.8	82%	0.818	78%	0.782	S	S	*	*			trans	-56.9	154.6	164.8	-57.8	0	0	0	0	111.1
638	E	30.4	Very low	31.9	Very low	177 Å²	177	133.8 Å²	133.8	83%	0.827	78%	0.777	S	S	*	*				-176	129	115.1	-104.6	177.9	175.5	0	0	113.3
639	T	31.5	Very low	31.6	Very low	133 Å²	133	135.5 Å²	135.5	82%	0.816	78%	0.776	S	S	*	*			trans	35.3	132.5	137.7	50.2	0	0	0	0	121.2
640	G	28.6	Very low	31.6	Very low	68 Å²	68	135 Å²	135	70%	0.701	77%	0.774	S	S	*	*			trans	132.1	105.4	132.5	0	0	0	0	0	117
641	S	33	Very low	31.5	Very low	134 Å²	134	135 Å²	135	94%	0.937	78%	0.782	S	S	*	*			trans	100.5	137.9	132.5	-53.2	0	0	0	0	119.4
642	K	32.2	Very low	31.5	Very low	204 Å²	204	135.2 Å²	135.2	89%	0.887	78%	0.783	S	S	*	*			trans	-83.9	170	-157.6	-103.8	176.3	177.6	175.2	0	114.3
643	P	38.3	Very low	31.7	Very low	112 Å²	112	135 Å²	135	73%	0.727	78%	0.782	S	S	*	*			trans	-86.8	153.8	-168.4	36.5	-33.8	0	0	0	112.5
644	L	28.6	Very low	32	Very low	172 Å²	172	136.9 Å²	136.9	90%	0.901	79%	0.785	S	S	*	*			trans	-139.5	122	161.3	-73.6	175.3	0	0	0	108.7
645	G	31	Very low	32.6	Very low	69 Å²	69	136.4 Å²	136.4	71%	0.711	78%	0.781	S	S	*	*			trans	-66.2	159	163.6	0	0	0	0	0	110.4
646	L	29.5	Very low	33	Very low	163 Å²	163	141.2 Å²	141.2	85%	0.853	79%	0.79	S	S	*	*			trans	-176.1	117.9	152.6	-96.9	147.2	0	0	0	107.4
647	V	38.5	Very low	33.3	Very low	134 Å²	134	140 Å²	140	81%	0.812	79%	0.785	S	S	*	*			trans	-58.8	137.4	156	178.8	0	0	0	0	106.6
648	P	36	Very low	33.6	Very low	98 Å²	98	140.4 Å²	140.4	64%	0.636	79%	0.787	S	S	*	*				-150.8	137.7	120.7	25.2	-2.5	0	0	0	116.2
649	L	26.8	Very low	33.8	Very low	152 Å²	152	138.1 Å²	138.1	80%	0.796	79%	0.79	S	S	*	*				68.8	122.4	122.7	-56.5	168.7	0	0	0	119.5	C651	L649-C651 PolarHBondContact O-N 3.19Å
650	R	28.3	Very low	34.1	Very low	221 Å²	221	135.5 Å²	135.5	83%	0.834	79%	0.79	S	S	*	*			trans	-37.1	125.1	151.2	-78.5	175.7	159.6	163.9	-5.6	110.7
651	C	29.3	Very low	34.5	Very low	124 Å²	124	138 Å²	138	84%	0.838	79%	0.792	S	S	*	*			trans	-96.5	98.2	158.3	-69.3	0	0	0	0	108	L649 D653	L649-C651 PolarHBondContact O-N 3.19Å; C651-D653 PolarHBondContact O-N 3.28Å
652	E	32.1	Very low	34.5	Very low	168 Å²	168	140.5 Å²	140.5	79%	0.785	78%	0.78	S	S	*	*			trans	-75.9	67.4	156	-77.1	156.3	127.3	0	0	108.1
653	D	34.2	Very low	34.7	Very low	128 Å²	128	141 Å²	141	68%	0.684	78%	0.782	S	S	*	*			trans	-165.6	127.8	161.1	-124.6	-30.4	0	0	0	113.5	C651 S655	C651-D653 PolarHBondContact O-N 3.28Å; D653-S655 PolarHBondContact O-N 3.31Å
654	D	36	Very low	34.3	Very low	132 Å²	132	140.2 Å²	140.2	71%	0.706	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	23.4	-164.3	-113.7	-17.7	0	0	0	113.7	R662	D654-R662 VanDerWaalsContact CG-NH2 3.31Å; D654-R662 IonicContact OD1-NH2 3.15Å; D654-R662 PolarHBondContact OD1-NH2 2.01Å; D654-R662 VanDerWaalsContact OD1-NH2 3.15Å; D654-R662 IonicContact OD2-CZ 3.95Å; D654-R662 IonicContact OD2-NH2 2.78Å; D654-R662 PolarHBondContact OD2-NH2 2.86Å
655	S	46.1	Very low	34.3	Very low	86 Å²	86	138.6 Å²	138.6	60%	0.601	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	4.8	-164.6	57.7	0	0	0	0	116.6	D653	D653-S655 PolarHBondContact O-N 3.31Å
656	R	40.8	Very low	34.3	Very low	234 Å²	234	144.8 Å²	144.8	88%	0.883	79%	0.79	S	S	*	*	S	Bend	trans	-139.3	16	-176.6	-104.8	175	-86.6	-167.6	-4.2	116.6
657	C	38.2	Very low	34.2	Very low	109 Å²	109	144.9 Å²	144.9	74%	0.736	79%	0.79	S	S	*	*	S	Bend	trans	-96	136	177.2	-70.4	0	0	0	0	112.4
658	P	36.5	Very low	33.6	Very low	130 Å²	130	142.1 Å²	142.1	84%	0.844	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.2	134.9	172.4	-12.4	26.8	0	0	0	111.1
659	S	35	Very low	33.1	Very low	129 Å²	129	146.4 Å²	146.4	90%	0.902	79%	0.794	S	S	*	*	S	Bend	trans	-62.9	133.6	-168	-50.5	0	0	0	0	115.7
660	G	37.7	Very low	33.1	Very low	78 Å²	78	147.9 Å²	147.9	80%	0.804	79%	0.794	S	S	*	*			trans	171.6	54.7	174.4	0	0	0	0	0	114.4
661	T	36.8	Very low	33.1	Very low	121 Å²	121	145.4 Å²	145.4	74%	0.742	79%	0.789	S	S	*	*			trans	-52.5	129.5	-171.8	47.8	0	0	0	0	117.9
662	R	32.8	Very low	32.9	Very low	187 Å²	187	144.8 Å²	144.8	71%	0.706	78%	0.781	S	S	*	*				81	124.1	91.2	-70.3	-173.8	-176.4	-167.5	-0.7	117.8	D654	D654-R662 VanDerWaalsContact CG-NH2 3.31Å; D654-R662 IonicContact OD1-NH2 3.15Å; D654-R662 PolarHBondContact OD1-NH2 2.01Å; D654-R662 VanDerWaalsContact OD1-NH2 3.15Å; D654-R662 IonicContact OD2-CZ 3.95Å; D654-R662 IonicContact OD2-NH2 2.78Å; D654-R662 PolarHBondContact OD2-NH2 2.86Å
663	K	36.2	Very low	32.7	Very low	213 Å²	213	144.6 Å²	144.6	93%	0.926	78%	0.78	S	S	*	*				154.1	139.7	129.6	-85.6	173.7	-176.4	-178.7	0	110
664	A	30.6	Very low	32.3	Very low	97 Å²	97	146.3 Å²	146.3	80%	0.802	78%	0.784	S	S	*	*			cis	-167.2	147.2	-10.1	0	0	0	0	0	108.2
665	V	28.8	Very low	31.9	Very low	138 Å²	138	147.3 Å²	147.3	84%	0.836	78%	0.782	S	S	*	*			trans	-98	142.1	170	169.5	0	0	0	0	109.2
666	K	31.4	Very low	31.1	Very low	199 Å²	199	152.2 Å²	152.2	87%	0.865	79%	0.789	S	S	*	*			trans	-176.7	112	147.5	-102.3	170.7	-175.4	-175.2	0	108.5
667	L	25.6	Very low	30.4	Very low	164 Å²	164	147.4 Å²	147.4	86%	0.859	79%	0.785	S	S	*	*				86.6	128.1	78.3	-156.7	85	0	0	0	113.6
668	A	25.8	Very low	30	Very low	77 Å²	77	148.1 Å²	148.1	64%	0.636	79%	0.786	S	S	*	*			trans	93.3	104.5	150	0	0	0	0	0	120.6
669	Q	27	Very low	29.6	Very low	188 Å²	188	150.1 Å²	150.1	88%	0.879	78%	0.784	S	S	*	*				53.4	127.5	119	-65.6	-175.7	-20.3	0	0	121.3
670	K	26.9	Very low	29.4	Very low	183 Å²	183	152.4 Å²	152.4	80%	0.796	79%	0.785	S	S	*	*			trans	103.6	123.5	131.2	-140.5	171.6	-173.5	174	0	118.1
671	K	26.6	Very low	28.8	Very low	169 Å²	169	153 Å²	153	74%	0.735	78%	0.782	S	S	*	*			trans	93.8	114.2	138.1	-106.8	-180	177.7	-168.7	0	120.9
672	T	26.6	Very low	28.4	Very low	110 Å²	110	157.3 Å²	157.3	68%	0.675	79%	0.787	S	S	*	*			trans	66.7	116.5	130.1	44.3	0	0	0	0	121.8
673	E	26.9	Very low	28.1	Very low	165 Å²	165	157 Å²	157	77%	0.771	79%	0.793	S	S	*	*				64.7	126.7	128.4	-74.8	-173.9	156.8	0	0	122.7
674	H	27.2	Very low	27.8	Very low	163 Å²	163	153.7 Å²	153.7	76%	0.755	78%	0.784	S	S	*	*			trans	77.8	126.3	143.6	-82.1	-63.7	0	0	0	121.3
675	K	27.2	Very low	27.8	Very low	153 Å²	153	155.6 Å²	155.6	67%	0.665	79%	0.786	S	S	*	*			trans	87.8	106.5	135.9	-117.1	173.9	169.3	-161.5	0	118.1
676	Y	28.5	Very low	28.1	Very low	190 Å²	190	152.9 Å²	152.9	75%	0.745	77%	0.769	S	S	*	*				160.8	138.5	101.7	-99	-79.3	0	0	0	112.2
677	V	26.4	Very low	28.2	Very low	132 Å²	132	148.5 Å²	148.5	80%	0.8	76%	0.761	S	S	*	*			trans	-78.1	135.1	169.2	170.6	0	0	0	0	109.2
678	T	30.2	Very low	28.6	Very low	124 Å²	124	144.1 Å²	144.1	76%	0.761	74%	0.743	S	S	*	*			trans	-161.4	122.4	150.7	31.8	0	0	0	0	112
679	E	28.2	Very low	29	Very low	172 Å²	172	147.4 Å²	147.4	80%	0.804	75%	0.749	S	S	*	*			trans	56.8	121	137.4	-66	-172.4	140.1	0	0	122.8
680	L	30.1	Very low	29.6	Very low	178 Å²	178	142.3 Å²	142.3	93%	0.932	75%	0.746	S	S	*	*			trans	-144.7	98.7	135.5	-105.9	155.6	0	0	0	108.2
681	A	26.1	Very low	30.6	Very low	89 Å²	89	137.3 Å²	137.3	74%	0.736	75%	0.747	S	S	*	*			trans	-86.1	130.9	168.2	0	0	0	0	0	109.1
682	Y	27.7	Very low	30.9	Very low	213 Å²	213	133.9 Å²	133.9	84%	0.835	73%	0.732	S	S	*	*			trans	-115.6	116.5	164	-147.7	-93.2	0	0	0	108.3
683	Q	26.5	Very low	31.4	Very low	181 Å²	181	131.9 Å²	131.9	85%	0.846	72%	0.722	S	S	*	*			trans	-70	123.3	175.7	-79.3	163.6	-36.4	0	0	109.6
684	I	29.3	Very low	32	Very low	142 Å²	142	126.7 Å²	126.7	73%	0.728	70%	0.703	S	S	*	*			trans	-115.9	106.1	162.9	-60.6	177.4	0	0	0	107.3
685	T	31	Very low	32.5	Very low	137 Å²	137	123.7 Å²	123.7	84%	0.84	70%	0.696	S	S	*	*			trans	-65	122.4	168.1	34.1	0	0	0	0	110.3
686	V	35.6	Very low	33.1	Very low	81 Å²	81	124 Å²	124	49%	0.491	71%	0.705	S	S	.	*			trans	-110.4	131.3	174.3	-162.5	0	0	0	0	108.2	C688	V686-C688 PolarHBondContact O-N 2.81Å
687	P	33.4	Very low	33.8	Very low	108 Å²	108	118 Å²	118	70%	0.701	70%	0.7	S	S	*	*			trans	-75.2	125.4	-176.3	30.9	-32	0	0	0	109.5
688	C	33.7	Very low	34.2	Very low	71 Å²	71	118.2 Å²	118.2	48%	0.48	69%	0.691	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108	127.8	172.2	-58	0	0	0	0	108.2	V686 C693	V686-C688 PolarHBondContact O-N 2.81Å; C688-C693 HydrophobicContact CB-CB 4.35Å; C688-C693 WeakPolarHBondContact CB-SG 3.29Å; C688-C693 WeakPolarHBondContact SG-CB 3.29Å; C688-C693 CovalentContact SG-SG 2.06Å; C688-C693 PolarHBondContact SG-SG 2.75Å
689	I	34.8	Very low	34.6	Very low	147 Å²	147	119.9 Å²	119.9	75%	0.754	68%	0.684	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-121.4	123.8	174	-59.3	176.9	0	0	0	106.8	G691 K692	I689-G691 PolarHBondContact O-N 2.8Å; I689-K692 PolarHBondContact N-O 2.04Å; I689-K692 PolarHBondContact O-N 3.43Å
690	G	38.9	Very low	35	Very low	80 Å²	80	120.5 Å²	120.5	83%	0.825	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.4	34.8	172.6	0	0	0	0	0	115.5	K692	G690-K692 VanDerWaalsContact C-N 3.35Å; G690-K692 PolarHBondContact O-N 2.9Å
691	G	47.4	Very low	35.1	Very low	79 Å²	79	118.5 Å²	118.5	81%	0.814	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.8	7.7	176.1	0	0	0	0	0	115.3	I689	I689-G691 PolarHBondContact O-N 2.8Å
692	K	33.8	Very low	35.5	Very low	96 Å²	96	123.4 Å²	123.4	42%	0.417	68%	0.68	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	125.4	177.7	-61	-174.1	179.9	-173.2	0	110.8	I689 G690 W699 E701	I689-K692 PolarHBondContact N-O 2.04Å; I689-K692 PolarHBondContact O-N 3.43Å; G690-K692 VanDerWaalsContact C-N 3.35Å; G690-K692 PolarHBondContact O-N 2.9Å; K692-W699 HydrophobicContact CB-CE3 3.59Å; K692-W699 HydrophobicContact CB-CZ3 3.55Å; K692-W699 HydrophobicContact CD-CE3 4.05Å; K692-W699 HydrophobicContact CD-CZ3 4.49Å; K692-W699 HydrophobicContact CG-CE3 4.38Å; K692-E701 WeakPolarHBondContact CE-OE1 3.11Å; K692-E701 IonicContact NZ-OE1 3.54Å
693	C	37	Very low	35.5	Very low	68 Å²	68	122.7 Å²	122.7	46%	0.459	68%	0.681	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.2	132.7	176.7	-48.5	0	0	0	0	108.5	C688	C688-C693 HydrophobicContact CB-CB 4.35Å; C688-C693 WeakPolarHBondContact CB-SG 3.29Å; C688-C693 WeakPolarHBondContact SG-CB 3.29Å; C688-C693 CovalentContact SG-SG 2.06Å; C688-C693 PolarHBondContact SG-SG 2.75Å
694	C	38.3	Very low	35.9	Very low	56 Å²	56	123.6 Å²	123.6	38%	0.378	69%	0.685	S	S	.	*			trans	-90.9	124.1	-175.4	-171	0	0	0	0	110.7	W699	C694-W699 HydrophobicContact CB-CH2 4.49Å; C694-W699 HydrophobicContact CB-CZ2 4.33Å
695	V	38.9	Very low	35.9	Very low	101 Å²	101	118.9 Å²	118.9	61%	0.612	67%	0.672	S	S	*	*	B	Isolated β-bridge	trans	-135.7	125.6	170.6	-175.2	0	0	0	0	108.3	G697 F698	V695-G697 VanDerWaalsContact C-N 3.27Å; V695-G697 PolarHBondContact O-N 2.62Å; V695-G697 VanDerWaalsContact O-N 3.14Å; V695-F698 PolarHBondContact O-N 3.46Å
696	N	39.3	Very low	35.9	Very low	160 Å²	160	122.3 Å²	122.3	86%	0.856	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.2	37.7	176.5	-70.5	-17.1	0	0	0	115.8	F698	N696-F698 VanDerWaalsContact C-N 3.34Å; N696-F698 PolarHBondContact O-N 3.01Å
697	G	42.5	Very low	35.5	Very low	62 Å²	62	124.7 Å²	124.7	64%	0.639	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.7	7.1	169.8	0	0	0	0	0	116.2	V695	V695-G697 VanDerWaalsContact C-N 3.27Å; V695-G697 PolarHBondContact O-N 2.62Å; V695-G697 VanDerWaalsContact O-N 3.14Å
698	F	34.9	Very low	35.5	Very low	137 Å²	137	125.9 Å²	125.9	60%	0.601	70%	0.695	S	S	*	*	B	Isolated β-bridge	trans	-114.7	136.3	176	-85	-95.9	0	0	0	111.8	V695 N696 F778	V695-F698 PolarHBondContact O-N 3.46Å; N696-F698 VanDerWaalsContact C-N 3.34Å; N696-F698 PolarHBondContact O-N 3.01Å; F698-F778 HydrophobicContact CZ-CZ 4.32Å
699	W	40.3	Very low	35.5	Very low	160 Å²	160	129.2 Å²	129.2	61%	0.606	71%	0.713	S	S	*	*			trans	-111	103.6	177	-66.9	85.8	0	0	0	108.2	K692 C694	K692-W699 HydrophobicContact CB-CE3 3.59Å; K692-W699 HydrophobicContact CB-CZ3 3.55Å; K692-W699 HydrophobicContact CD-CE3 4.05Å; K692-W699 HydrophobicContact CD-CZ3 4.49Å; K692-W699 HydrophobicContact CG-CE3 4.38Å; C694-W699 HydrophobicContact CB-CH2 4.49Å; C694-W699 HydrophobicContact CB-CZ2 4.33Å
700	E	36	Very low	35.2	Very low	185 Å²	185	124.9 Å²	124.9	86%	0.864	71%	0.705	S	S	*	*			trans	-147.1	147.2	178.2	-111.4	174.8	-176.6	0	0	113.5
701	E	31.9	Very low	34.9	Very low	136 Å²	136	126.5 Å²	126.5	64%	0.636	70%	0.704	S	S	*	*			trans	-92.6	141.3	-169.2	-63.4	-177.3	172.5	0	0	111.4	K692	K692-E701 WeakPolarHBondContact CE-OE1 3.11Å; K692-E701 IonicContact NZ-OE1 3.54Å
702	H	34.5	Very low	34	Very low	192 Å²	192	133.2 Å²	133.2	89%	0.889	71%	0.711	S	S	*	*			trans	75.1	96.4	176	-72.3	-96.2	0	0	0	118.2
703	F	27.8	Very low	33.7	Very low	198 Å²	198	131.9 Å²	131.9	87%	0.868	72%	0.724	S	S	*	*			trans	-104.8	126.6	164.6	-144.4	-94.9	0	0	0	109.1
704	Q	35.6	Very low	33.4	Very low	200 Å²	200	135.4 Å²	135.4	94%	0.935	74%	0.737	S	S	*	*			trans	-122.1	111.6	158	-130.8	170.2	8.5	0	0	106.7
705	G	28.5	Very low	33	Very low	43 Å²	43	140.5 Å²	140.5	44%	0.443	76%	0.756	S	S	.	*			trans	-79.3	153.6	-160.3	0	0	0	0	0	115.1
706	F	30.2	Very low	32.4	Very low	209 Å²	209	145.2 Å²	145.2	92%	0.917	76%	0.764	S	S	*	*			trans	-132.1	119.3	137	-97.5	-88.3	0	0	0	108.3
707	V	28.9	Very low	31.8	Very low	130 Å²	130	146 Å²	146	79%	0.788	76%	0.76	S	S	*	*			trans	-85.4	114.7	171.8	173.2	0	0	0	0	106.9
708	T	33.1	Very low	31.1	Very low	134 Å²	134	148.2 Å²	148.2	82%	0.822	76%	0.761	S	S	*	*			trans	-137.3	122.9	152.3	46.1	0	0	0	0	109.6	G710	T708-G710 PolarHBondContact O-N 2.84Å
709	V	33.1	Very low	30.8	Very low	141 Å²	141	150.3 Å²	150.3	86%	0.855	77%	0.773	S	S	*	*			trans	-59.5	115.5	-170.8	177.4	0	0	0	0	111.2
710	G	28.5	Very low	30.1	Very low	56 Å²	56	149.4 Å²	149.4	58%	0.577	78%	0.779	S	S	*	*			trans	-89.7	144.2	165.3	0	0	0	0	0	111.2	T708	T708-G710 PolarHBondContact O-N 2.84Å
711	S	32	Very low	29.6	Very low	114 Å²	114	152.1 Å²	152.1	80%	0.797	78%	0.782	S	S	*	*			trans	67.7	86.9	152.7	44.5	0	0	0	0	118.6
712	F	29.7	Very low	29.3	Very low	220 Å²	220	152 Å²	152	97%	0.965	79%	0.785	S	S	*	*			trans	-152	118.3	141.1	-107.3	-81.5	0	0	0	110.6
713	G	27	Very low	28.9	Very low	67 Å²	67	149.9 Å²	149.9	69%	0.691	78%	0.78	S	S	*	*			trans	72.8	123.8	151.6	0	0	0	0	0	118.4
714	L	31.6	Very low	28.8	Very low	142 Å²	142	149 Å²	149	74%	0.743	77%	0.772	S	S	*	*				177.9	72.2	126.9	-90.7	156	0	0	0	110.4	Y716	L714-Y716 PolarHBondContact O-N 3.46Å
715	Q	27.9	Very low	28.4	Very low	163 Å²	163	149.8 Å²	149.8	76%	0.762	77%	0.766	S	S	*	*			trans	-66.2	92	136.1	-88.1	179.2	-33.9	0	0	105.9
716	Y	27.3	Very low	28.4	Very low	200 Å²	200	155.4 Å²	155.4	78%	0.784	79%	0.786	S	S	*	*			trans	170.5	94.8	163.6	-100.4	-73.7	0	0	0	105.9	L714	L714-Y716 PolarHBondContact O-N 3.46Å
717	F	27.5	Very low	28.3	Very low	177 Å²	177	149.4 Å²	149.4	78%	0.776	77%	0.767	S	S	*	*			trans	174.2	67.6	150.2	-95.8	-67.4	0	0	0	108.7	L720	F717-L720 HydrophobicContact CE1-CD1 4.28Å
718	T	26.7	Very low	28.3	Very low	108 Å²	108	148 Å²	148	66%	0.663	77%	0.768	S	S	*	*			trans	-82.2	142.2	148.4	37.3	0	0	0	0	107.7
719	Q	28.1	Very low	28.3	Very low	181 Å²	181	146.4 Å²	146.4	85%	0.846	76%	0.759	S	S	*	*			trans	75.7	82.7	171.6	-68	161.2	-29.9	0	0	118.2
720	L	27.4	Very low	28.4	Very low	142 Å²	142	143.2 Å²	143.2	74%	0.743	74%	0.743	S	S	*	*			trans	-134.4	100.8	141.1	-94.3	159.2	0	0	0	108.6	F717 L722	F717-L720 HydrophobicContact CE1-CD1 4.28Å; L720-L722 PolarHBondContact O-N 2.87Å
721	R	24.2	Very low	29	Very low	242 Å²	242	150.9 Å²	150.9	91%	0.913	75%	0.754	S	S	*	*			trans	-61.7	119.2	160.8	-92	-176.9	171.5	150.5	-2.8	107.4
722	L	26.9	Very low	29.6	Very low	134 Å²	134	153 Å²	153	70%	0.702	75%	0.749	S	S	*	*			trans	-127.7	107.9	157.9	-81.5	165.4	0	0	0	107.3	L720 Y724	L720-L722 PolarHBondContact O-N 2.87Å; L722-Y724 PolarHBondContact O-N 3Å
723	D	25.4	Very low	30.3	Very low	146 Å²	146	145 Å²	145	78%	0.781	72%	0.723	S	S	*	*			trans	-51.3	106.7	162.3	-82.7	-52.8	0	0	0	108.5	R725	D723-R725 PolarHBondContact O-N 3.02Å; D723-R725 VanDerWaalsContact O-N 3.11Å
724	Y	25.9	Very low	31.2	Very low	180 Å²	180	144.3 Å²	144.3	71%	0.706	70%	0.704	S	S	*	*			trans	-84.1	60.8	163.6	-96.4	-108.5	0	0	0	108.7	L722 T727	L722-Y724 PolarHBondContact O-N 3Å; Y724-T727 HydrophobicContact CD1-CG2 4.02Å; Y724-T727 WeakPolarHBondContact CD1-OG1 3.03Å; Y724-T727 HydrophobicContact CE1-CG2 3.56Å; Y724-T727 WeakPolarHBondContact CE1-OG1 3.36Å
725	R	27.1	Very low	32.1	Very low	216 Å²	216	141 Å²	141	82%	0.815	69%	0.692	S	S	*	*	S	Bend	trans	-104.7	123.6	145.3	-80.8	-175.3	172	-177	-2	104.2	D723	D723-R725 PolarHBondContact O-N 3.02Å; D723-R725 VanDerWaalsContact O-N 3.11Å
726	D	27.7	Very low	33.2	Very low	161 Å²	161	139.7 Å²	139.7	86%	0.861	69%	0.69	S	S	*	*			trans	89.3	41.1	174.7	-50	-27.8	0	0	0	119.4
727	T	29	Very low	34.2	Very low	84 Å²	84	134.7 Å²	134.7	52%	0.515	68%	0.681	S	S	.	*			trans	-101.2	100.6	160.9	37.9	0	0	0	0	111.7	Y724 V729	Y724-T727 HydrophobicContact CD1-CG2 4.02Å; Y724-T727 WeakPolarHBondContact CD1-OG1 3.03Å; Y724-T727 HydrophobicContact CE1-CG2 3.56Å; Y724-T727 WeakPolarHBondContact CE1-OG1 3.36Å; T727-V729 PolarHBondContact O-N 2.06Å; T727-V729 VanDerWaalsContact O-N 3.12Å
728	A	28.2	Very low	35.2	Very low	99 Å²	99	129.7 Å²	129.7	82%	0.818	68%	0.679	S	S	*	*			trans	-60.2	107.2	169.7	0	0	0	0	0	110.5	S730	A728-S730 PolarHBondContact O-N 3.42Å
729	V	32.5	Very low	36.4	Very low	102 Å²	102	128 Å²	128	62%	0.618	67%	0.665	S	S	*	*			trans	-65.6	118.8	164.5	-178.4	0	0	0	0	107.1	T727 R731 A733 L734	T727-V729 PolarHBondContact O-N 2.06Å; T727-V729 VanDerWaalsContact O-N 3.12Å; V729-R731 PolarHBondContact O-N 3.19Å; V729-A733 HydrophobicContact CG1-CB 3.88Å; V729-L734 HydrophobicContact CB-CD1 4.07Å; V729-L734 HydrophobicContact CG1-CD1 3.63Å
730	S	36.8	Very low	37.6	Very low	74 Å²	74	124 Å²	124	52%	0.517	65%	0.65	S	S	.	*			trans	-59.3	141.7	-177.6	93.8	0	0	0	0	110.2	A728 K732 A733	A728-S730 PolarHBondContact O-N 3.42Å; S730-K732 PolarHBondContact O-N 2.77Å; S730-K732 PolarHBondContact OG-N 3.43Å; S730-A733 PolarHBondContact O-N 3.01Å
731	R	41.2	Very low	38.6	Very low	216 Å²	216	120.9 Å²	120.9	82%	0.815	64%	0.638	S	S	*	*	H	α-helix	trans	-51.6	-18.5	177	-63.9	-176.5	-153.3	-176.8	5.7	113.7	V729 S735	V729-R731 PolarHBondContact O-N 3.19Å; R731-S735 PolarHBondContact O-N 3.16Å; R731-S735 PolarHBondContact O-OG 3.41Å
732	K	44.3	Very low	39.9	Very low	160 Å²	160	116.4 Å²	116.4	70%	0.696	63%	0.632	S	S	*	*	H	α-helix	trans	-77.5	-25.3	178.9	-157.6	165.5	-175.2	170.6	0	113.6	S730 S735	S730-K732 PolarHBondContact O-N 2.77Å; S730-K732 PolarHBondContact OG-N 3.43Å; K732-S735 PolarHBondContact O-OG 3.24Å
733	A	44.4	Very low	41	Very low	51 Å²	51	117.6 Å²	117.6	42%	0.421	63%	0.631	S	S	.	*	H	α-helix	trans	-85.5	-24.1	176.7	0	0	0	0	0	112.9	V729 S730	V729-A733 HydrophobicContact CG1-CB 3.88Å; S730-A733 PolarHBondContact O-N 3.01Å
734	L	45.4	Very low	41.8	Very low	53 Å²	53	115.8 Å²	115.8	28%	0.277	64%	0.636	S	S	.	*	H	α-helix	trans	-80.6	-29.3	172.4	-81.6	101.6	0	0	0	112.8	V729 I739	V729-L734 HydrophobicContact CB-CD1 4.07Å; V729-L734 HydrophobicContact CG1-CD1 3.63Å; L734-I739 HydrophobicContact CD2-CG2 4.12Å; L734-I739 PolarHBondContact O-N 3.34Å
735	S	50.8	Low	43	Very low	72 Å²	72	111 Å²	111	50%	0.503	62%	0.622	S	S	.	*	H	α-helix	trans	-69.8	-32.2	176.1	57.8	0	0	0	0	113.4	R731 K732 V737 G738	R731-S735 PolarHBondContact O-N 3.16Å; R731-S735 PolarHBondContact O-OG 3.41Å; K732-S735 PolarHBondContact O-OG 3.24Å; S735-V737 PolarHBondContact O-N 3Å; S735-G738 PolarHBondContact O-N 3.07Å
736	D	49.7	Very low	43.6	Very low	136 Å²	136	104.9 Å²	104.9	73%	0.727	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-10.1	-177.5	-71.9	-4.1	0	0	0	113.1
737	V	49.4	Very low	44.1	Very low	95 Å²	95	104.1 Å²	104.1	58%	0.576	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	8.9	179.5	-162.9	0	0	0	0	111.8	S735 I739	S735-V737 PolarHBondContact O-N 3Å; V737-I739 VanDerWaalsContact C-N 3.28Å; V737-I739 HydrophobicContact CG1-CD1 4.4Å; V737-I739 PolarHBondContact O-N 2.94Å
738	G	47.9	Very low	44.6	Very low	72 Å²	72	106.6 Å²	106.6	74%	0.742	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.9	19.9	176.2	0	0	0	0	0	114.7	S735	S735-G738 PolarHBondContact O-N 3.07Å
739	I	52.2	Low	45.5	Very low	72 Å²	72	107.8 Å²	107.8	37%	0.369	60%	0.603	S	S	.	*			trans	-98.5	119.6	-179.4	-59.1	179.4	0	0	0	108.9	L734 V737 P741	L734-I739 HydrophobicContact CD2-CG2 4.12Å; L734-I739 PolarHBondContact O-N 3.34Å; V737-I739 VanDerWaalsContact C-N 3.28Å; V737-I739 HydrophobicContact CG1-CD1 4.4Å; V737-I739 PolarHBondContact O-N 2.94Å; I739-P741 WeakPolarHBondContact O-CD 3.5Å
740	N	53.9	Low	46	Very low	98 Å²	98	108.4 Å²	108.4	52%	0.524	60%	0.602	S	S	.	*			trans	-70	117.3	177.6	-171.9	-23.5	0	0	0	109.9	D742 K743	N740-D742 PolarHBondContact O-N 3.16Å; N740-D742 VanDerWaalsContact O-N 3.14Å; N740-D742 PolarHBondContact OD1-N 2.92Å; N740-D742 VanDerWaalsContact OD1-N 3.11Å; N740-K743 PolarHBondContact O-N 3.38Å
741	P	47.5	Very low	46	Very low	76 Å²	76	114.6 Å²	114.6	49%	0.494	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.1	-10.2	-175.8	28.3	-35.7	0	0	0	114.3	I739	I739-P741 WeakPolarHBondContact O-CD 3.5Å
742	D	52.6	Low	46	Very low	147 Å²	147	112.6 Å²	112.6	79%	0.786	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	9.8	-175.3	-60.4	-37	0	0	0	113.6	N740	N740-D742 PolarHBondContact O-N 3.16Å; N740-D742 VanDerWaalsContact O-N 3.14Å; N740-D742 PolarHBondContact OD1-N 2.92Å; N740-D742 VanDerWaalsContact OD1-N 3.11Å
743	K	49.9	Very low	45.6	Very low	159 Å²	159	110.2 Å²	110.2	69%	0.691	61%	0.614	S	S	*	*	S	Bend	trans	-118.5	114.4	179.6	-121	177.9	179.7	-177.7	0	111.2	N740 I745	N740-K743 PolarHBondContact O-N 3.38Å; K743-I745 PolarHBondContact O-N 2.77Å
744	A	41.1	Very low	45	Very low	108 Å²	108	119.2 Å²	119.2	89%	0.893	64%	0.637	S	S	*	*			trans	-66.1	117.1	171.8	0	0	0	0	0	110
745	I	51	Low	44.3	Very low	79 Å²	79	125.3 Å²	125.3	41%	0.405	66%	0.662	S	S	.	*			trans	-118.6	128	176.7	-61.9	176.3	0	0	0	107.2	K743 Q749 L750	K743-I745 PolarHBondContact O-N 2.77Å; I745-Q749 HydrophobicContact CG2-CB 3.43Å; I745-Q749 VanDerWaalsContact CG2-CB 3.43Å; I745-L750 HydrophobicContact CB-CD1 4.48Å; I745-L750 HydrophobicContact CG2-CD1 4.04Å
746	T	40.4	Very low	43.5	Very low	89 Å²	89	126.6 Å²	126.6	55%	0.546	67%	0.669	S	S	.	*			trans	-72.2	155.4	176.8	51.4	0	0	0	0	110.8	D748 Q749 L750	T746-D748 PolarHBondContact O-N 2.79Å; T746-D748 VanDerWaalsContact O-N 3.12Å; T746-Q749 WeakPolarHBondContact O-CA 3.14Å; T746-Q749 PolarHBondContact O-N 3.35Å; T746-Q749 WeakPolarHBondContact OG1-CG 3.5Å; T746-L750 PolarHBondContact O-N 3.13Å
747	L	38.4	Very low	42.5	Very low	144 Å²	144	126.4 Å²	126.4	75%	0.754	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-31.2	-176.5	-161.7	71.5	0	0	0	112.8
748	D	39.7	Very low	41.6	Very low	136 Å²	136	129.3 Å²	129.3	73%	0.727	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-28.7	173.3	-71.5	-36.8	0	0	0	113.5	T746 L750 Y751	T746-D748 PolarHBondContact O-N 2.79Å; T746-D748 VanDerWaalsContact O-N 3.12Å; D748-L750 VanDerWaalsContact C-N 3.34Å; D748-Y751 PolarHBondContact O-N 3.1Å
749	Q	46.1	Very low	40.5	Very low	125 Å²	125	135.5 Å²	135.5	58%	0.584	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-9.6	178.2	-71.9	-159.1	-6.7	0	0	113.9	I745 T746 Y751	I745-Q749 HydrophobicContact CG2-CB 3.43Å; I745-Q749 VanDerWaalsContact CG2-CB 3.43Å; T746-Q749 WeakPolarHBondContact O-CA 3.14Å; T746-Q749 PolarHBondContact O-N 3.35Å; T746-Q749 WeakPolarHBondContact OG1-CG 3.5Å; Q749-Y751 VanDerWaalsContact C-N 3.32Å
750	L	43	Very low	39.4	Very low	114 Å²	114	137.9 Å²	137.9	60%	0.597	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-17.5	169.1	-129.9	93.3	0	0	0	112.5	I745 T746 D748	I745-L750 HydrophobicContact CB-CD1 4.48Å; I745-L750 HydrophobicContact CG2-CD1 4.04Å; T746-L750 PolarHBondContact O-N 3.13Å; D748-L750 VanDerWaalsContact C-N 3.34Å
751	Y	37.3	Very low	38.2	Very low	205 Å²	205	144.1 Å²	144.1	80%	0.804	73%	0.73	S	S	*	*	S	Bend	trans	-92.7	-7.7	-175.8	-93.9	-85.8	0	0	0	114.9	D748 Q749	D748-Y751 PolarHBondContact O-N 3.1Å; Q749-Y751 VanDerWaalsContact C-N 3.32Å
752	E	41.9	Very low	37.4	Very low	174 Å²	174	146.6 Å²	146.6	81%	0.813	74%	0.738	S	S	*	*			trans	-106.8	2.5	-176.7	-73.7	-146.8	151.7	0	0	116.1	R754	E752-R754 PolarHBondContact O-N 3.17Å
753	V	34.2	Very low	36.5	Very low	109 Å²	109	143.5 Å²	143.5	66%	0.661	72%	0.721	S	S	*	*			trans	-87	96.4	-178.7	-172.6	0	0	0	0	111.4	F755	V753-F755 PolarHBondContact O-N 2.76Å
754	R	33.7	Very low	35.8	Very low	240 Å²	240	142.2 Å²	142.2	91%	0.906	72%	0.721	S	S	*	*			trans	-50.5	122.7	170.6	-71	177.3	-174.7	-173.9	0.8	112.8	E752	E752-R754 PolarHBondContact O-N 3.17Å
755	F	30.7	Very low	35.7	Very low	181 Å²	181	142.3 Å²	142.3	79%	0.794	71%	0.71	S	S	*	*			trans	-104.9	132.5	152.3	-82.4	-85	0	0	0	110.1	V753	V753-F755 PolarHBondContact O-N 2.76Å
756	P	32.5	Very low	35.1	Very low	100 Å²	100	140.8 Å²	140.8	65%	0.649	71%	0.71	S	S	*	*			trans	-75.5	159.9	-179.5	32.1	-33.6	0	0	0	112	I758	P756-I758 PolarHBondContact O-N 3.17Å
757	P	28.4	Very low	35	Very low	131 Å²	131	142.2 Å²	142.2	85%	0.851	71%	0.71	S	S	*	*			trans	-79.9	111.6	-168.7	32.2	-31.5	0	0	0	110.7
758	I	30.9	Very low	35	Very low	156 Å²	156	141.2 Å²	141.2	80%	0.8	71%	0.705	S	S	*	*			trans	-93.6	108.4	165	-61.6	178.2	0	0	0	108	P756 C760	P756-I758 PolarHBondContact O-N 3.17Å; I758-C760 PolarHBondContact O-N 3.25Å
759	K	26.1	Very low	35.2	Very low	202 Å²	202	140.5 Å²	140.5	88%	0.878	70%	0.699	S	S	*	*			trans	-59.4	113.9	163.3	-86	175.8	171.2	174.2	0	109.4
760	C	29.1	Very low	35.1	Very low	123 Å²	123	142 Å²	142	83%	0.831	70%	0.7	S	S	*	*			trans	-142.3	100.2	146.6	-92	0	0	0	0	109.2	I758	I758-C760 PolarHBondContact O-N 3.25Å
761	R	28.2	Very low	35.1	Very low	229 Å²	229	143 Å²	143	86%	0.864	70%	0.703	S	S	*	*			trans	-48.7	135.2	157.1	-125.4	-176.8	-175.6	-165.9	-0.6	108.3
762	I	30	Very low	35.6	Very low	128 Å²	128	138.7 Å²	138.7	66%	0.656	69%	0.69	S	S	*	*				174.1	130.3	81.6	-97.3	146.4	0	0	0	109.8
763	D	34.8	Very low	36	Very low	81 Å²	81	135.1 Å²	135.1	43%	0.433	68%	0.676	S	S	.	*			trans	53.9	79.8	135.5	-51.2	-30.2	0	0	0	122.8	A766 Q767	D763-A766 HydrophobicContact CB-CB 4.46Å; D763-A766 WeakPolarHBondContact OD1-CB 3.29Å; D763-Q767 HydrophobicContact CB-CG 4.25Å
764	L	34.4	Very low	36.8	Very low	133 Å²	133	133.7 Å²	133.7	70%	0.696	66%	0.664	S	S	*	*	S	Bend	trans	-122	-36.3	146.9	-123.1	94.3	0	0	0	112.9	Q767 L768	L764-Q767 PolarHBondContact O-N 2.03Å; L764-L768 PolarHBondContact O-N 2.9Å; L764-L768 VanDerWaalsContact O-N 3.08Å
765	V	38.6	Very low	37.6	Very low	109 Å²	109	127.1 Å²	127.1	66%	0.661	65%	0.646	S	S	*	*	H	α-helix	trans	-74.3	-33.1	175.5	-175.8	0	0	0	0	111.1	M769	V765-M769 HydrophobicContact CG1-SD 4.32Å; V765-M769 WeakPolarHBondContact O-CB 3.39Å; V765-M769 WeakPolarHBondContact O-CG 3.49Å; V765-M769 PolarHBondContact O-N 3Å
766	A	38.1	Very low	38.5	Very low	48 Å²	48	122.4 Å²	122.4	40%	0.397	63%	0.629	S	S	.	*	H	α-helix	trans	-70.7	-33.6	172.3	0	0	0	0	0	112.5	D763 M769 Y770	D763-A766 HydrophobicContact CB-CB 4.46Å; D763-A766 WeakPolarHBondContact OD1-CB 3.29Å; A766-M769 PolarHBondContact O-N 3.23Å; A766-Y770 VanDerWaalsContact O-CB 3.23Å; A766-Y770 WeakPolarHBondContact O-CB 2.97Å; A766-Y770 PolarHBondContact O-N 2.82Å
767	Q	38.9	Very low	39.3	Very low	119 Å²	119	120.3 Å²	120.3	56%	0.556	62%	0.617	S	S	*	*	H	α-helix	trans	-71.3	-36.7	174.4	-80.1	-177.1	-0.3	0	0	112.4	D763 L764 Y770 M771	D763-Q767 HydrophobicContact CB-CG 4.25Å; L764-Q767 PolarHBondContact O-N 2.03Å; Q767-Y770 PolarHBondContact O-N 2.7Å; Q767-M771 WeakPolarHBondContact O-CB 3.06Å; Q767-M771 VanDerWaalsContact O-CG 3.27Å; Q767-M771 WeakPolarHBondContact O-CG 3.31Å; Q767-M771 PolarHBondContact O-N 2.96Å
768	L	39.3	Very low	40.2	Very low	122 Å²	122	119.6 Å²	119.6	64%	0.639	60%	0.601	S	S	*	*	H	α-helix	trans	-69.1	-35.6	173	-76.7	162.7	0	0	0	112	L764 Q772	L764-L768 PolarHBondContact O-N 2.9Å; L764-L768 VanDerWaalsContact O-N 3.08Å; L768-Q772 WeakPolarHBondContact O-CB 3.31Å; L768-Q772 PolarHBondContact O-N 3.43Å
769	M	44	Very low	40.9	Very low	122 Å²	122	116.6 Å²	116.6	60%	0.601	59%	0.586	S	S	*	*	H	α-helix	trans	-71.3	-35.9	171.4	-69.1	179.9	108.3	0	0	112.2	V765 A766 Q772 I773	V765-M769 HydrophobicContact CG1-SD 4.32Å; V765-M769 WeakPolarHBondContact O-CB 3.39Å; V765-M769 WeakPolarHBondContact O-CG 3.49Å; V765-M769 PolarHBondContact O-N 3Å; A766-M769 PolarHBondContact O-N 3.23Å; M769-Q772 PolarHBondContact O-N 2.04Å; M769-I773 WeakPolarHBondContact O-CB 3.36Å; M769-I773 WeakPolarHBondContact O-CD1 3.48Å; M769-I773 WeakPolarHBondContact O-CG1 3.16Å; M769-I773 PolarHBondContact O-N 3.22Å
770	Y	42.8	Very low	41.7	Very low	157 Å²	157	111.7 Å²	111.7	62%	0.616	57%	0.57	S	S	*	*	H	α-helix	trans	-70.6	-35.5	176.4	-148.6	-94.9	0	0	0	112	A766 Q767 I773 L774	A766-Y770 VanDerWaalsContact O-CB 3.23Å; A766-Y770 WeakPolarHBondContact O-CB 2.97Å; A766-Y770 PolarHBondContact O-N 2.82Å; Q767-Y770 PolarHBondContact O-N 2.7Å; Y770-I773 PolarHBondContact O-N 3.34Å; Y770-L774 HydrophobicContact CD1-CD1 3.63Å; Y770-L774 HydrophobicContact CD1-CG 4.02Å; Y770-L774 HydrophobicContact CE1-CD1 3.84Å; Y770-L774 HydrophobicContact CE1-CD2 4.49Å; Y770-L774 HydrophobicContact CE1-CG 4.13Å; Y770-L774 WeakPolarHBondContact O-CB 3.3Å; Y770-L774 VanDerWaalsContact O-CG 3.31Å; Y770-L774 WeakPolarHBondContact O-CG 3.2Å; Y770-L774 PolarHBondContact O-N 3.23Å
771	M	44.1	Very low	42.3	Very low	134 Å²	134	111.8 Å²	111.8	66%	0.66	56%	0.558	S	S	*	*	H	α-helix	trans	-68.1	-38.1	171	-73.4	-63.7	-154.4	0	0	111.7	Q767 L774 L775	Q767-M771 WeakPolarHBondContact O-CB 3.06Å; Q767-M771 VanDerWaalsContact O-CG 3.27Å; Q767-M771 WeakPolarHBondContact O-CG 3.31Å; Q767-M771 PolarHBondContact O-N 2.96Å; M771-L774 PolarHBondContact O-N 2.79Å; M771-L775 VanDerWaalsContact O-CB 3.23Å; M771-L775 WeakPolarHBondContact O-CB 3.32Å; M771-L775 PolarHBondContact O-N 3.37Å
772	Q	47.6	Very low	42.7	Very low	114 Å²	114	104.2 Å²	104.2	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-68	-34.8	173.7	-157.7	70.8	14	0	0	112	L768 M769 N776	L768-Q772 WeakPolarHBondContact O-CB 3.31Å; L768-Q772 PolarHBondContact O-N 3.43Å; M769-Q772 PolarHBondContact O-N 2.04Å; Q772-N776 VanDerWaalsContact O-CB 3.31Å; Q772-N776 WeakPolarHBondContact O-CB 3.15Å; Q772-N776 VanDerWaalsContact O-CG 3.3Å; Q772-N776 PolarHBondContact O-N 2.05Å; Q772-N776 PolarHBondContact O-ND2 2.95Å
773	I	50.7	Low	43.1	Very low	99 Å²	99	104.8 Å²	104.8	51%	0.508	53%	0.534	S	S	.	.	H	α-helix	trans	-72.2	-42.3	175.4	-69.3	162	0	0	0	110.8	M769 Y770 N776 S777	M769-I773 WeakPolarHBondContact O-CB 3.36Å; M769-I773 WeakPolarHBondContact O-CD1 3.48Å; M769-I773 WeakPolarHBondContact O-CG1 3.16Å; M769-I773 PolarHBondContact O-N 3.22Å; Y770-I773 PolarHBondContact O-N 3.34Å; I773-N776 PolarHBondContact O-N 3.41Å; I773-S777 WeakPolarHBondContact O-CB 3.05Å; I773-S777 PolarHBondContact O-N 2.88Å; I773-S777 PolarHBondContact O-OG 2.86Å
774	L	50.2	Low	43.4	Very low	80 Å²	80	106.9 Å²	106.9	42%	0.419	55%	0.545	S	S	.	.	H	α-helix	trans	-66.8	-37.1	174.7	-75.5	171.5	0	0	0	112.2	Y770 M771 S777 F778	Y770-L774 HydrophobicContact CD1-CD1 3.63Å; Y770-L774 HydrophobicContact CD1-CG 4.02Å; Y770-L774 HydrophobicContact CE1-CD1 3.84Å; Y770-L774 HydrophobicContact CE1-CD2 4.49Å; Y770-L774 HydrophobicContact CE1-CG 4.13Å; Y770-L774 WeakPolarHBondContact O-CB 3.3Å; Y770-L774 VanDerWaalsContact O-CG 3.31Å; Y770-L774 WeakPolarHBondContact O-CG 3.2Å; Y770-L774 PolarHBondContact O-N 3.23Å; M771-L774 PolarHBondContact O-N 2.79Å; L774-S777 PolarHBondContact O-N 2.8Å; L774-F778 WeakPolarHBondContact O-CB 3.4Å; L774-F778 PolarHBondContact O-N 3.46Å
775	L	50	Low	43.8	Very low	101 Å²	101	107 Å²	107	53%	0.529	55%	0.545	S	S	.	.	H	α-helix	trans	-66.7	-40.7	174.7	-156.7	81.1	0	0	0	111.2	M771 F778 L779	M771-L775 VanDerWaalsContact O-CB 3.23Å; M771-L775 WeakPolarHBondContact O-CB 3.32Å; M771-L775 PolarHBondContact O-N 3.37Å; L775-F778 PolarHBondContact O-N 2.87Å; L775-L779 HydrophobicContact CG-CD1 4.44Å; L775-L779 WeakPolarHBondContact O-CB 3.5Å; L775-L779 WeakPolarHBondContact O-CD1 3.3Å; L775-L779 WeakPolarHBondContact O-CG 3.16Å; L775-L779 PolarHBondContact O-N 3.37Å
776	N	49.1	Very low	43.7	Very low	82 Å²	82	108.3 Å²	108.3	44%	0.439	54%	0.542	S	S	.	.	H	α-helix	trans	-70.3	-32.1	173.8	-78.4	-48.6	0	0	0	112.9	Q772 I773 N780	Q772-N776 VanDerWaalsContact O-CB 3.31Å; Q772-N776 WeakPolarHBondContact O-CB 3.15Å; Q772-N776 VanDerWaalsContact O-CG 3.3Å; Q772-N776 PolarHBondContact O-N 2.05Å; Q772-N776 PolarHBondContact O-ND2 2.95Å; I773-N776 PolarHBondContact O-N 3.41Å; N776-N780 VanDerWaalsContact O-CB 3.29Å; N776-N780 WeakPolarHBondContact O-CB 3.35Å; N776-N780 PolarHBondContact O-N 3.44Å; N776-N780 PolarHBondContact O-ND2 3.33Å
777	S	50.7	Low	43.5	Very low	57 Å²	57	113.1 Å²	113.1	40%	0.399	57%	0.571	S	S	.	*	H	α-helix	trans	-73.9	-35.7	172.6	-79.6	0	0	0	0	112.7	I773 L774 N780 Q781	I773-S777 WeakPolarHBondContact O-CB 3.05Å; I773-S777 PolarHBondContact O-N 2.88Å; I773-S777 PolarHBondContact O-OG 2.86Å; L774-S777 PolarHBondContact O-N 2.8Å; S777-N780 PolarHBondContact O-N 3.21Å; S777-Q781 WeakPolarHBondContact O-CB 3.14Å; S777-Q781 WeakPolarHBondContact O-CG 3.06Å; S777-Q781 PolarHBondContact O-N 2.74Å
778	F	46.2	Very low	43.7	Very low	115 Å²	115	112.8 Å²	112.8	50%	0.504	57%	0.572	S	S	.	*	H	α-helix	trans	-67.8	-42.3	171.8	-113.9	-92.1	0	0	0	111.1	F698 L774 L775 N780 Q781 C782	F698-F778 HydrophobicContact CZ-CZ 4.32Å; L774-F778 WeakPolarHBondContact O-CB 3.4Å; L774-F778 PolarHBondContact O-N 3.46Å; L775-F778 PolarHBondContact O-N 2.87Å; F778-N780 VanDerWaalsContact C-N 3.33Å; F778-N780 PolarHBondContact O-N 3.41Å; F778-Q781 PolarHBondContact O-N 3.38Å; F778-C782 WeakPolarHBondContact O-CB 3.35Å; F778-C782 PolarHBondContact O-N 3.22Å; F778-C782 PolarHBondContact O-SG 2.71Å
779	L	47	Very low	44	Very low	93 Å²	93	112.3 Å²	112.3	49%	0.487	57%	0.568	S	S	.	*	H	α-helix	trans	-64.1	-37.3	174.2	-74.2	164.5	0	0	0	111.5	L775 Y783	L775-L779 HydrophobicContact CG-CD1 4.44Å; L775-L779 WeakPolarHBondContact O-CB 3.5Å; L775-L779 WeakPolarHBondContact O-CD1 3.3Å; L775-L779 WeakPolarHBondContact O-CG 3.16Å; L775-L779 PolarHBondContact O-N 3.37Å; L779-Y783 WeakPolarHBondContact O-CB 3.38Å; L779-Y783 PolarHBondContact O-N 3.49Å
780	N	41.9	Very low	44	Very low	100 Å²	100	111.8 Å²	111.8	54%	0.535	57%	0.567	S	S	.	*	H	α-helix	trans	-74.5	-30.5	174.4	-91.2	-38.3	0	0	0	114.5	N776 S777 F778 N784	N776-N780 VanDerWaalsContact O-CB 3.29Å; N776-N780 WeakPolarHBondContact O-CB 3.35Å; N776-N780 PolarHBondContact O-N 3.44Å; N776-N780 PolarHBondContact O-ND2 3.33Å; S777-N780 PolarHBondContact O-N 3.21Å; F778-N780 VanDerWaalsContact C-N 3.33Å; F778-N780 PolarHBondContact O-N 3.41Å; N780-N784 PolarHBondContact O-N 3.19Å; N780-N784 VanDerWaalsContact O-N 3.16Å; N780-N784 PolarHBondContact O-ND2 3.3Å
781	Q	41.8	Very low	44	Very low	124 Å²	124	109.1 Å²	109.1	58%	0.579	56%	0.564	S	S	*	*	H	α-helix	trans	-76.6	-35.3	173.4	-79.3	-177.7	1.4	0	0	111.8	S777 F778 Y783 N784 I785	S777-Q781 WeakPolarHBondContact O-CB 3.14Å; S777-Q781 WeakPolarHBondContact O-CG 3.06Å; S777-Q781 PolarHBondContact O-N 2.74Å; F778-Q781 PolarHBondContact O-N 3.38Å; Q781-Y783 VanDerWaalsContact C-N 3.29Å; Q781-Y783 PolarHBondContact O-N 2.78Å; Q781-N784 PolarHBondContact O-N 3.15Å; Q781-I785 WeakPolarHBondContact O-CD1 3.13Å; Q781-I785 WeakPolarHBondContact O-CG1 3.22Å; Q781-I785 PolarHBondContact O-N 3.07Å
782	C	36.5	Very low	44	Very low	71 Å²	71	107.6 Å²	107.6	48%	0.48	56%	0.558	S	S	.	*	H	α-helix	trans	-67.7	-29.8	170.1	-71.1	0	0	0	0	112.3	F778	F778-C782 WeakPolarHBondContact O-CB 3.35Å; F778-C782 PolarHBondContact O-N 3.22Å; F778-C782 PolarHBondContact O-SG 2.71Å
783	Y	38.5	Very low	43.8	Very low	139 Å²	139	107.1 Å²	107.1	55%	0.545	56%	0.559	S	S	.	*	H	α-helix	trans	-74.2	-30.8	174.9	-148.8	-94.9	0	0	0	112.8	L779 Q781	L779-Y783 WeakPolarHBondContact O-CB 3.38Å; L779-Y783 PolarHBondContact O-N 3.49Å; Q781-Y783 VanDerWaalsContact C-N 3.29Å; Q781-Y783 PolarHBondContact O-N 2.78Å
784	N	41.1	Very low	43.3	Very low	125 Å²	125	107.7 Å²	107.7	67%	0.668	56%	0.563	S	S	*	*	H	α-helix	trans	-86.6	-9.1	177.8	-84.8	-67.4	0	0	0	115.1	N780 Q781	N780-N784 PolarHBondContact O-N 3.19Å; N780-N784 VanDerWaalsContact O-N 3.16Å; N780-N784 PolarHBondContact O-ND2 3.3Å; Q781-N784 PolarHBondContact O-N 3.15Å
785	I	43.3	Very low	42.8	Very low	136 Å²	136	109.8 Å²	109.8	70%	0.697	57%	0.574	S	S	*	*	S	Bend	trans	-96.5	-4.4	174.4	-66.3	167.7	0	0	0	111.2	Q781	Q781-I785 WeakPolarHBondContact O-CD1 3.13Å; Q781-I785 WeakPolarHBondContact O-CG1 3.22Å; Q781-I785 PolarHBondContact O-N 3.07Å
786	F	35.4	Very low	42.2	Very low	137 Å²	137	110.6 Å²	110.6	60%	0.601	58%	0.578	S	S	*	*			trans	-122.8	-0.6	-175	-96	-90.7	0	0	0	115.7	K10	K10-F786 HydrophobicContact CD-CE1 4.09Å; K10-F786 HydrophobicContact CG-CE1 4.21Å
787	C	34.4	Very low	41.5	Very low	148 Å²	148	113.2 Å²	113.2	100%	1	59%	0.591	S	S	*	*			trans	-98.4	0	158.1	-83.8	0	0	0	0	108

Retrieved 787 of 787 residues in 111.4 ms (Link to these results)

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