A0A077Z0W7_TRITR Loading...

WAP domain containing protein, SLPI-like

AlphaFold DB , UniProt , Accession A0A077Z0W7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 297 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	61.3	Low	61.6	Low	195 Å²	195	116.7 Å²	116.7	96%	0.961	63%	0.629	S	S	*	*				0	-42.3	0	-66.7	-64	-147.5	0	0	110.6	S3 L4	M1-S3 PolarHBondContact O-N 2.79Å; M1-L4 PolarHBondContact O-N 3.38Å
2	D	66.6	Low	61.4	Low	116 Å²	116	116.8 Å²	116.8	62%	0.62	63%	0.628	S	S	*	*	H	α-helix	trans	-69.5	-37.5	-162.6	-45.9	-83.3	0	0	0	113.6	L4 L5 I6	D2-L4 VanDerWaalsContact C-N 3.28Å; D2-L4 PolarHBondContact O-N 2.77Å; D2-L5 WeakPolarHBondContact O-CB 3.41Å; D2-L5 PolarHBondContact O-N 3.18Å; D2-I6 VanDerWaalsContact O-CG1 3.32Å; D2-I6 WeakPolarHBondContact O-CG1 3.07Å; D2-I6 PolarHBondContact O-N 2.98Å
3	S	64.6	Low	61.2	Low	98 Å²	98	117.8 Å²	117.8	69%	0.685	63%	0.631	S	S	*	*	H	α-helix	trans	-61.4	-33.6	177.2	-47.1	0	0	0	0	113.5	M1 I6 S7	M1-S3 PolarHBondContact O-N 2.79Å; S3-I6 PolarHBondContact O-N 3.46Å; S3-S7 PolarHBondContact O-N 3.28Å
4	L	61.8	Low	60.5	Low	142 Å²	142	115.9 Å²	115.9	74%	0.743	63%	0.63	S	S	*	*	H	α-helix	trans	-73.3	-38.4	177.7	-152.3	87.6	0	0	0	111.2	M1 D2 I6 S7 L8	M1-L4 PolarHBondContact O-N 3.38Å; D2-L4 VanDerWaalsContact C-N 3.28Å; D2-L4 PolarHBondContact O-N 2.77Å; L4-I6 VanDerWaalsContact C-N 3.33Å; L4-S7 PolarHBondContact O-N 3.33Å; L4-L8 WeakPolarHBondContact O-CB 3.48Å; L4-L8 PolarHBondContact O-N 3.05Å
5	L	61.2	Low	59.9	Low	94 Å²	94	113.3 Å²	113.3	49%	0.492	63%	0.631	S	S	.	*	H	α-helix	trans	-66.1	-34.1	173.5	-83.4	159.6	0	0	0	112.3	D2 K9	D2-L5 WeakPolarHBondContact O-CB 3.41Å; D2-L5 PolarHBondContact O-N 3.18Å; L5-K9 WeakPolarHBondContact O-CB 3.26Å; L5-K9 VanDerWaalsContact O-CG 3.26Å; L5-K9 WeakPolarHBondContact O-CG 3.4Å; L5-K9 PolarHBondContact O-N 2.84Å
6	I	61.3	Low	59	Low	106 Å²	106	117.6 Å²	117.6	54%	0.544	64%	0.644	S	S	.	*	H	α-helix	trans	-67.5	-47.8	173.2	-67.1	162.3	0	0	0	110	D2 S3 L4 L8 K9 V10	D2-I6 VanDerWaalsContact O-CG1 3.32Å; D2-I6 WeakPolarHBondContact O-CG1 3.07Å; D2-I6 PolarHBondContact O-N 2.98Å; S3-I6 PolarHBondContact O-N 3.46Å; L4-I6 VanDerWaalsContact C-N 3.33Å; I6-L8 VanDerWaalsContact C-N 3.34Å; I6-L8 PolarHBondContact O-N 2.82Å; I6-K9 PolarHBondContact O-N 3.18Å; I6-V10 HydrophobicContact CG2-CG2 4.33Å; I6-V10 WeakPolarHBondContact O-CB 3.41Å; I6-V10 VanDerWaalsContact O-CG2 3.31Å; I6-V10 WeakPolarHBondContact O-CG2 3.42Å; I6-V10 PolarHBondContact O-N 2.9Å
7	S	60.7	Low	58.2	Low	80 Å²	80	117.8 Å²	117.8	56%	0.559	65%	0.65	S	S	*	*	H	α-helix	trans	-57.9	-43.3	174.5	-76.8	0	0	0	0	112.8	S3 L4 V10 L11	S3-S7 PolarHBondContact O-N 3.28Å; L4-S7 PolarHBondContact O-N 3.33Å; S7-V10 PolarHBondContact O-N 2.93Å; S7-L11 WeakPolarHBondContact O-CB 3.45Å; S7-L11 PolarHBondContact O-N 3.29Å
8	L	60.1	Low	57.3	Low	105 Å²	105	114.7 Å²	114.7	55%	0.55	65%	0.649	S	S	.	*	H	α-helix	trans	-66.8	-37.6	179.1	-164.7	71	0	0	0	112.3	L4 I6 L11 L12	L4-L8 WeakPolarHBondContact O-CB 3.48Å; L4-L8 PolarHBondContact O-N 3.05Å; I6-L8 VanDerWaalsContact C-N 3.34Å; I6-L8 PolarHBondContact O-N 2.82Å; L8-L11 PolarHBondContact O-N 3.46Å; L8-L12 WeakPolarHBondContact O-CG 3.45Å; L8-L12 PolarHBondContact O-N 3.14Å; L8-L12 VanDerWaalsContact O-N 3.16Å
9	K	62.2	Low	56.8	Low	135 Å²	135	113.6 Å²	113.6	59%	0.587	65%	0.645	S	S	*	*	H	α-helix	trans	-68.2	-40.9	173.8	-75.5	176.3	178	-174.3	0	112.3	L5 I6 L11 L12 I13	L5-K9 WeakPolarHBondContact O-CB 3.26Å; L5-K9 VanDerWaalsContact O-CG 3.26Å; L5-K9 WeakPolarHBondContact O-CG 3.4Å; L5-K9 PolarHBondContact O-N 2.84Å; I6-K9 PolarHBondContact O-N 3.18Å; K9-L11 VanDerWaalsContact C-N 3.33Å; K9-L11 PolarHBondContact O-N 3.17Å; K9-L12 PolarHBondContact O-N 2.96Å; K9-I13 WeakPolarHBondContact O-CD1 3.31Å; K9-I13 WeakPolarHBondContact O-CG1 3.48Å; K9-I13 PolarHBondContact O-N 2.95Å
10	V	60.5	Low	56.6	Low	82 Å²	82	109 Å²	109	50%	0.497	62%	0.624	S	S	.	*	H	α-helix	trans	-63.2	-40.4	175.1	170.8	0	0	0	0	110.8	I6 S7 L12 I13 C14	I6-V10 HydrophobicContact CG2-CG2 4.33Å; I6-V10 WeakPolarHBondContact O-CB 3.41Å; I6-V10 VanDerWaalsContact O-CG2 3.31Å; I6-V10 WeakPolarHBondContact O-CG2 3.42Å; I6-V10 PolarHBondContact O-N 2.9Å; S7-V10 PolarHBondContact O-N 2.93Å; V10-L12 VanDerWaalsContact C-N 3.28Å; V10-L12 PolarHBondContact O-N 3.33Å; V10-I13 PolarHBondContact O-N 2.89Å; V10-C14 PolarHBondContact O-N 3.06Å
11	L	57	Low	57.1	Low	131 Å²	131	110.8 Å²	110.8	69%	0.686	63%	0.627	S	S	*	*	H	α-helix	trans	-61	-35.7	174.6	-142.3	81.5	0	0	0	112.7	S7 L8 K9	S7-L11 WeakPolarHBondContact O-CB 3.45Å; S7-L11 PolarHBondContact O-N 3.29Å; L8-L11 PolarHBondContact O-N 3.46Å; K9-L11 VanDerWaalsContact C-N 3.33Å; K9-L11 PolarHBondContact O-N 3.17Å
12	L	59.4	Low	57.6	Low	117 Å²	117	103.3 Å²	103.3	61%	0.613	59%	0.589	S	S	*	*	H	α-helix	trans	-78.3	-25.6	178.9	-79.8	163	0	0	0	114	L8 K9 V10	L8-L12 WeakPolarHBondContact O-CG 3.45Å; L8-L12 PolarHBondContact O-N 3.14Å; L8-L12 VanDerWaalsContact O-N 3.16Å; K9-L12 PolarHBondContact O-N 2.96Å; V10-L12 VanDerWaalsContact C-N 3.28Å; V10-L12 PolarHBondContact O-N 3.33Å
13	I	59.2	Low	57.6	Low	131 Å²	131	103.3 Å²	103.3	67%	0.672	60%	0.595	S	S	*	*	H	α-helix	trans	-78.6	-29	-179.5	-67.8	159.3	0	0	0	111.6	K9 V10 A15	K9-I13 WeakPolarHBondContact O-CD1 3.31Å; K9-I13 WeakPolarHBondContact O-CG1 3.48Å; K9-I13 PolarHBondContact O-N 2.95Å; V10-I13 PolarHBondContact O-N 2.89Å; I13-A15 VanDerWaalsContact C-N 3.35Å
14	C	50.7	Low	57.7	Low	91 Å²	91	99.7 Å²	99.7	62%	0.615	57%	0.573	S	S	*	*	S	Bend	trans	-82.1	-7.8	178.1	-64.4	0	0	0	0	114.5	V10 Q16	V10-C14 PolarHBondContact O-N 3.06Å; C14-Q16 VanDerWaalsContact C-N 3.28Å; C14-Q16 PolarHBondContact O-N 3.05Å
15	A	51.4	Low	58.4	Low	77 Å²	77	95 Å²	95	64%	0.636	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	18.4	-175	0	0	0	0	0	114.6	I13	I13-A15 VanDerWaalsContact C-N 3.35Å
16	Q	45.8	Very low	59.5	Low	181 Å²	181	92.9 Å²	92.9	85%	0.846	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	21.3	179.4	-60.6	-167.4	-10.6	0	0	113	C14	C14-Q16 VanDerWaalsContact C-N 3.28Å; C14-Q16 PolarHBondContact O-N 3.05Å
17	V	46.3	Very low	60.5	Low	122 Å²	122	89.8 Å²	89.8	74%	0.739	53%	0.528	S	S	*	.	S	Bend	trans	-81.9	127.8	170.3	-176.8	0	0	0	0	108.1	V19	V17-V19 PolarHBondContact O-N 3.28Å
18	G	41	Very low	61.3	Low	62 Å²	62	90.1 Å²	90.1	64%	0.639	53%	0.528	S	S	*	.			trans	-45	119.7	-163.8	0	0	0	0	0	115.4	G20	G18-G20 PolarHBondContact O-N 3.26Å
19	V	48.1	Very low	62.3	Low	93 Å²	93	88.2 Å²	88.2	56%	0.564	52%	0.521	S	S	*	.			trans	-76.8	102.7	174.7	178.6	0	0	0	0	108.8	V17 E21 V44	V17-V19 PolarHBondContact O-N 3.28Å; V19-E21 PolarHBondContact O-N 3.47Å; V19-V44 HydrophobicContact CG1-CG1 4.36Å
20	G	54.1	Low	63	Low	22 Å²	22	85.8 Å²	85.8	23%	0.227	52%	0.519	C	S	.	.			trans	69.4	24.4	151.7	0	0	0	0	0	118.5	G18 K22 D45 E46	G18-G20 PolarHBondContact O-N 3.26Å; G20-K22 PolarHBondContact O-N 2.84Å; G20-K22 VanDerWaalsContact O-N 3.16Å; G20-D45 VanDerWaalsContact O-CB 3.31Å; G20-D45 WeakPolarHBondContact O-CB 3.33Å; G20-E46 WeakPolarHBondContact CA-OE1 3.38Å
21	E	67.1	Low	63.9	Low	146 Å²	146	88.4 Å²	88.4	68%	0.682	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-61.2	117.7	178.9	-68.6	-173.1	-164.6	0	0	112.1	V19 D45	V19-E21 PolarHBondContact O-N 3.47Å; E21-D45 WeakPolarHBondContact CA-OD2 3.38Å
22	K	70.5	Confident	65	Low	38 Å²	38	84.9 Å²	84.9	17%	0.165	53%	0.533	C	S	.	.	P	Polyproline II helix	trans	-79.1	151	174.8	-75.3	169.5	179.3	169.1	0	111.1	G20 D45 C48 G50 E52 K53	G20-K22 PolarHBondContact O-N 2.84Å; G20-K22 VanDerWaalsContact O-N 3.16Å; K22-D45 HydrophobicContact CB-CB 4.25Å; K22-D45 HydrophobicContact CD-CB 4.08Å; K22-D45 WeakPolarHBondContact CE-O 3.29Å; K22-D45 HydrophobicContact CG-CB 4.07Å; K22-D45 PolarHBondContact N-OD2 2.83Å; K22-D45 PolarHBondContact NZ-O 2.92Å; K22-C48 PolarHBondContact NZ-O 3.2Å; K22-G50 WeakPolarHBondContact CE-O 3.47Å; K22-G50 PolarHBondContact NZ-O 3.31Å; K22-G50 VanDerWaalsContact NZ-O 3.09Å; K22-E52 WeakPolarHBondContact CD-O 2.99Å; K22-E52 PolarHBondContact NZ-O 2.95Å; K22-K53 HydrophobicContact CB-CG 4.07Å; K22-K53 PolarHBondContact O-NZ 3.43Å
23	P	68	Low	66.1	Low	116 Å²	116	88 Å²	88	75%	0.753	54%	0.544	S	S	*	.	S	Bend	trans	-62.9	149.3	-179.7	26.5	-35.2	0	0	0	112.8
24	G	66.6	Low	67.1	Low	22 Å²	22	86.7 Å²	86.7	23%	0.227	54%	0.537	C	S	.	.	S	Bend	trans	96.3	-176.4	-179.2	0	0	0	0	0	114.1	K53	G24-K53 WeakPolarHBondContact O-CD 3.31Å; G24-K53 VanDerWaalsContact O-CE 3.22Å; G24-K53 WeakPolarHBondContact O-CE 3.3Å
25	L	76.6	Confident	68.7	Low	45 Å²	45	84.1 Å²	84.1	24%	0.236	52%	0.521	C	S	.	.	B	Isolated β-bridge	trans	-116.9	149.1	-178	-73.8	-178.6	0	0	0	112.2	P66 E67 R72	L25-P66 CarbonylContact O-C 3.54Å; L25-P66 WeakPolarHBondContact O-CA 3.08Å; L25-P66 WeakPolarHBondContact O-CB 3.38Å; L25-E67 PolarHBondContact O-N 3.28Å; L25-R72 HydrophobicContact CD1-CB 3.7Å; L25-R72 HydrophobicContact CD1-CG 3.8Å; L25-R72 WeakPolarHBondContact CD1-O 3.39Å
26	C	83.4	Confident	70.1	Confident	49 Å²	49	86.7 Å²	86.7	33%	0.331	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-62.5	137.8	162	-71.1	0	0	0	0	111	C55	C26-C55 WeakPolarHBondContact CA-SG 3.49Å; C26-C55 HydrophobicContact CB-CB 3.65Å; C26-C55 WeakPolarHBondContact CB-SG 3.47Å; C26-C55 WeakPolarHBondContact SG-CA 2.99Å; C26-C55 WeakPolarHBondContact SG-CB 3.01Å; C26-C55 CovalentContact SG-SG 2.03Å; C26-C55 PolarHBondContact SG-SG 3.19Å
27	P	81.5	Confident	72.1	Confident	41 Å²	41	84.6 Å²	84.6	27%	0.266	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-61.8	151.2	172.9	27.9	-35.2	0	0	0	111	T29 L64 E67	P27-T29 PolarHBondContact O-N 3.32Å; P27-L64 HydrophobicContact CG-CB 4.22Å; P27-L64 HydrophobicContact CG-CD1 3.57Å; P27-L64 HydrophobicContact CG-CG 4.5Å; P27-E67 HydrophobicContact CB-CG 4.01Å
28	P	77.4	Confident	73.9	Confident	87 Å²	87	80.4 Å²	80.4	57%	0.565	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-63.7	122.7	-177.7	25.8	-34.2	0	0	0	111.1	E67	P28-E67 WeakPolarHBondContact CD-OE1 3.44Å
29	T	80.9	Confident	76.1	Confident	65 Å²	65	85.1 Å²	85.1	40%	0.399	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-60.2	129.1	173	-41.1	0	0	0	0	109.6	P27 Q56 L58	P27-T29 PolarHBondContact O-N 3.32Å; T29-Q56 PolarHBondContact OG1-O 3.09Å; T29-L58 HydrophobicContact CG2-CD2 4.01Å; T29-L58 HydrophobicContact CG2-CG 4.15Å
30	P	78.2	Confident	78.1	Confident	83 Å²	83	85.5 Å²	85.5	54%	0.539	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-63.3	148	176.7	25.7	-33.9	0	0	0	110.7	G32 L58	P30-G32 PolarHBondContact O-N 3.04Å; P30-L58 HydrophobicContact CG-CD1 4.07Å; P30-L58 HydrophobicContact CG-CG 4.4Å
31	P	78.4	Confident	79.9	Confident	138 Å²	138	91.8 Å²	91.8	90%	0.896	53%	0.529	S	S	*	.	S	Bend	trans	-59.1	128.3	176.1	-23	33.3	0	0	0	111.7
32	G	81.1	Confident	81.1	Confident	56 Å²	56	85 Å²	85	58%	0.577	50%	0.497	S	S	*	.	S	Bend	trans	172.1	173	178.8	0	0	0	0	0	111.5	P30 L58	P30-G32 PolarHBondContact O-N 3.04Å; G32-L58 WeakPolarHBondContact O-CD2 3.37Å
33	E	81.7	Confident	82.1	Confident	184 Å²	184	87.5 Å²	87.5	86%	0.86	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-84.7	145.9	168.8	-64.4	-175.6	166.5	0	0	109.7	S35	E33-S35 PolarHBondContact O-N 3.44Å
34	I	81.5	Confident	83	Confident	102 Å²	102	84.2 Å²	84.2	52%	0.523	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-65.9	129.4	171.9	-60.8	174.2	0	0	0	107.5	A38	I34-A38 HydrophobicContact CG2-CB 3.52Å
35	S	83.2	Confident	84	Confident	38 Å²	38	83.9 Å²	83.9	27%	0.266	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-55.1	138.7	179.4	-178.2	0	0	0	0	110.9	E33 D37 A38 L58	E33-S35 PolarHBondContact O-N 3.44Å; S35-D37 PolarHBondContact O-N 3.43Å; S35-D37 PolarHBondContact OG-N 3.48Å; S35-A38 WeakPolarHBondContact O-CB 3.41Å; S35-A38 PolarHBondContact O-N 3.36Å; S35-L58 WeakPolarHBondContact CB-O 3.43Å; S35-L58 PolarHBondContact N-O 3.42Å
36	P	81.9	Confident	84.5	Confident	131 Å²	131	87.6 Å²	87.6	85%	0.851	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.2	172.1	28	-35.7	0	0	0	112.7	A38	P36-A38 VanDerWaalsContact C-N 3.33Å
37	D	86.2	Confident	84.8	Confident	136 Å²	136	89.5 Å²	89.5	73%	0.727	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	10.3	174.5	-64.5	-60.5	0	0	0	113.3	S35	S35-D37 PolarHBondContact O-N 3.43Å; S35-D37 PolarHBondContact OG-N 3.48Å
38	A	84.3	Confident	85.1	Confident	34 Å²	34	87.9 Å²	87.9	28%	0.281	50%	0.499	S	S	.	.			trans	-59.3	138.4	-179.6	0	0	0	0	0	112.3	I34 S35 P36 L59	I34-A38 HydrophobicContact CG2-CB 3.52Å; S35-A38 WeakPolarHBondContact O-CB 3.41Å; S35-A38 PolarHBondContact O-N 3.36Å; P36-A38 VanDerWaalsContact C-N 3.33Å; A38-L59 CarbonylContact C-O 3.57Å; A38-L59 WeakPolarHBondContact CA-O 3.48Å; A38-L59 VanDerWaalsContact CB-C 3.46Å; A38-L59 WeakPolarHBondContact CB-O 3.26Å
39	K	87.8	Confident	85.6	Confident	161 Å²	161	87.9 Å²	87.9	70%	0.7	50%	0.499	S	S	*	.			trans	-136.7	132	179.1	-69.3	176.5	-174.3	170.9	0	109.5	E41 L59	K39-E41 PolarHBondContact O-N 3.22Å; K39-L59 PolarHBondContact N-O 3.15Å
40	D	90.6	Very high	85.8	Confident	102 Å²	102	88.1 Å²	88.1	55%	0.545	52%	0.515	S	S	.	.			trans	-80.2	116.6	173.1	-65.3	-14.8	0	0	0	108.8	G60 K61	D40-G60 WeakPolarHBondContact OD1-CA 3.23Å; D40-K61 CarbonylContact C-O 3.5Å; D40-K61 WeakPolarHBondContact CA-O 3.23Å; D40-K61 HydrophobicContact CB-CB 4.02Å; D40-K61 PolarHBondContact OD1-N 3.11Å
41	E	91.4	Very high	85.9	Confident	153 Å²	153	92.3 Å²	92.3	72%	0.715	52%	0.52	S	S	*	.	S	Bend	trans	-85.7	-19.7	172.6	-63.5	-176.6	176.3	0	0	111.7	K39 K61 I62	K39-E41 PolarHBondContact O-N 3.22Å; E41-K61 PolarHBondContact N-O 2.84Å; E41-I62 HydrophobicContact CB-CG2 4.24Å; E41-I62 HydrophobicContact CG-CG2 3.97Å
42	C	92.7	Very high	86.1	Confident	3 Å²	3	88.8 Å²	88.8	2%	0.02	49%	0.491	C	S	.	.			trans	-139.1	158	178.6	65	0	0	0	0	111	D47 C54 K61	C42-D47 HydrophobicContact CB-CB 3.96Å; C42-C54 HydrophobicContact CB-CB 3.8Å; C42-C54 WeakPolarHBondContact CB-SG 3.29Å; C42-C54 PolarHBondContact O-SG 3.42Å; C42-C54 VanDerWaalsContact O-SG 3.33Å; C42-C54 WeakPolarHBondContact SG-CA 3.22Å; C42-C54 WeakPolarHBondContact SG-CB 3.3Å; C42-C54 CovalentContact SG-SG 2.04Å; C42-C54 PolarHBondContact SG-SG 3.27Å; C42-K61 WeakPolarHBondContact O-CB 3.37Å
43	T	90.3	Very high	86.4	Confident	92 Å²	92	87 Å²	87	56%	0.564	47%	0.468	S	S	*	.	S	Bend	trans	-114.9	-38.8	175.6	67.6	0	0	0	0	112.8	D47 K61	T43-D47 WeakPolarHBondContact CA-OD2 3.47Å; T43-D47 WeakPolarHBondContact CB-OD2 3.49Å; T43-D47 PolarHBondContact N-OD2 3.37Å; T43-D47 PolarHBondContact OG1-OD2 3.07Å; T43-K61 PolarHBondContact O-NZ 2.9Å
44	V	87.1	Confident	86.8	Confident	47 Å²	47	79.1 Å²	79.1	29%	0.285	43%	0.433	S	S	.	.	S	Bend	trans	-132.4	162.8	177.7	-66.1	0	0	0	0	110.7	V19 E46 D47 C54	V19-V44 HydrophobicContact CG1-CG1 4.36Å; V44-E46 HydrophobicContact CG2-CB 4.11Å; V44-E46 PolarHBondContact O-N 2.95Å; V44-D47 WeakPolarHBondContact CG2-OD2 3.5Å; V44-D47 PolarHBondContact N-OD2 2.86Å; V44-D47 WeakPolarHBondContact O-CB 3.43Å; V44-D47 PolarHBondContact O-N 3.39Å; V44-D47 VanDerWaalsContact O-N 3.09Å; V44-C54 VanDerWaalsContact C-CB 3.42Å; V44-C54 WeakPolarHBondContact O-CB 3.39Å
45	D	87.4	Confident	87.2	Confident	15 Å²	15	74.3 Å²	74.3	8%	0.08	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-55.6	-32.7	177.9	-81.1	-3.8	0	0	0	113.4	G20 E21 K22 D47 C48 K53 C54	G20-D45 VanDerWaalsContact O-CB 3.31Å; G20-D45 WeakPolarHBondContact O-CB 3.33Å; E21-D45 WeakPolarHBondContact CA-OD2 3.38Å; K22-D45 HydrophobicContact CB-CB 4.25Å; K22-D45 HydrophobicContact CD-CB 4.08Å; K22-D45 WeakPolarHBondContact CE-O 3.29Å; K22-D45 HydrophobicContact CG-CB 4.07Å; K22-D45 PolarHBondContact N-OD2 2.83Å; K22-D45 PolarHBondContact NZ-O 2.92Å; D45-D47 VanDerWaalsContact C-N 3.26Å; D45-D47 PolarHBondContact O-N 3.3Å; D45-C48 WeakPolarHBondContact O-CB 3.31Å; D45-C48 PolarHBondContact O-N 3.26Å; D45-K53 VanDerWaalsContact OD1-CA 3.29Å; D45-K53 WeakPolarHBondContact OD1-CA 3Å; D45-K53 WeakPolarHBondContact OD1-CB 3.14Å; D45-K53 IonicContact OD1-NZ 2.66Å; D45-K53 IonicContact OD2-NZ 3.57Å; D45-K53 PolarHBondContact OD2-NZ 2.82Å; D45-C54 PolarHBondContact OD1-N 3.31Å
46	E	87.1	Confident	87.4	Confident	123 Å²	123	76.5 Å²	76.5	58%	0.575	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-65.8	-23.9	178.7	-57.6	-173.8	158	0	0	113.8	G20 V44 C48	G20-E46 WeakPolarHBondContact CA-OE1 3.38Å; V44-E46 HydrophobicContact CG2-CB 4.11Å; V44-E46 PolarHBondContact O-N 2.95Å; E46-C48 PolarHBondContact O-N 3.39Å
47	D	89.8	Confident	87.7	Confident	88 Å²	88	71.2 Å²	71.2	47%	0.471	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-68.4	-22.2	176	-62.6	-41	0	0	0	111.7	C42 T43 V44 D45	C42-D47 HydrophobicContact CB-CB 3.96Å; T43-D47 WeakPolarHBondContact CA-OD2 3.47Å; T43-D47 WeakPolarHBondContact CB-OD2 3.49Å; T43-D47 PolarHBondContact N-OD2 3.37Å; T43-D47 PolarHBondContact OG1-OD2 3.07Å; V44-D47 WeakPolarHBondContact CG2-OD2 3.5Å; V44-D47 PolarHBondContact N-OD2 2.86Å; V44-D47 WeakPolarHBondContact O-CB 3.43Å; V44-D47 PolarHBondContact O-N 3.39Å; V44-D47 VanDerWaalsContact O-N 3.09Å; D45-D47 VanDerWaalsContact C-N 3.26Å; D45-D47 PolarHBondContact O-N 3.3Å
48	C	88.3	Confident	87.8	Confident	7 Å²	7	66.9 Å²	66.9	5%	0.047	36%	0.356	C	S	.	.	S	Bend	trans	-86.7	147.2	-177.3	-63.7	0	0	0	0	112.4	K22 D45 E46 E52 C63	K22-C48 PolarHBondContact NZ-O 3.2Å; D45-C48 WeakPolarHBondContact O-CB 3.31Å; D45-C48 PolarHBondContact O-N 3.26Å; E46-C48 PolarHBondContact O-N 3.39Å; C48-E52 HydrophobicContact CB-CB 3.96Å; C48-E52 VanDerWaalsContact CB-O 3.29Å; C48-E52 WeakPolarHBondContact CB-O 3.5Å; C48-C63 WeakPolarHBondContact CA-SG 3.45Å; C48-C63 HydrophobicContact CB-CB 3.62Å; C48-C63 WeakPolarHBondContact CB-SG 3.1Å; C48-C63 WeakPolarHBondContact SG-CA 3.32Å; C48-C63 WeakPolarHBondContact SG-CB 3.22Å; C48-C63 CovalentContact SG-SG 2.03Å; C48-C63 PolarHBondContact SG-SG 2.8Å
49	P	88.6	Confident	88	Confident	87 Å²	87	70.8 Å²	70.8	57%	0.565	37%	0.372	S	S	*	.	S	Bend	trans	-71.2	148.4	177.4	30	-34.2	0	0	0	112.2	R51 E52	P49-R51 PolarHBondContact O-N 3.48Å; P49-E52 WeakPolarHBondContact CD-OE2 3.39Å; P49-E52 VanDerWaalsContact CG-OE2 3.31Å; P49-E52 WeakPolarHBondContact CG-OE2 3.45Å; P49-E52 PolarHBondContact O-N 3.31Å
50	G	84.9	Confident	88	Confident	70 Å²	70	63.1 Å²	63.1	72%	0.722	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	-123.6	172.1	0	0	0	0	0	114.1	K22	K22-G50 WeakPolarHBondContact CE-O 3.47Å; K22-G50 PolarHBondContact NZ-O 3.31Å; K22-G50 VanDerWaalsContact NZ-O 3.09Å
51	R	79	Confident	88	Confident	171 Å²	171	61.5 Å²	61.5	65%	0.645	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-3.4	-176.3	67.1	176.7	62.5	167.2	-3.4	114.9	P49 E65 P66	P49-R51 PolarHBondContact O-N 3.48Å; R51-E65 WeakPolarHBondContact CD-OE1 3.16Å; R51-E65 IonicContact NH1-OE1 2.72Å; R51-P66 VanDerWaalsContact O-CD 3.3Å; R51-P66 WeakPolarHBondContact O-CD 3.18Å
52	E	84.2	Confident	88	Confident	64 Å²	64	56.1 Å²	56.1	30%	0.299	30%	0.302	S	S	.	.			trans	-70	142.6	-174.6	-64	178.7	164.3	0	0	111.4	K22 C48 P49 C63 L64	K22-E52 WeakPolarHBondContact CD-O 2.99Å; K22-E52 PolarHBondContact NZ-O 2.95Å; C48-E52 HydrophobicContact CB-CB 3.96Å; C48-E52 VanDerWaalsContact CB-O 3.29Å; C48-E52 WeakPolarHBondContact CB-O 3.5Å; P49-E52 WeakPolarHBondContact CD-OE2 3.39Å; P49-E52 VanDerWaalsContact CG-OE2 3.31Å; P49-E52 WeakPolarHBondContact CG-OE2 3.45Å; P49-E52 PolarHBondContact O-N 3.31Å; E52-C63 HydrophobicContact CB-CB 4.2Å; E52-C63 WeakPolarHBondContact OE2-CB 3.37Å; E52-L64 CarbonylContact C-O 3.56Å; E52-L64 VanDerWaalsContact CA-O 3.29Å; E52-L64 WeakPolarHBondContact CA-O 3.32Å
53	K	86.9	Confident	88	Confident	19 Å²	19	57.4 Å²	57.4	8%	0.083	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	151.9	177.8	-68.8	-179.5	68.4	67.6	0	110.6	K22 G24 D45 C55 C63 L64 P66	K22-K53 HydrophobicContact CB-CG 4.07Å; K22-K53 PolarHBondContact O-NZ 3.43Å; G24-K53 WeakPolarHBondContact O-CD 3.31Å; G24-K53 VanDerWaalsContact O-CE 3.22Å; G24-K53 WeakPolarHBondContact O-CE 3.3Å; D45-K53 VanDerWaalsContact OD1-CA 3.29Å; D45-K53 WeakPolarHBondContact OD1-CA 3Å; D45-K53 WeakPolarHBondContact OD1-CB 3.14Å; D45-K53 IonicContact OD1-NZ 2.66Å; D45-K53 IonicContact OD2-NZ 3.57Å; D45-K53 PolarHBondContact OD2-NZ 2.82Å; K53-C55 PolarHBondContact O-N 2.9Å; K53-C55 PolarHBondContact O-SG 2.86Å; K53-C55 VanDerWaalsContact O-SG 3.37Å; K53-C63 WeakPolarHBondContact O-CA 3.38Å; K53-L64 PolarHBondContact N-O 3.47Å; K53-L64 PolarHBondContact O-N 2.99Å; K53-P66 HydrophobicContact CD-CB 3.96Å; K53-P66 HydrophobicContact CG-CB 4.4Å
54	C	90.1	Very high	87.9	Confident	19 Å²	19	55.3 Å²	55.3	13%	0.128	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	101.5	177	-177.2	0	0	0	0	110.5	C42 V44 D45	C42-C54 HydrophobicContact CB-CB 3.8Å; C42-C54 WeakPolarHBondContact CB-SG 3.29Å; C42-C54 PolarHBondContact O-SG 3.42Å; C42-C54 VanDerWaalsContact O-SG 3.33Å; C42-C54 WeakPolarHBondContact SG-CA 3.22Å; C42-C54 WeakPolarHBondContact SG-CB 3.3Å; C42-C54 CovalentContact SG-SG 2.04Å; C42-C54 PolarHBondContact SG-SG 3.27Å; V44-C54 VanDerWaalsContact C-CB 3.42Å; V44-C54 WeakPolarHBondContact O-CB 3.39Å; D45-C54 PolarHBondContact OD1-N 3.31Å
55	C	89.4	Confident	87.7	Confident	1 Å²	1	59 Å²	59	1%	0.007	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	136.8	-162.9	-65.1	0	0	0	0	113.1	C26 K53 T57 K61 I62 L64	C26-C55 WeakPolarHBondContact CA-SG 3.49Å; C26-C55 HydrophobicContact CB-CB 3.65Å; C26-C55 WeakPolarHBondContact CB-SG 3.47Å; C26-C55 WeakPolarHBondContact SG-CA 2.99Å; C26-C55 WeakPolarHBondContact SG-CB 3.01Å; C26-C55 CovalentContact SG-SG 2.03Å; C26-C55 PolarHBondContact SG-SG 3.19Å; K53-C55 PolarHBondContact O-N 2.9Å; K53-C55 PolarHBondContact O-SG 2.86Å; K53-C55 VanDerWaalsContact O-SG 3.37Å; C55-T57 PolarHBondContact O-N 3.12Å; C55-K61 WeakPolarHBondContact O-CA 3.34Å; C55-I62 PolarHBondContact N-O 3.42Å; C55-I62 PolarHBondContact O-N 2.86Å; C55-L64 HydrophobicContact CB-CB 4.18Å; C55-L64 HydrophobicContact CB-CD1 3.75Å; C55-L64 HydrophobicContact CB-CG 4.09Å
56	Q	88.4	Confident	87.3	Confident	83 Å²	83	59.3 Å²	59.3	39%	0.388	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	125.7	176.1	-174.6	65.6	62.1	0	0	111.3	T29	T29-Q56 PolarHBondContact OG1-O 3.09Å
57	T	87.3	Confident	86.4	Confident	21 Å²	21	56.5 Å²	56.5	13%	0.129	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	177	170.8	75.5	0	0	0	0	111.4	C55 L59 G60 I62 L64	C55-T57 PolarHBondContact O-N 3.12Å; T57-L59 PolarHBondContact O-N 2.7Å; T57-L59 PolarHBondContact OG1-N 3.34Å; T57-G60 WeakPolarHBondContact CA-O 3.22Å; T57-G60 WeakPolarHBondContact CB-O 3.05Å; T57-G60 PolarHBondContact N-O 3.45Å; T57-G60 PolarHBondContact O-N 2.82Å; T57-G60 PolarHBondContact OG1-O 3.21Å; T57-I62 HydrophobicContact CG2-CD1 3.88Å; T57-I62 HydrophobicContact CG2-CG1 3.62Å; T57-L64 HydrophobicContact CG2-CD1 3.9Å
58	L	88.7	Confident	84.6	Confident	45 Å²	45	57.1 Å²	57.1	24%	0.236	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-9.8	170.4	-56.6	-177.3	0	0	0	113	T29 P30 G32 S35	T29-L58 HydrophobicContact CG2-CD2 4.01Å; T29-L58 HydrophobicContact CG2-CG 4.15Å; P30-L58 HydrophobicContact CG-CD1 4.07Å; P30-L58 HydrophobicContact CG-CG 4.4Å; G32-L58 WeakPolarHBondContact O-CD2 3.37Å; S35-L58 WeakPolarHBondContact CB-O 3.43Å; S35-L58 PolarHBondContact N-O 3.42Å
59	L	87.8	Confident	82.8	Confident	115 Å²	115	61 Å²	61	60%	0.602	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	5	178.1	-59.7	179.1	0	0	0	113.2	A38 K39 T57	A38-L59 CarbonylContact C-O 3.57Å; A38-L59 WeakPolarHBondContact CA-O 3.48Å; A38-L59 VanDerWaalsContact CB-C 3.46Å; A38-L59 WeakPolarHBondContact CB-O 3.26Å; K39-L59 PolarHBondContact N-O 3.15Å; T57-L59 PolarHBondContact O-N 2.7Å; T57-L59 PolarHBondContact OG1-N 3.34Å
60	G	87.5	Confident	80.7	Confident	1 Å²	1	63 Å²	63	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	112.1	-172.2	-171.6	0	0	0	0	0	111.7	D40 T57	D40-G60 WeakPolarHBondContact OD1-CA 3.23Å; T57-G60 WeakPolarHBondContact CA-O 3.22Å; T57-G60 WeakPolarHBondContact CB-O 3.05Å; T57-G60 PolarHBondContact N-O 3.45Å; T57-G60 PolarHBondContact O-N 2.82Å; T57-G60 PolarHBondContact OG1-O 3.21Å
61	K	91	Very high	78.6	Confident	68 Å²	68	60.7 Å²	60.7	30%	0.296	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	122.5	171.6	-68.1	-178.8	173	-170.3	0	110.8	D40 E41 C42 T43 C55	D40-K61 CarbonylContact C-O 3.5Å; D40-K61 WeakPolarHBondContact CA-O 3.23Å; D40-K61 HydrophobicContact CB-CB 4.02Å; D40-K61 PolarHBondContact OD1-N 3.11Å; E41-K61 PolarHBondContact N-O 2.84Å; C42-K61 WeakPolarHBondContact O-CB 3.37Å; T43-K61 PolarHBondContact O-NZ 2.9Å; C55-K61 WeakPolarHBondContact O-CA 3.34Å
62	I	91.8	Very high	77	Confident	39 Å²	39	59.1 Å²	59.1	20%	0.2	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	159.2	176.1	63.7	173.2	0	0	0	110.8	E41 C55 T57 L64	E41-I62 HydrophobicContact CB-CG2 4.24Å; E41-I62 HydrophobicContact CG-CG2 3.97Å; C55-I62 PolarHBondContact N-O 3.42Å; C55-I62 PolarHBondContact O-N 2.86Å; T57-I62 HydrophobicContact CG2-CD1 3.88Å; T57-I62 HydrophobicContact CG2-CG1 3.62Å; I62-L64 HydrophobicContact CD1-CD2 3.96Å; I62-L64 HydrophobicContact CG1-CD2 4.09Å; I62-L64 HydrophobicContact CG1-CG 4.12Å; I62-L64 PolarHBondContact O-N 3.45Å
63	C	91.7	Very high	75	Confident	31 Å²	31	56.3 Å²	56.3	21%	0.209	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	123.5	176.9	-61.2	0	0	0	0	110.4	C48 E52 K53	C48-C63 WeakPolarHBondContact CA-SG 3.45Å; C48-C63 HydrophobicContact CB-CB 3.62Å; C48-C63 WeakPolarHBondContact CB-SG 3.1Å; C48-C63 WeakPolarHBondContact SG-CA 3.32Å; C48-C63 WeakPolarHBondContact SG-CB 3.22Å; C48-C63 CovalentContact SG-SG 2.03Å; C48-C63 PolarHBondContact SG-SG 2.8Å; E52-C63 HydrophobicContact CB-CB 4.2Å; E52-C63 WeakPolarHBondContact OE2-CB 3.37Å; K53-C63 WeakPolarHBondContact O-CA 3.38Å
64	L	88.2	Confident	72.9	Confident	48 Å²	48	60.4 Å²	60.4	25%	0.251	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.9	178.7	-63.4	179	0	0	0	110.6	P27 E52 K53 C55 T57 I62	P27-L64 HydrophobicContact CG-CB 4.22Å; P27-L64 HydrophobicContact CG-CD1 3.57Å; P27-L64 HydrophobicContact CG-CG 4.5Å; E52-L64 CarbonylContact C-O 3.56Å; E52-L64 VanDerWaalsContact CA-O 3.29Å; E52-L64 WeakPolarHBondContact CA-O 3.32Å; K53-L64 PolarHBondContact N-O 3.47Å; K53-L64 PolarHBondContact O-N 2.99Å; C55-L64 HydrophobicContact CB-CB 4.18Å; C55-L64 HydrophobicContact CB-CD1 3.75Å; C55-L64 HydrophobicContact CB-CG 4.09Å; T57-L64 HydrophobicContact CG2-CD1 3.9Å; I62-L64 HydrophobicContact CD1-CD2 3.96Å; I62-L64 HydrophobicContact CG1-CD2 4.09Å; I62-L64 HydrophobicContact CG1-CG 4.12Å; I62-L64 PolarHBondContact O-N 3.45Å
65	E	84	Confident	70.9	Confident	123 Å²	123	63.2 Å²	63.2	58%	0.575	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-62.5	130.2	168.5	-169.9	167.6	-149.4	0	0	109	R51	R51-E65 WeakPolarHBondContact CD-OE1 3.16Å; R51-E65 IonicContact NH1-OE1 2.72Å
66	P	78.8	Confident	68.7	Low	22 Å²	22	70 Å²	70	14%	0.143	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-63.6	146.2	179.3	22.9	-33.3	0	0	0	112	L25 R51 K53	L25-P66 CarbonylContact O-C 3.54Å; L25-P66 WeakPolarHBondContact O-CA 3.08Å; L25-P66 WeakPolarHBondContact O-CB 3.38Å; R51-P66 VanDerWaalsContact O-CD 3.3Å; R51-P66 WeakPolarHBondContact O-CD 3.18Å; K53-P66 HydrophobicContact CD-CB 3.96Å; K53-P66 HydrophobicContact CG-CB 4.4Å
67	E	67.6	Low	66.7	Low	65 Å²	65	70.6 Å²	70.6	30%	0.304	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-57.4	136.3	167	-71.9	-167.6	137.2	0	0	109.3	L25 P27 P28 D69	L25-E67 PolarHBondContact O-N 3.28Å; P27-E67 HydrophobicContact CB-CG 4.01Å; P28-E67 WeakPolarHBondContact CD-OE1 3.44Å; E67-D69 PolarHBondContact O-N 2.73Å
68	P	52.8	Low	64.8	Low	100 Å²	100	78.9 Å²	78.9	65%	0.649	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-57.5	131	173.4	25.1	-33.5	0	0	0	108.6	N70	P68-N70 VanDerWaalsContact C-N 3.28Å; P68-N70 PolarHBondContact O-N 2.03Å
69	D	50.7	Low	62.8	Low	90 Å²	90	84.3 Å²	84.3	48%	0.481	44%	0.439	S	S	.	.			trans	-70.7	85.3	-173	-172.9	20.4	0	0	0	111.2	E67 G71 R72 G73	E67-D69 PolarHBondContact O-N 2.73Å; D69-G71 PolarHBondContact O-N 3.26Å; D69-G71 VanDerWaalsContact OD1-C 3.3Å; D69-G71 WeakPolarHBondContact OD1-CA 3.22Å; D69-G71 PolarHBondContact OD1-N 2.98Å; D69-R72 PolarHBondContact OD1-N 3.17Å; D69-G73 PolarHBondContact OD1-N 3.31Å
70	N	43.5	Very low	60.7	Low	127 Å²	127	81.5 Å²	81.5	68%	0.679	44%	0.439	S	S	*	.	S	Bend	trans	-70.7	34.5	169.7	-66.7	-43.2	0	0	0	111.4	P68	P68-N70 VanDerWaalsContact C-N 3.28Å; P68-N70 PolarHBondContact O-N 2.03Å
71	G	40.7	Very low	59	Low	22 Å²	22	83 Å²	83	23%	0.227	45%	0.449	C	S	.	.	S	Bend	trans	69.5	24.3	-168.8	0	0	0	0	0	114	D69 H82	D69-G71 PolarHBondContact O-N 3.26Å; D69-G71 VanDerWaalsContact OD1-C 3.3Å; D69-G71 WeakPolarHBondContact OD1-CA 3.22Å; D69-G71 PolarHBondContact OD1-N 2.98Å; G71-H82 PolarHBondContact O-CE1 3.44Å; G71-H82 VanDerWaalsContact O-CE1 3.28Å; G71-H82 PolarHBondContact O-ND1 3.01Å
72	R	45	Very low	57.2	Low	138 Å²	138	81.9 Å²	81.9	52%	0.521	44%	0.444	S	S	.	.			trans	-96.7	-9.9	-176.5	-155.4	179	-162.2	-173.2	7.7	113.6	L25 D69	L25-R72 HydrophobicContact CD1-CB 3.7Å; L25-R72 HydrophobicContact CD1-CG 3.8Å; L25-R72 WeakPolarHBondContact CD1-O 3.39Å; D69-R72 PolarHBondContact OD1-N 3.17Å
73	G	43	Very low	55.7	Low	6 Å²	6	81 Å²	81	6%	0.062	44%	0.441	C	S	.	.	S	Bend	trans	-47.9	165.4	-178.7	0	0	0	0	0	116	D69 N75	D69-G73 PolarHBondContact OD1-N 3.31Å; G73-N75 PolarHBondContact O-N 3.29Å
74	P	43.5	Very low	54.5	Low	105 Å²	105	81.6 Å²	81.6	68%	0.682	44%	0.44	S	S	*	.	S	Bend	trans	-63.6	-10.2	-176.8	28.7	-36.2	0	0	0	113.5	R76	P74-R76 PolarHBondContact O-N 3.2Å
75	N	46.7	Very low	53.5	Low	77 Å²	77	84.2 Å²	84.2	41%	0.412	46%	0.46	S	S	.	.			trans	-72.8	57.1	167	-130.4	16.4	0	0	0	110.9	G73 T83	G73-N75 PolarHBondContact O-N 3.29Å; N75-T83 VanDerWaalsContact CB-O 3.29Å; N75-T83 WeakPolarHBondContact CB-O 3Å; N75-T83 WeakPolarHBondContact CB-OG1 2.99Å; N75-T83 PolarHBondContact ND2-O 2.85Å; N75-T83 PolarHBondContact ND2-OG1 3.04Å; N75-T83 PolarHBondContact O-N 3.23Å; N75-T83 PolarHBondContact O-OG1 2.95Å; N75-T83 PolarHBondContact OD1-OG1 3.36Å
76	R	44.8	Very low	52.7	Low	143 Å²	143	80.8 Å²	80.8	54%	0.54	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-107.7	97.4	161	-78.4	175.4	164.5	-166.6	-9.5	106.2	P74 L78	P74-R76 PolarHBondContact O-N 3.2Å; R76-L78 PolarHBondContact O-N 3.16Å
77	D	44.8	Very low	52.5	Low	96 Å²	96	85.2 Å²	85.2	51%	0.513	48%	0.476	S	S	.	.			trans	-52.8	140.4	157.5	-72.8	-38.5	0	0	0	107.7	N79 G80	D77-N79 PolarHBondContact O-N 3.5Å; D77-G80 PolarHBondContact O-N 3.49Å
78	L	47.8	Very low	53.1	Low	195 Å²	195	84.6 Å²	84.6	100%	1.021	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	1.8	-173	-81.4	154.6	0	0	0	115.4	R76	R76-L78 PolarHBondContact O-N 3.16Å
79	N	46.4	Very low	54.2	Low	159 Å²	159	80.8 Å²	80.8	85%	0.85	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	12.8	177.5	-153.9	39.2	0	0	0	113.6	D77 S81	D77-N79 PolarHBondContact O-N 3.5Å; N79-S81 VanDerWaalsContact C-N 3.31Å; N79-S81 PolarHBondContact O-N 2.94Å
80	G	44.3	Very low	55	Low	57 Å²	57	82.9 Å²	82.9	59%	0.588	47%	0.469	S	S	*	.			trans	78.4	5.8	172.5	0	0	0	0	0	115.9	D77 H82	D77-G80 PolarHBondContact O-N 3.49Å; G80-H82 PolarHBondContact O-N 3.42Å
81	S	51.9	Low	56	Low	32 Å²	32	81.3 Å²	81.3	22%	0.224	47%	0.469	C	S	.	.			trans	-70.5	118.1	171.1	-166.7	0	0	0	0	109.4	N79 T83	N79-S81 VanDerWaalsContact C-N 3.31Å; N79-S81 PolarHBondContact O-N 2.94Å; S81-T83 PolarHBondContact O-N 2.96Å
82	H	53.5	Low	57	Low	44 Å²	44	84.4 Å²	84.4	20%	0.204	48%	0.476	C	S	.	.	B	Isolated β-bridge	trans	-61.4	114	163	-63.7	-77.5	0	0	0	107.9	G71 G80 D104 R105	G71-H82 PolarHBondContact O-CE1 3.44Å; G71-H82 VanDerWaalsContact O-CE1 3.28Å; G71-H82 PolarHBondContact O-ND1 3.01Å; G80-H82 PolarHBondContact O-N 3.42Å; H82-D104 WeakPolarHBondContact O-CB 3.4Å; H82-D104 PolarHBondContact O-N 2.89Å; H82-R105 HydrophobicContact CB-CB 4.12Å
83	T	61.1	Low	57.6	Low	22 Å²	22	89 Å²	89	14%	0.135	49%	0.494	C	S	.	.			trans	-106.9	115.2	176.3	47.8	0	0	0	0	111.7	N75 S81 D104	N75-T83 VanDerWaalsContact CB-O 3.29Å; N75-T83 WeakPolarHBondContact CB-O 3Å; N75-T83 WeakPolarHBondContact CB-OG1 2.99Å; N75-T83 PolarHBondContact ND2-O 2.85Å; N75-T83 PolarHBondContact ND2-OG1 3.04Å; N75-T83 PolarHBondContact O-N 3.23Å; N75-T83 PolarHBondContact O-OG1 2.95Å; N75-T83 PolarHBondContact OD1-OG1 3.36Å; S81-T83 PolarHBondContact O-N 2.96Å; T83-D104 WeakPolarHBondContact CA-OD2 3.45Å
84	K	65.4	Low	58.5	Low	43 Å²	43	91.6 Å²	91.6	19%	0.187	52%	0.52	C	S	.	.			trans	-67.9	158.3	170.5	-74.4	176	-173	166.5	0	110.7	D104 C107 S109 L111 K112	K84-D104 HydrophobicContact CB-CB 4.05Å; K84-D104 HydrophobicContact CD-CB 4.06Å; K84-D104 WeakPolarHBondContact CE-O 3.31Å; K84-D104 HydrophobicContact CG-CB 3.82Å; K84-D104 PolarHBondContact N-OD2 3.19Å; K84-D104 PolarHBondContact NZ-O 2.92Å; K84-C107 PolarHBondContact NZ-O 3.09Å; K84-S109 WeakPolarHBondContact CD-O 3.38Å; K84-S109 WeakPolarHBondContact CE-O 3.31Å; K84-S109 PolarHBondContact NZ-O 3.09Å; K84-L111 VanDerWaalsContact CD-O 3.29Å; K84-L111 WeakPolarHBondContact CD-O 3.34Å; K84-L111 PolarHBondContact NZ-O 3.16Å; K84-L111 VanDerWaalsContact NZ-O 3.09Å; K84-K112 HydrophobicContact CB-CG 4.41Å; K84-K112 PolarHBondContact O-NZ 2.76Å
85	P	67.5	Low	59.3	Low	103 Å²	103	93.7 Å²	93.7	67%	0.669	53%	0.525	S	S	*	.	S	Bend	trans	-53.1	148.5	177.8	-27.8	35.9	0	0	0	114.1
86	G	67.9	Low	60.2	Low	50 Å²	50	90.6 Å²	90.6	52%	0.515	51%	0.509	S	S	.	.	S	Bend	trans	93.7	169.7	-179.4	0	0	0	0	0	114.5	K112	G86-K112 VanDerWaalsContact O-CD 3.29Å; G86-K112 WeakPolarHBondContact O-CD 3.43Å; G86-K112 WeakPolarHBondContact O-CE 3.43Å; G86-K112 PolarHBondContact O-NZ 3.44Å
87	E	74.7	Confident	61.3	Low	115 Å²	115	85.6 Å²	85.6	54%	0.537	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-97.6	154.1	-178.5	-70.6	171.4	-162.6	0	0	111.7	P125 K126	E87-P125 CarbonylContact O-C 3.54Å; E87-P125 VanDerWaalsContact O-CA 3.31Å; E87-P125 WeakPolarHBondContact O-CA 3.35Å; E87-K126 HydrophobicContact CB-CB 4.11Å; E87-K126 HydrophobicContact CB-CD 4.38Å; E87-K126 PolarHBondContact O-N 3.01Å; E87-K126 WeakPolarHBondContact OE2-CD 3.29Å; E87-K126 IonicContact OE2-NZ 2.9Å; E87-K126 PolarHBondContact OE2-NZ 2.94Å
88	C	78.2	Confident	62.7	Low	52 Å²	52	81.6 Å²	81.6	35%	0.351	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-69.5	128.4	166.4	-76.3	0	0	0	0	110.4	V90 C114	C88-V90 PolarHBondContact O-N 3.24Å; C88-C114 WeakPolarHBondContact CA-SG 3.29Å; C88-C114 HydrophobicContact CB-CB 3.8Å; C88-C114 WeakPolarHBondContact CB-SG 3.29Å; C88-C114 WeakPolarHBondContact SG-CB 3.34Å; C88-C114 CovalentContact SG-SG 2.03Å; C88-C114 PolarHBondContact SG-SG 2.78Å
89	P	77.2	Confident	64.3	Low	21 Å²	21	75 Å²	75	14%	0.136	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-61	126.1	174.4	23	-33.1	0	0	0	111.4	S91 F92 F116 V123 F124 K126	P89-S91 VanDerWaalsContact C-N 3.27Å; P89-S91 PolarHBondContact O-N 3.43Å; P89-F92 HydrophobicContact CB-CE2 4.03Å; P89-F92 HydrophobicContact CB-CZ 4.13Å; P89-F92 HydrophobicContact CG-CE1 4.42Å; P89-F92 HydrophobicContact CG-CE2 3.55Å; P89-F92 HydrophobicContact CG-CZ 3.35Å; P89-F116 WeakPolarHBondContact O-CE1 3.29Å; P89-V123 HydrophobicContact CG-CG2 4.1Å; P89-F124 VanDerWaalsContact CD-O 3.3Å; P89-F124 WeakPolarHBondContact CD-O 3.22Å; P89-F124 WeakPolarHBondContact CG-O 3.33Å; P89-K126 HydrophobicContact CB-CB 4.39Å
90	V	68.1	Low	66.1	Low	133 Å²	133	72.3 Å²	72.3	81%	0.806	44%	0.439	S	S	*	.	S	Bend	trans	-75.3	-9.6	-171.9	-62.9	0	0	0	0	114.7	C88	C88-V90 PolarHBondContact O-N 3.24Å
91	S	64.2	Low	67.8	Low	95 Å²	95	70 Å²	70	66%	0.664	41%	0.414	S	S	*	.			trans	-155	145.7	-178.5	64.2	0	0	0	0	111.9	P89	P89-S91 VanDerWaalsContact C-N 3.27Å; P89-S91 PolarHBondContact O-N 3.43Å
92	F	61.6	Low	69.3	Low	87 Å²	87	74.8 Å²	74.8	38%	0.382	44%	0.437	S	S	.	.			trans	-128.4	149.4	173.7	-74.2	-100.5	0	0	0	110.1	P89 G94 P96 F116 V123	P89-F92 HydrophobicContact CB-CE2 4.03Å; P89-F92 HydrophobicContact CB-CZ 4.13Å; P89-F92 HydrophobicContact CG-CE1 4.42Å; P89-F92 HydrophobicContact CG-CE2 3.55Å; P89-F92 HydrophobicContact CG-CZ 3.35Å; F92-G94 WeakPolarHBondContact CB-O 3.34Å; F92-P96 HydrophobicContact CD1-CB 4.48Å; F92-P96 HydrophobicContact CE1-CB 4.25Å; F92-P96 HydrophobicContact CZ-CB 4.41Å; F92-F116 HydrophobicContact CD2-CD1 4.17Å; F92-F116 AromaticContact CD2-CE1 3.77Å; F92-F116 HydrophobicContact CD2-CE1 3.77Å; F92-F116 HydrophobicContact CD2-CZ 4.03Å; F92-F116 HydrophobicContact CE2-CD1 4.15Å; F92-F116 AromaticContact CE2-CE1 3.37Å; F92-F116 HydrophobicContact CE2-CE1 3.37Å; F92-F116 AromaticContact CE2-CE2 3.9Å; F92-F116 HydrophobicContact CE2-CE2 3.9Å; F92-F116 AromaticContact CE2-CZ 3.21Å; F92-F116 HydrophobicContact CE2-CZ 3.21Å; F92-F116 HydrophobicContact CZ-CE1 4.44Å; F92-F116 HydrophobicContact CZ-CE2 4.28Å; F92-F116 AromaticContact CZ-CZ 3.89Å; F92-F116 HydrophobicContact CZ-CZ 3.89Å; F92-V123 HydrophobicContact CE1-CB 4.42Å; F92-V123 HydrophobicContact CE1-CG1 4.1Å; F92-V123 HydrophobicContact CZ-CB 3.89Å; F92-V123 HydrophobicContact CZ-CG1 3.7Å; F92-V123 HydrophobicContact CZ-CG2 4.18Å
93	R	58	Low	70.3	Confident	235 Å²	235	73.7 Å²	73.7	89%	0.887	43%	0.434	S	S	*	.	S	Bend	trans	-89.1	100	155.3	-71.6	-171.8	176.8	-160.1	1	107.9
94	G	60.5	Low	71	Confident	60 Å²	60	72.8 Å²	72.8	62%	0.619	43%	0.429	S	S	*	.	S	Bend	trans	103.3	-173.2	-178.9	0	0	0	0	0	113.9	F92	F92-G94 WeakPolarHBondContact CB-O 3.34Å
95	L	60	Low	71.6	Confident	149 Å²	149	78.6 Å²	78.6	78%	0.78	45%	0.449	S	S	*	.	S	Bend	trans	-81.4	139.3	175.8	-79.6	134.5	0	0	0	110.4
96	P	66	Low	72.3	Confident	11 Å²	11	77.8 Å²	77.8	7%	0.071	44%	0.439	C	S	.	.			trans	-65.4	136.7	175.8	7.5	-4.2	0	0	0	111.6	F92 F116 R121 V123	F92-P96 HydrophobicContact CD1-CB 4.48Å; F92-P96 HydrophobicContact CE1-CB 4.25Å; F92-P96 HydrophobicContact CZ-CB 4.41Å; P96-F116 HydrophobicContact CB-CD2 4.04Å; P96-F116 HydrophobicContact CB-CE2 4.18Å; P96-F116 HydrophobicContact CG-CB 3.92Å; P96-F116 HydrophobicContact CG-CD2 3.19Å; P96-F116 HydrophobicContact CG-CE2 3.79Å; P96-F116 HydrophobicContact CG-CG 3.63Å; P96-R121 HydrophobicContact CB-CB 4.2Å; P96-R121 HydrophobicContact CG-CB 4.45Å; P96-R121 PolarHBondContact O-NH2 3.3Å; P96-V123 HydrophobicContact CB-CG1 3.43Å; P96-V123 VanDerWaalsContact CB-CG1 3.43Å; P96-V123 HydrophobicContact CG-CG1 4.47Å
97	A	67.3	Low	72.7	Confident	38 Å²	38	75.7 Å²	75.7	31%	0.314	42%	0.417	S	S	.	.			trans	-88.4	-37.3	-158.6	0	0	0	0	0	114.2	R121 Y263	A97-R121 PolarHBondContact O-NH2 3.24Å; A97-Y263 VanDerWaalsContact CA-OH 3.23Å; A97-Y263 WeakPolarHBondContact CA-OH 3.34Å; A97-Y263 HydrophobicContact CB-CE1 3.85Å; A97-Y263 VanDerWaalsContact CB-OH 3.23Å; A97-Y263 WeakPolarHBondContact CB-OH 3.47Å; A97-Y263 WeakPolarHBondContact O-CE1 3.44Å; A97-Y263 VanDerWaalsContact O-CZ 3.24Å; A97-Y263 PolarHBondContact O-OH 3.24Å
98	G	75.4	Confident	73	Confident	12 Å²	12	76.6 Å²	76.6	12%	0.124	42%	0.421	C	S	.	.	S	Bend	trans	-64.9	177.1	-169.3	0	0	0	0	0	115.2	R121 C122	G98-R121 PolarHBondContact O-NE 3.26Å; G98-R121 PolarHBondContact O-NH2 3.22Å; G98-C122 VanDerWaalsContact CA-O 3.3Å; G98-C122 WeakPolarHBondContact CA-O 3.39Å; G98-C122 PolarHBondContact N-O 2.99Å
99	P	81.4	Confident	72.8	Confident	57 Å²	57	77.1 Å²	77.1	37%	0.37	43%	0.426	S	S	.	.			trans	-59.1	159.9	-178.8	22.9	-33.7	0	0	0	113.2	R121 C122	P99-R121 WeakPolarHBondContact O-CA 3.14Å; P99-C122 HydrophobicContact CG-CB 4.02Å; P99-C122 PolarHBondContact O-N 3.04Å
100	P	83.4	Confident	72.4	Confident	102 Å²	102	78.7 Å²	78.7	66%	0.662	43%	0.433	S	S	*	.	B	Isolated β-bridge	trans	-62.4	154.4	164.2	31.3	-35.5	0	0	0	110.5
101	C	81.3	Confident	72.8	Confident	9 Å²	9	73.2 Å²	73.2	6%	0.061	40%	0.399	C	S	.	.			trans	-158.4	157.2	-177.9	56.1	0	0	0	0	109.4	D106 C113 Q120 C122	C101-D106 HydrophobicContact CB-CB 3.87Å; C101-C113 HydrophobicContact CB-CB 3.81Å; C101-C113 WeakPolarHBondContact CB-SG 3.02Å; C101-C113 PolarHBondContact O-SG 2.72Å; C101-C113 VanDerWaalsContact O-SG 3.36Å; C101-C113 WeakPolarHBondContact SG-CA 3.47Å; C101-C113 WeakPolarHBondContact SG-CB 2.97Å; C101-C113 CovalentContact SG-SG 2.03Å; C101-C113 PolarHBondContact SG-SG 3.19Å; C101-Q120 WeakPolarHBondContact O-CB 3.48Å; C101-C122 VanDerWaalsContact CB-SG 3.58Å
102	D	82.2	Confident	73.6	Confident	132 Å²	132	69.2 Å²	69.2	71%	0.706	37%	0.37	S	S	*	.	S	Bend	trans	-107.1	-27.2	172.3	-64.9	-32.2	0	0	0	111.1	D106 Q120	D102-D106 WeakPolarHBondContact CA-OD2 3.05Å; D102-D106 PolarHBondContact N-OD2 3.36Å; D102-Q120 PolarHBondContact O-NE2 2.91Å
103	C	75.5	Confident	74.6	Confident	21 Å²	21	65.7 Å²	65.7	14%	0.142	36%	0.356	C	S	.	.	S	Bend	trans	-148.3	169.7	174	69.1	0	0	0	0	112.4	R105 D106 C113	C103-R105 PolarHBondContact O-N 3.34Å; C103-D106 PolarHBondContact N-OD2 2.75Å; C103-D106 PolarHBondContact O-N 2.86Å; C103-D106 VanDerWaalsContact O-N 3.1Å; C103-D106 PolarHBondContact SG-OD2 2.66Å; C103-C113 VanDerWaalsContact O-CB 3.31Å; C103-C113 WeakPolarHBondContact O-CB 3.38Å
104	D	76.4	Confident	75.7	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.016	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-63.4	-20.5	-175.3	-61.4	1.2	0	0	0	112.9	H82 T83 K84 D106 C107 K112 C113	H82-D104 WeakPolarHBondContact O-CB 3.4Å; H82-D104 PolarHBondContact O-N 2.89Å; T83-D104 WeakPolarHBondContact CA-OD2 3.45Å; K84-D104 HydrophobicContact CB-CB 4.05Å; K84-D104 HydrophobicContact CD-CB 4.06Å; K84-D104 WeakPolarHBondContact CE-O 3.31Å; K84-D104 HydrophobicContact CG-CB 3.82Å; K84-D104 PolarHBondContact N-OD2 3.19Å; K84-D104 PolarHBondContact NZ-O 2.92Å; D104-D106 VanDerWaalsContact C-N 3.26Å; D104-D106 PolarHBondContact O-N 2.72Å; D104-C107 WeakPolarHBondContact O-CB 3.47Å; D104-C107 PolarHBondContact O-N 2.95Å; D104-K112 IonicContact OD2-NZ 3.92Å; D104-K112 PolarHBondContact OD2-NZ 2.67Å; D104-C113 WeakPolarHBondContact OD1-CA 3.29Å; D104-C113 WeakPolarHBondContact OD1-CB 3.49Å; D104-C113 PolarHBondContact OD1-N 2.76Å
105	R	76.8	Confident	76.8	Confident	165 Å²	165	55.6 Å²	55.6	62%	0.623	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-65.3	-27.6	177.1	-174.9	178.1	176.8	-175.5	-1.2	112.9	H82 C103 C107	H82-R105 HydrophobicContact CB-CB 4.12Å; C103-R105 PolarHBondContact O-N 3.34Å; R105-C107 PolarHBondContact O-N 3.09Å
106	D	82.6	Confident	77.3	Confident	86 Å²	86	50.9 Å²	50.9	46%	0.46	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-76.7	-15.4	179.6	-47.4	-44	0	0	0	112	C101 D102 C103 D104	C101-D106 HydrophobicContact CB-CB 3.87Å; D102-D106 WeakPolarHBondContact CA-OD2 3.05Å; D102-D106 PolarHBondContact N-OD2 3.36Å; C103-D106 PolarHBondContact N-OD2 2.75Å; C103-D106 PolarHBondContact O-N 2.86Å; C103-D106 VanDerWaalsContact O-N 3.1Å; C103-D106 PolarHBondContact SG-OD2 2.66Å; D104-D106 VanDerWaalsContact C-N 3.26Å; D104-D106 PolarHBondContact O-N 2.72Å
107	C	76.5	Confident	77.4	Confident	7 Å²	7	54.7 Å²	54.7	5%	0.047	33%	0.326	C	S	.	.	S	Bend	trans	-85.5	147.8	176.4	-57.2	0	0	0	0	111.1	K84 D104 R105 L111 C122	K84-C107 PolarHBondContact NZ-O 3.09Å; D104-C107 WeakPolarHBondContact O-CB 3.47Å; D104-C107 PolarHBondContact O-N 2.95Å; R105-C107 PolarHBondContact O-N 3.09Å; C107-L111 HydrophobicContact CB-CB 3.73Å; C107-L111 WeakPolarHBondContact CB-O 3.31Å; C107-C122 WeakPolarHBondContact CA-SG 3.44Å; C107-C122 HydrophobicContact CB-CB 3.74Å; C107-C122 WeakPolarHBondContact CB-SG 3.24Å; C107-C122 WeakPolarHBondContact SG-CA 3.34Å; C107-C122 WeakPolarHBondContact SG-CB 3.44Å; C107-C122 CovalentContact SG-SG 2.03Å; C107-C122 PolarHBondContact SG-SG 3.36Å
108	E	79.8	Confident	77.5	Confident	134 Å²	134	56.4 Å²	56.4	63%	0.626	35%	0.347	S	S	*	.			trans	-74.3	152.4	174.8	-173.3	49.3	-107.2	0	0	111.8	N110 L111	E108-N110 PolarHBondContact O-N 3.19Å; E108-L111 VanDerWaalsContact O-CB 3.32Å; E108-L111 WeakPolarHBondContact O-CB 3.35Å; E108-L111 PolarHBondContact O-N 3.16Å; E108-L111 VanDerWaalsContact O-N 3.15Å
109	S	73.7	Confident	77.2	Confident	63 Å²	63	64.3 Å²	64.3	44%	0.441	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	-129.1	170.4	-174	0	0	0	0	113	K84	K84-S109 WeakPolarHBondContact CD-O 3.38Å; K84-S109 WeakPolarHBondContact CE-O 3.31Å; K84-S109 PolarHBondContact NZ-O 3.09Å
110	N	69.6	Low	77.1	Confident	53 Å²	53	65.6 Å²	65.6	28%	0.283	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	9.4	-177.8	72.4	-75.2	0	0	0	114.9	E108 P125 F128	E108-N110 PolarHBondContact O-N 3.19Å; N110-P125 WeakPolarHBondContact O-CD 3.49Å; N110-P125 WeakPolarHBondContact O-CG 3.42Å; N110-F128 VanDerWaalsContact ND2-CD2 3.29Å; N110-F128 WeakPolarHBondContact ND2-CD2 3.49Å; N110-F128 WeakPolarHBondContact ND2-CE2 3.02Å; N110-F128 WeakPolarHBondContact ND2-CZ 3.33Å
111	L	77.5	Confident	76.9	Confident	19 Å²	19	63.5 Å²	63.5	10%	0.099	35%	0.353	C	S	.	.			trans	-71.7	137.6	178.2	-66.3	168	0	0	0	111.1	K84 C107 E108 C122 V123 F124	K84-L111 VanDerWaalsContact CD-O 3.29Å; K84-L111 WeakPolarHBondContact CD-O 3.34Å; K84-L111 PolarHBondContact NZ-O 3.16Å; K84-L111 VanDerWaalsContact NZ-O 3.09Å; C107-L111 HydrophobicContact CB-CB 3.73Å; C107-L111 WeakPolarHBondContact CB-O 3.31Å; E108-L111 VanDerWaalsContact O-CB 3.32Å; E108-L111 WeakPolarHBondContact O-CB 3.35Å; E108-L111 PolarHBondContact O-N 3.16Å; E108-L111 VanDerWaalsContact O-N 3.15Å; L111-C122 HydrophobicContact CB-CB 4.35Å; L111-C122 HydrophobicContact CD1-CB 4.44Å; L111-V123 CarbonylContact C-O 3.55Å; L111-V123 WeakPolarHBondContact CA-O 2.96Å; L111-V123 VanDerWaalsContact CD2-C 3.42Å; L111-F124 HydrophobicContact CD2-CB 4.47Å; L111-F124 HydrophobicContact CD2-CD1 3.41Å; L111-F124 VanDerWaalsContact CD2-CD1 3.41Å; L111-F124 HydrophobicContact CD2-CD2 4.24Å; L111-F124 HydrophobicContact CD2-CE1 3.54Å; L111-F124 HydrophobicContact CD2-CE2 4.34Å; L111-F124 HydrophobicContact CD2-CG 3.79Å; L111-F124 HydrophobicContact CD2-CZ 4.02Å; L111-F124 HydrophobicContact CG-CD1 4.4Å; L111-F124 HydrophobicContact CG-CE1 4.3Å
112	K	80.8	Confident	77	Confident	11 Å²	11	63.2 Å²	63.2	5%	0.048	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	148.4	176.2	-62.7	-177.6	61.3	61.4	0	111.4	K84 G86 D104 C114 C122 V123 P125	K84-K112 HydrophobicContact CB-CG 4.41Å; K84-K112 PolarHBondContact O-NZ 2.76Å; G86-K112 VanDerWaalsContact O-CD 3.29Å; G86-K112 WeakPolarHBondContact O-CD 3.43Å; G86-K112 WeakPolarHBondContact O-CE 3.43Å; G86-K112 PolarHBondContact O-NZ 3.44Å; D104-K112 IonicContact OD2-NZ 3.92Å; D104-K112 PolarHBondContact OD2-NZ 2.67Å; K112-C114 PolarHBondContact O-N 2.83Å; K112-C122 CarbonylContact O-C 3.44Å; K112-C122 WeakPolarHBondContact O-CA 3Å; K112-V123 PolarHBondContact N-O 3.29Å; K112-V123 PolarHBondContact O-N 2.86Å; K112-P125 HydrophobicContact CD-CB 4.12Å; K112-P125 HydrophobicContact CD-CG 4.05Å; K112-P125 HydrophobicContact CG-CG 4.12Å
113	C	82.7	Confident	77	Confident	13 Å²	13	57.2 Å²	57.2	9%	0.088	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	101.4	174.3	-172.4	0	0	0	0	110.2	C101 C103 D104	C101-C113 HydrophobicContact CB-CB 3.81Å; C101-C113 WeakPolarHBondContact CB-SG 3.02Å; C101-C113 PolarHBondContact O-SG 2.72Å; C101-C113 VanDerWaalsContact O-SG 3.36Å; C101-C113 WeakPolarHBondContact SG-CA 3.47Å; C101-C113 WeakPolarHBondContact SG-CB 2.97Å; C101-C113 CovalentContact SG-SG 2.03Å; C101-C113 PolarHBondContact SG-SG 3.19Å; C103-C113 VanDerWaalsContact O-CB 3.31Å; C103-C113 WeakPolarHBondContact O-CB 3.38Å; D104-C113 WeakPolarHBondContact OD1-CA 3.29Å; D104-C113 WeakPolarHBondContact OD1-CB 3.49Å; D104-C113 PolarHBondContact OD1-N 2.76Å
114	C	81.4	Confident	77.1	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.014	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.9	-172.5	-62	0	0	0	0	111.3	C88 K112 F116 Q120 R121 V123	C88-C114 WeakPolarHBondContact CA-SG 3.29Å; C88-C114 HydrophobicContact CB-CB 3.8Å; C88-C114 WeakPolarHBondContact CB-SG 3.29Å; C88-C114 WeakPolarHBondContact SG-CB 3.34Å; C88-C114 CovalentContact SG-SG 2.03Å; C88-C114 PolarHBondContact SG-SG 2.78Å; K112-C114 PolarHBondContact O-N 2.83Å; C114-F116 HydrophobicContact CB-CD2 4.35Å; C114-F116 HydrophobicContact CB-CE1 4.47Å; C114-F116 HydrophobicContact CB-CE2 3.31Å; C114-F116 HydrophobicContact CB-CZ 3.36Å; C114-F116 WeakPolarHBondContact O-CD2 3.42Å; C114-F116 WeakPolarHBondContact O-CE2 3.35Å; C114-Q120 WeakPolarHBondContact O-CA 3.44Å; C114-R121 PolarHBondContact N-O 3.22Å; C114-R121 PolarHBondContact O-N 2.03Å; C114-V123 HydrophobicContact CB-CG2 3.61Å; C114-V123 WeakPolarHBondContact SG-CG2 3.3Å
115	S	82.7	Confident	77.2	Confident	81 Å²	81	60.8 Å²	60.8	57%	0.566	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.1	-176	-173.3	0	0	0	0	111.9
116	F	70.6	Confident	76.7	Confident	50 Å²	50	56.8 Å²	56.8	22%	0.219	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	118.2	179.5	-54.7	-75.2	0	0	0	110.2	P89 F92 P96 C114 G118 R119 V123	P89-F116 WeakPolarHBondContact O-CE1 3.29Å; F92-F116 HydrophobicContact CD2-CD1 4.17Å; F92-F116 AromaticContact CD2-CE1 3.77Å; F92-F116 HydrophobicContact CD2-CE1 3.77Å; F92-F116 HydrophobicContact CD2-CZ 4.03Å; F92-F116 HydrophobicContact CE2-CD1 4.15Å; F92-F116 AromaticContact CE2-CE1 3.37Å; F92-F116 HydrophobicContact CE2-CE1 3.37Å; F92-F116 AromaticContact CE2-CE2 3.9Å; F92-F116 HydrophobicContact CE2-CE2 3.9Å; F92-F116 AromaticContact CE2-CZ 3.21Å; F92-F116 HydrophobicContact CE2-CZ 3.21Å; F92-F116 HydrophobicContact CZ-CE1 4.44Å; F92-F116 HydrophobicContact CZ-CE2 4.28Å; F92-F116 AromaticContact CZ-CZ 3.89Å; F92-F116 HydrophobicContact CZ-CZ 3.89Å; P96-F116 HydrophobicContact CB-CD2 4.04Å; P96-F116 HydrophobicContact CB-CE2 4.18Å; P96-F116 HydrophobicContact CG-CB 3.92Å; P96-F116 HydrophobicContact CG-CD2 3.19Å; P96-F116 HydrophobicContact CG-CE2 3.79Å; P96-F116 HydrophobicContact CG-CG 3.63Å; C114-F116 HydrophobicContact CB-CD2 4.35Å; C114-F116 HydrophobicContact CB-CE1 4.47Å; C114-F116 HydrophobicContact CB-CE2 3.31Å; C114-F116 HydrophobicContact CB-CZ 3.36Å; C114-F116 WeakPolarHBondContact O-CD2 3.42Å; C114-F116 WeakPolarHBondContact O-CE2 3.35Å; F116-G118 PolarHBondContact O-N 2.74Å; F116-G118 VanDerWaalsContact O-N 3.17Å; F116-R119 PolarHBondContact N-O 2.03Å; F116-R119 PolarHBondContact O-N 3.45Å; F116-V123 HydrophobicContact CE2-CG1 3.87Å; F116-V123 HydrophobicContact CE2-CG2 4.13Å; F116-V123 HydrophobicContact CZ-CG2 4.25Å
117	G	68	Low	75.7	Confident	90 Å²	90	58.9 Å²	58.9	93%	0.928	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	30.9	179.4	0	0	0	0	0	114.1
118	G	68.6	Low	75.1	Confident	74 Å²	74	61.6 Å²	61.6	76%	0.763	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	10.3	-176.6	0	0	0	0	0	115.2	F116	F116-G118 PolarHBondContact O-N 2.74Å; F116-G118 VanDerWaalsContact O-N 3.17Å
119	R	70.4	Confident	73.7	Confident	179 Å²	179	60.6 Å²	60.6	68%	0.675	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	130	172.7	-58.7	-174.9	-174.9	-143.9	0.4	110.2	F116	F116-R119 PolarHBondContact N-O 2.03Å; F116-R119 PolarHBondContact O-N 3.45Å
120	Q	78.2	Confident	72.2	Confident	83 Å²	83	60.5 Å²	60.5	39%	0.388	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	131.5	173.1	-71.7	176.3	-100.4	0	0	110.2	C101 D102 C114	C101-Q120 WeakPolarHBondContact O-CB 3.48Å; D102-Q120 PolarHBondContact O-NE2 2.91Å; C114-Q120 WeakPolarHBondContact O-CA 3.44Å
121	R	78.9	Confident	70.5	Confident	59 Å²	59	62 Å²	62	22%	0.223	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144	-179.9	-57.7	-64.6	-73.2	-84.5	-2.6	110.5	P96 A97 G98 P99 C114 V123	P96-R121 HydrophobicContact CB-CB 4.2Å; P96-R121 HydrophobicContact CG-CB 4.45Å; P96-R121 PolarHBondContact O-NH2 3.3Å; A97-R121 PolarHBondContact O-NH2 3.24Å; G98-R121 PolarHBondContact O-NE 3.26Å; G98-R121 PolarHBondContact O-NH2 3.22Å; P99-R121 WeakPolarHBondContact O-CA 3.14Å; C114-R121 PolarHBondContact N-O 3.22Å; C114-R121 PolarHBondContact O-N 2.03Å; R121-V123 PolarHBondContact O-N 3.11Å
122	C	83.5	Confident	68.4	Low	2 Å²	2	64 Å²	64	1%	0.014	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	126	172.4	-63.7	0	0	0	0	110.9	G98 P99 C101 C107 L111 K112	G98-C122 VanDerWaalsContact CA-O 3.3Å; G98-C122 WeakPolarHBondContact CA-O 3.39Å; G98-C122 PolarHBondContact N-O 2.99Å; P99-C122 HydrophobicContact CG-CB 4.02Å; P99-C122 PolarHBondContact O-N 3.04Å; C101-C122 VanDerWaalsContact CB-SG 3.58Å; C107-C122 WeakPolarHBondContact CA-SG 3.44Å; C107-C122 HydrophobicContact CB-CB 3.74Å; C107-C122 WeakPolarHBondContact CB-SG 3.24Å; C107-C122 WeakPolarHBondContact SG-CA 3.34Å; C107-C122 WeakPolarHBondContact SG-CB 3.44Å; C107-C122 CovalentContact SG-SG 2.03Å; C107-C122 PolarHBondContact SG-SG 3.36Å; L111-C122 HydrophobicContact CB-CB 4.35Å; L111-C122 HydrophobicContact CD1-CB 4.44Å; K112-C122 CarbonylContact O-C 3.44Å; K112-C122 WeakPolarHBondContact O-CA 3Å
123	V	82.1	Confident	66.2	Low	7 Å²	7	68.5 Å²	68.5	4%	0.042	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	158.9	-179.9	-61.5	0	0	0	0	110.6	P89 F92 P96 L111 K112 C114 F116 R121	P89-V123 HydrophobicContact CG-CG2 4.1Å; F92-V123 HydrophobicContact CE1-CB 4.42Å; F92-V123 HydrophobicContact CE1-CG1 4.1Å; F92-V123 HydrophobicContact CZ-CB 3.89Å; F92-V123 HydrophobicContact CZ-CG1 3.7Å; F92-V123 HydrophobicContact CZ-CG2 4.18Å; P96-V123 HydrophobicContact CB-CG1 3.43Å; P96-V123 VanDerWaalsContact CB-CG1 3.43Å; P96-V123 HydrophobicContact CG-CG1 4.47Å; L111-V123 CarbonylContact C-O 3.55Å; L111-V123 WeakPolarHBondContact CA-O 2.96Å; L111-V123 VanDerWaalsContact CD2-C 3.42Å; K112-V123 PolarHBondContact N-O 3.29Å; K112-V123 PolarHBondContact O-N 2.86Å; C114-V123 HydrophobicContact CB-CG2 3.61Å; C114-V123 WeakPolarHBondContact SG-CG2 3.3Å; F116-V123 HydrophobicContact CE2-CG1 3.87Å; F116-V123 HydrophobicContact CE2-CG2 4.13Å; F116-V123 HydrophobicContact CZ-CG2 4.25Å; R121-V123 PolarHBondContact O-N 3.11Å
124	F	78.5	Confident	63.9	Low	83 Å²	83	70.4 Å²	70.4	36%	0.364	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-65.7	146.9	169.1	-69.7	-63.4	0	0	0	110.8	P89 L111 F128	P89-F124 VanDerWaalsContact CD-O 3.3Å; P89-F124 WeakPolarHBondContact CD-O 3.22Å; P89-F124 WeakPolarHBondContact CG-O 3.33Å; L111-F124 HydrophobicContact CD2-CB 4.47Å; L111-F124 HydrophobicContact CD2-CD1 3.41Å; L111-F124 VanDerWaalsContact CD2-CD1 3.41Å; L111-F124 HydrophobicContact CD2-CD2 4.24Å; L111-F124 HydrophobicContact CD2-CE1 3.54Å; L111-F124 HydrophobicContact CD2-CE2 4.34Å; L111-F124 HydrophobicContact CD2-CG 3.79Å; L111-F124 HydrophobicContact CD2-CZ 4.02Å; L111-F124 HydrophobicContact CG-CD1 4.4Å; L111-F124 HydrophobicContact CG-CE1 4.3Å; F124-F128 HydrophobicContact CB-CB 4Å; F124-F128 HydrophobicContact CB-CD1 3.67Å; F124-F128 HydrophobicContact CB-CE1 4.48Å; F124-F128 HydrophobicContact CB-CG 4.08Å; F124-F128 AromaticContact CD1-CD1 3.23Å; F124-F128 HydrophobicContact CD1-CD1 3.23Å; F124-F128 AromaticContact CD1-CE1 3.16Å; F124-F128 HydrophobicContact CD1-CE1 3.16Å; F124-F128 HydrophobicContact CD1-CG 4Å; F124-F128 AromaticContact CD1-CZ 3.89Å; F124-F128 HydrophobicContact CD1-CZ 3.89Å; F124-F128 HydrophobicContact CD2-CD1 4.18Å; F124-F128 HydrophobicContact CD2-CE1 4.38Å; F124-F128 AromaticContact CE1-CD1 3.84Å; F124-F128 HydrophobicContact CE1-CD1 3.84Å; F124-F128 AromaticContact CE1-CE1 3.25Å; F124-F128 HydrophobicContact CE1-CE1 3.25Å; F124-F128 AromaticContact CE1-CZ 3.86Å; F124-F128 HydrophobicContact CE1-CZ 3.86Å; F124-F128 HydrophobicContact CE2-CE1 4.44Å; F124-F128 AromaticContact CG-CD1 3.43Å; F124-F128 HydrophobicContact CG-CD1 3.43Å; F124-F128 VanDerWaalsContact CG-CD1 3.43Å; F124-F128 AromaticContact CG-CE1 3.78Å; F124-F128 HydrophobicContact CG-CE1 3.78Å; F124-F128 HydrophobicContact CG-CG 4.25Å; F124-F128 AromaticContact CZ-CE1 3.93Å; F124-F128 HydrophobicContact CZ-CE1 3.93Å
125	P	77.4	Confident	62	Low	16 Å²	16	75.3 Å²	75.3	10%	0.104	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-55	157.1	169.5	-20.8	30	0	0	0	111.6	E87 N110 K112 F128	E87-P125 CarbonylContact O-C 3.54Å; E87-P125 VanDerWaalsContact O-CA 3.31Å; E87-P125 WeakPolarHBondContact O-CA 3.35Å; N110-P125 WeakPolarHBondContact O-CD 3.49Å; N110-P125 WeakPolarHBondContact O-CG 3.42Å; K112-P125 HydrophobicContact CD-CB 4.12Å; K112-P125 HydrophobicContact CD-CG 4.05Å; K112-P125 HydrophobicContact CG-CG 4.12Å; P125-F128 HydrophobicContact CB-CB 4.46Å; P125-F128 WeakPolarHBondContact O-CB 3.31Å; P125-F128 PolarHBondContact O-N 3.4Å
126	K	66.5	Low	59.9	Low	81 Å²	81	75.7 Å²	75.7	35%	0.352	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	143.5	165.2	-171	-172.1	147.6	-134.9	0	109.5	E87 P89 F128	E87-K126 HydrophobicContact CB-CB 4.11Å; E87-K126 HydrophobicContact CB-CD 4.38Å; E87-K126 PolarHBondContact O-N 3.01Å; E87-K126 WeakPolarHBondContact OE2-CD 3.29Å; E87-K126 IonicContact OE2-NZ 2.9Å; E87-K126 PolarHBondContact OE2-NZ 2.94Å; P89-K126 HydrophobicContact CB-CB 4.39Å; K126-F128 PolarHBondContact O-N 2.86Å; K126-F128 VanDerWaalsContact O-N 3.11Å
127	D	63.2	Low	58.6	Low	129 Å²	129	79.3 Å²	79.3	69%	0.69	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	7.1	-179.4	-47.8	-46.8	0	0	0	115.2	T129	D127-T129 PolarHBondContact O-N 2.88Å
128	F	62.8	Low	57.3	Low	64 Å²	64	77.9 Å²	77.9	28%	0.281	46%	0.458	S	S	.	.			trans	-75.7	108.5	170.4	-172.9	-92.6	0	0	0	111.3	N110 F124 P125 K126 A130	N110-F128 VanDerWaalsContact ND2-CD2 3.29Å; N110-F128 WeakPolarHBondContact ND2-CD2 3.49Å; N110-F128 WeakPolarHBondContact ND2-CE2 3.02Å; N110-F128 WeakPolarHBondContact ND2-CZ 3.33Å; F124-F128 HydrophobicContact CB-CB 4Å; F124-F128 HydrophobicContact CB-CD1 3.67Å; F124-F128 HydrophobicContact CB-CE1 4.48Å; F124-F128 HydrophobicContact CB-CG 4.08Å; F124-F128 AromaticContact CD1-CD1 3.23Å; F124-F128 HydrophobicContact CD1-CD1 3.23Å; F124-F128 AromaticContact CD1-CE1 3.16Å; F124-F128 HydrophobicContact CD1-CE1 3.16Å; F124-F128 HydrophobicContact CD1-CG 4Å; F124-F128 AromaticContact CD1-CZ 3.89Å; F124-F128 HydrophobicContact CD1-CZ 3.89Å; F124-F128 HydrophobicContact CD2-CD1 4.18Å; F124-F128 HydrophobicContact CD2-CE1 4.38Å; F124-F128 AromaticContact CE1-CD1 3.84Å; F124-F128 HydrophobicContact CE1-CD1 3.84Å; F124-F128 AromaticContact CE1-CE1 3.25Å; F124-F128 HydrophobicContact CE1-CE1 3.25Å; F124-F128 AromaticContact CE1-CZ 3.86Å; F124-F128 HydrophobicContact CE1-CZ 3.86Å; F124-F128 HydrophobicContact CE2-CE1 4.44Å; F124-F128 AromaticContact CG-CD1 3.43Å; F124-F128 HydrophobicContact CG-CD1 3.43Å; F124-F128 VanDerWaalsContact CG-CD1 3.43Å; F124-F128 AromaticContact CG-CE1 3.78Å; F124-F128 HydrophobicContact CG-CE1 3.78Å; F124-F128 HydrophobicContact CG-CG 4.25Å; F124-F128 AromaticContact CZ-CE1 3.93Å; F124-F128 HydrophobicContact CZ-CE1 3.93Å; P125-F128 HydrophobicContact CB-CB 4.46Å; P125-F128 WeakPolarHBondContact O-CB 3.31Å; P125-F128 PolarHBondContact O-N 3.4Å; K126-F128 PolarHBondContact O-N 2.86Å; K126-F128 VanDerWaalsContact O-N 3.11Å; F128-A130 HydrophobicContact CD1-CB 4.31Å; F128-A130 HydrophobicContact CE1-CB 3.53Å; F128-A130 HydrophobicContact CE2-CB 4Å; F128-A130 HydrophobicContact CZ-CB 3.38Å
129	T	49.6	Very low	55.9	Low	113 Å²	113	82 Å²	82	69%	0.693	46%	0.455	S	S	*	.			trans	-106	8.2	-174.6	46.9	0	0	0	0	114	D127 G131	D127-T129 PolarHBondContact O-N 2.88Å; T129-G131 PolarHBondContact O-N 3.03Å
130	A	42.3	Very low	54.4	Low	61 Å²	61	77.3 Å²	77.3	50%	0.504	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	107.3	-175.9	0	0	0	0	0	111.5	F128	F128-A130 HydrophobicContact CD1-CB 4.31Å; F128-A130 HydrophobicContact CE1-CB 3.53Å; F128-A130 HydrophobicContact CE2-CB 4Å; F128-A130 HydrophobicContact CZ-CB 3.38Å
131	G	35.9	Very low	52.7	Low	86 Å²	86	81.3 Å²	81.3	89%	0.887	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	-4.6	173.1	0	0	0	0	0	115.9	T129	T129-G131 PolarHBondContact O-N 3.03Å
132	T	33.2	Very low	50.9	Low	61 Å²	61	88 Å²	88	37%	0.374	50%	0.504	S	S	.	.			trans	-108.3	102.2	178.2	40.6	0	0	0	0	111.3	Y269	T132-Y269 HydrophobicContact CG2-CE1 4.48Å
133	V	33.5	Very low	48.7	Very low	105 Å²	105	96.3 Å²	96.3	64%	0.636	54%	0.542	S	S	*	.			trans	-60.4	138.4	162.1	-71.3	0	0	0	0	109.1	A138	V133-A138 HydrophobicContact CG2-CB 3.97Å
134	S	34.7	Very low	46.8	Very low	53 Å²	53	103.4 Å²	103.4	37%	0.371	58%	0.58	S	S	.	*			trans	-59.4	148.7	174.3	-179.9	0	0	0	0	109.8	S136 E137 A138	S134-S136 WeakPolarHBondContact CB-OG 3.1Å; S134-S136 PolarHBondContact O-N 3.14Å; S134-S136 PolarHBondContact OG-N 3.17Å; S134-S136 PolarHBondContact OG-OG 3.2Å; S134-E137 WeakPolarHBondContact CB-OE2 3.03Å; S134-E137 PolarHBondContact N-OE2 3.18Å; S134-E137 WeakPolarHBondContact O-CA 3.42Å; S134-E137 PolarHBondContact O-N 3.04Å; S134-A138 PolarHBondContact O-N 2.87Å
135	L	41.5	Very low	44.9	Very low	105 Å²	105	103.1 Å²	103.1	55%	0.55	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.2	-22.9	170	-89	161.4	0	0	0	112.3	F139	L135-F139 HydrophobicContact CD2-CE2 3.92Å; L135-F139 VanDerWaalsContact O-CD2 3.26Å; L135-F139 WeakPolarHBondContact O-CD2 3.41Å
136	S	38.6	Very low	43	Very low	89 Å²	89	110.7 Å²	110.7	62%	0.622	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-23.8	171.5	54.3	0	0	0	0	114.2	S134	S134-S136 WeakPolarHBondContact CB-OG 3.1Å; S134-S136 PolarHBondContact O-N 3.14Å; S134-S136 PolarHBondContact OG-N 3.17Å; S134-S136 PolarHBondContact OG-OG 3.2Å
137	E	42.6	Very low	41.7	Very low	125 Å²	125	112.3 Å²	112.3	58%	0.584	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-31.8	-175.6	-65.1	164.9	146.7	0	0	111.5	S134 F139 A140	S134-E137 WeakPolarHBondContact CB-OE2 3.03Å; S134-E137 PolarHBondContact N-OE2 3.18Å; S134-E137 WeakPolarHBondContact O-CA 3.42Å; S134-E137 PolarHBondContact O-N 3.04Å; E137-F139 PolarHBondContact O-N 2.03Å; E137-A140 WeakPolarHBondContact O-CB 3Å; E137-A140 PolarHBondContact O-N 3.36Å
138	A	40.3	Very low	40.5	Very low	60 Å²	60	117 Å²	117	50%	0.496	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.8	-23.1	170.8	0	0	0	0	0	113.5	V133 S134	V133-A138 HydrophobicContact CG2-CB 3.97Å; S134-A138 PolarHBondContact O-N 2.87Å
139	F	40.6	Very low	39.4	Very low	162 Å²	162	120.8 Å²	120.8	71%	0.711	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	28.1	178.9	-65.1	-61	0	0	0	113.2	L135 E137 E141	L135-F139 HydrophobicContact CD2-CE2 3.92Å; L135-F139 VanDerWaalsContact O-CD2 3.26Å; L135-F139 WeakPolarHBondContact O-CD2 3.41Å; E137-F139 PolarHBondContact O-N 2.03Å; F139-E141 PolarHBondContact O-N 2.84Å
140	A	38.5	Very low	38.7	Very low	79 Å²	79	121.5 Å²	121.5	65%	0.653	69%	0.692	S	S	*	*			trans	-68.4	75.6	176.5	0	0	0	0	0	113.2	E137 K142	E137-A140 WeakPolarHBondContact O-CB 3Å; E137-A140 PolarHBondContact O-N 3.36Å; A140-K142 PolarHBondContact O-N 3.43Å
141	E	42.5	Very low	38.4	Very low	168 Å²	168	126 Å²	126	79%	0.785	71%	0.706	S	S	*	*			trans	25.7	88.5	150	-158.9	169.6	173	0	0	117.8	F139	F139-E141 PolarHBondContact O-N 2.84Å
142	K	40.3	Very low	38.4	Very low	200 Å²	200	131.4 Å²	131.4	87%	0.87	71%	0.708	S	S	*	*			trans	-77.2	124.1	150.5	-86.8	-170.6	176.2	178.9	0	109.5	A140 N144	A140-K142 PolarHBondContact O-N 3.43Å; K142-N144 VanDerWaalsContact C-N 3.26Å; K142-N144 PolarHBondContact O-N 3.25Å
143	Q	37.9	Very low	38.7	Very low	176 Å²	176	132 Å²	132	82%	0.822	73%	0.727	S	S	*	*	S	Bend	trans	-63.8	78.2	171.8	-65.7	179.6	-6.5	0	0	111.8
144	N	42.4	Very low	38.6	Very low	155 Å²	155	132.3 Å²	132.3	83%	0.829	73%	0.733	S	S	*	*	S	Bend	trans	-168.8	49.2	157.4	-106.4	-23.6	0	0	0	113.7	K142 Q146	K142-N144 VanDerWaalsContact C-N 3.26Å; K142-N144 PolarHBondContact O-N 3.25Å; N144-Q146 PolarHBondContact O-N 2.9Å
145	G	38.6	Very low	38.6	Very low	78 Å²	78	135.2 Å²	135.2	80%	0.804	75%	0.751	S	S	*	*			trans	67.6	11.1	140.3	0	0	0	0	0	121
146	Q	38.1	Very low	38.2	Very low	174 Å²	174	138.1 Å²	138.1	81%	0.813	77%	0.765	S	S	*	*			trans	-128.9	108.8	174.7	-80.3	-179.9	-104.7	0	0	112.7	N144	N144-Q146 PolarHBondContact O-N 2.9Å
147	P	38.1	Very low	38.4	Very low	115 Å²	115	141.2 Å²	141.2	75%	0.747	77%	0.773	S	S	*	*			trans	-72.8	124.8	167	-6	22.3	0	0	0	109.7	L149	P147-L149 PolarHBondContact O-N 2.73Å
148	Y	37.6	Very low	38	Very low	228 Å²	228	137.6 Å²	137.6	89%	0.894	77%	0.769	S	S	*	*			trans	-73	103.9	163.6	-91.9	-95.1	0	0	0	108.8
149	L	41.1	Very low	37.7	Very low	144 Å²	144	139.6 Å²	139.6	75%	0.754	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-74.4	125.1	165.2	-62.6	176.5	0	0	0	108.2	P147 I151	P147-L149 PolarHBondContact O-N 2.73Å; L149-I151 PolarHBondContact O-N 2.68Å
150	P	34.6	Very low	37.4	Very low	128 Å²	128	138 Å²	138	83%	0.831	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-62.4	119.2	171	-19.8	32.6	0	0	0	109.2
151	I	36.5	Very low	37.3	Very low	154 Å²	154	141.5 Å²	141.5	79%	0.79	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-66	134	174.6	-59.1	171.3	0	0	0	107.5	L149 G153	L149-I151 PolarHBondContact O-N 2.68Å; I151-G153 PolarHBondContact O-N 2.78Å
152	E	34.8	Very low	37.2	Very low	201 Å²	201	142.5 Å²	142.5	94%	0.939	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	116.2	174.4	-70.3	-170.7	131.9	0	0	110.2
153	G	39.7	Very low	37.1	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	115.7	7.5	161.8	0	0	0	0	0	119.6	I151	I151-G153 PolarHBondContact O-N 2.78Å
154	S	32.7	Very low	37.2	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	78%	0.779	S	S	*	*			trans	-157.1	149.3	168.4	-82.4	0	0	0	0	116.2
155	P	32.9	Very low	36.7	Very low	114 Å²	114	136.2 Å²	136.2	74%	0.74	78%	0.783	S	S	*	*			trans	-106.1	144.1	-169.7	39.4	-32.6	0	0	0	115.1
156	I	34.4	Very low	36.6	Very low	166 Å²	166	138.9 Å²	138.9	85%	0.851	78%	0.777	S	S	*	*			trans	-163.1	151.9	168.3	13.1	170.6	0	0	0	108
157	I	41.8	Very low	36.3	Very low	154 Å²	154	134.9 Å²	134.9	79%	0.79	77%	0.766	S	S	*	*			cis	-134.8	140	10.2	-54.5	173	0	0	0	110
158	G	35.6	Very low	36	Very low	48 Å²	48	135.6 Å²	135.6	50%	0.495	77%	0.774	S	S	.	*	S	Bend	trans	-114.2	165.4	150.4	0	0	0	0	0	109.5
159	P	33.3	Very low	35.8	Very low	103 Å²	103	131.9 Å²	131.9	67%	0.669	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-59.7	147.1	-177.7	26.5	-34.4	0	0	0	111.4	I161	P159-I161 PolarHBondContact O-N 2.66Å; P159-I161 VanDerWaalsContact O-N 3.14Å
160	P	34.5	Very low	35.3	Very low	128 Å²	128	133.7 Å²	133.7	83%	0.831	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-65.3	117	-175.6	26.8	-34	0	0	0	110.4
161	I	36.7	Very low	35.4	Very low	152 Å²	152	130.1 Å²	130.1	78%	0.779	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-78.8	119	167.5	-54.6	175.5	0	0	0	106.8	P159 S163	P159-I161 PolarHBondContact O-N 2.66Å; P159-I161 VanDerWaalsContact O-N 3.14Å; I161-S163 VanDerWaalsContact C-N 3.35Å; I161-S163 PolarHBondContact O-N 2.77Å
162	E	39	Very low	35.3	Very low	189 Å²	189	131.3 Å²	131.3	88%	0.883	75%	0.754	S	S	*	*			trans	-66.2	96.8	164.5	-71.4	-173.7	144.2	0	0	108.4	P164	E162-P164 WeakPolarHBondContact O-CD 3.34Å
163	S	39	Very low	35.1	Very low	94 Å²	94	133.5 Å²	133.5	66%	0.657	75%	0.753	S	S	*	*			trans	-57.6	127.4	170.9	-71	0	0	0	0	109.7	I161 Q165	I161-S163 VanDerWaalsContact C-N 3.35Å; I161-S163 PolarHBondContact O-N 2.77Å; S163-Q165 PolarHBondContact O-N 2.83Å
164	P	39.5	Very low	35.1	Very low	111 Å²	111	133.4 Å²	133.4	72%	0.721	74%	0.735	S	S	*	*			trans	-56.1	124.7	167.3	-20.8	31.9	0	0	0	108.7	E162 I166	E162-P164 WeakPolarHBondContact O-CD 3.34Å; P164-I166 VanDerWaalsContact C-N 3.25Å; P164-I166 PolarHBondContact O-N 3.4Å
165	Q	31.8	Very low	35.4	Very low	194 Å²	194	132.4 Å²	132.4	91%	0.907	73%	0.734	S	S	*	*			trans	-73.6	82.8	177.1	-64.6	-156.7	-21.3	0	0	110	S163 P167	S163-Q165 PolarHBondContact O-N 2.83Å; Q165-P167 WeakPolarHBondContact O-CD 2.96Å
166	I	36.4	Very low	35.7	Very low	134 Å²	134	134 Å²	134	69%	0.687	74%	0.736	S	S	*	*			trans	-74.2	118.4	166.4	-56.6	-178.3	0	0	0	106.9	P164 Y170	P164-I166 VanDerWaalsContact C-N 3.25Å; P164-I166 PolarHBondContact O-N 3.4Å; I166-Y170 HydrophobicContact CG2-CE2 4.46Å
167	P	32	Very low	36	Very low	91 Å²	91	129.5 Å²	129.5	59%	0.591	71%	0.714	S	S	*	*			trans	-61.1	143.2	-171	-26.1	35.4	0	0	0	113.8	Q165 M169	Q165-P167 WeakPolarHBondContact O-CD 2.96Å; P167-M169 VanDerWaalsContact C-N 3.29Å; P167-M169 PolarHBondContact O-N 3.1Å
168	S	31.2	Very low	35.6	Very low	130 Å²	130	128.9 Å²	128.9	91%	0.909	71%	0.709	S	S	*	*	S	Bend	trans	-71.1	78.8	173.3	59.4	0	0	0	0	111.3
169	M	34	Very low	35.4	Very low	150 Å²	150	130.3 Å²	130.3	74%	0.739	72%	0.716	S	S	*	*			trans	-141	35.7	-178.6	-144.3	-166	83.1	0	0	114.7	P167	P167-M169 VanDerWaalsContact C-N 3.29Å; P167-M169 PolarHBondContact O-N 3.1Å
170	Y	31	Very low	35.3	Very low	181 Å²	181	132.4 Å²	132.4	71%	0.71	73%	0.727	S	S	*	*			trans	-132.4	109.7	176.6	-48.3	-75.1	0	0	0	109.5	I166	I166-Y170 HydrophobicContact CG2-CE2 4.46Å
171	G	37.3	Very low	35.2	Very low	53 Å²	53	135.5 Å²	135.5	55%	0.546	73%	0.728	S	S	.	*			trans	-79.1	175.5	178.2	0	0	0	0	0	113.2	W173 N177	G171-W173 PolarHBondContact O-N 3.06Å; G171-N177 PolarHBondContact O-ND2 3.18Å
172	E	33.4	Very low	34.9	Very low	180 Å²	180	131.5 Å²	131.5	84%	0.841	72%	0.724	S	S	*	*			trans	-35.2	118.2	-177.1	-87.4	-178.2	132.4	0	0	114.1	N174 N177	E172-N174 PolarHBondContact O-N 2.84Å; E172-N174 PolarHBondContact O-ND2 2.81Å; E172-N177 PolarHBondContact O-ND2 3.45Å
173	W	30.3	Very low	34.4	Very low	247 Å²	247	131 Å²	131	94%	0.936	73%	0.727	S	S	*	*			trans	-56.4	104.5	175.8	-77.7	85.8	0	0	0	110.7	G171	G171-W173 PolarHBondContact O-N 3.06Å
174	N	39.8	Very low	34	Very low	71 Å²	71	128.9 Å²	128.9	38%	0.38	72%	0.721	S	S	.	*			trans	-136	166.6	172.1	74.3	82.5	0	0	0	109.3	E172 N176 N177	E172-N174 PolarHBondContact O-N 2.84Å; E172-N174 PolarHBondContact O-ND2 2.81Å; N174-N176 PolarHBondContact O-N 3.35Å; N174-N176 VanDerWaalsContact OD1-CB 3.31Å; N174-N176 WeakPolarHBondContact OD1-CB 3.41Å; N174-N176 PolarHBondContact OD1-N 2.84Å; N174-N176 PolarHBondContact OD1-ND2 2.96Å; N174-N177 VanDerWaalsContact ND2-CG 3.28Å; N174-N177 PolarHBondContact ND2-ND2 3.23Å; N174-N177 PolarHBondContact ND2-OD1 3.18Å; N174-N177 PolarHBondContact O-N 2.92Å; N174-N177 PolarHBondContact OD1-OD1 3.29Å
175	A	39.9	Very low	33.5	Very low	90 Å²	90	131.5 Å²	131.5	74%	0.744	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-14.3	-172.7	0	0	0	0	0	115.1
176	N	39.5	Very low	33.3	Very low	147 Å²	147	130.1 Å²	130.1	79%	0.786	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-2.2	179.5	-47.4	-63.2	0	0	0	113.6	N174	N174-N176 PolarHBondContact O-N 3.35Å; N174-N176 VanDerWaalsContact OD1-CB 3.31Å; N174-N176 WeakPolarHBondContact OD1-CB 3.41Å; N174-N176 PolarHBondContact OD1-N 2.84Å; N174-N176 PolarHBondContact OD1-ND2 2.96Å
177	N	39.7	Very low	33	Very low	73 Å²	73	131.5 Å²	131.5	39%	0.39	72%	0.719	S	S	.	*			trans	-105.7	10.5	-172.5	-62.2	18	0	0	0	113.7	G171 E172 N174 A179	G171-N177 PolarHBondContact O-ND2 3.18Å; E172-N177 PolarHBondContact O-ND2 3.45Å; N174-N177 VanDerWaalsContact ND2-CG 3.28Å; N174-N177 PolarHBondContact ND2-ND2 3.23Å; N174-N177 PolarHBondContact ND2-OD1 3.18Å; N174-N177 PolarHBondContact O-N 2.92Å; N174-N177 PolarHBondContact OD1-OD1 3.29Å; N177-A179 PolarHBondContact O-N 2.83Å; N177-A179 VanDerWaalsContact O-N 3.11Å
178	M	33.6	Very low	32.9	Very low	141 Å²	141	135.8 Å²	135.8	70%	0.695	73%	0.731	S	S	*	*			trans	-63.6	115.4	-179.5	-70.4	179.7	71.3	0	0	110.3	T180	M178-T180 PolarHBondContact O-N 2.96Å
179	A	32.5	Very low	32.8	Very low	78 Å²	78	135.1 Å²	135.1	65%	0.645	72%	0.717	S	S	*	*			trans	-60.9	123.1	178.1	0	0	0	0	0	110.2	N177 F181	N177-A179 PolarHBondContact O-N 2.83Å; N177-A179 VanDerWaalsContact O-N 3.11Å; A179-F181 HydrophobicContact CB-CD2 4.47Å; A179-F181 HydrophobicContact CB-CE2 4.39Å; A179-F181 PolarHBondContact O-N 3.26Å
180	T	30.5	Very low	32.4	Very low	146 Å²	146	135.6 Å²	135.6	90%	0.896	72%	0.721	S	S	*	*			trans	-70.7	93.9	-176.5	-19.5	0	0	0	0	110.7	M178	M178-T180 PolarHBondContact O-N 2.96Å
181	F	31.6	Very low	32.3	Very low	194 Å²	194	135.9 Å²	135.9	85%	0.851	73%	0.727	S	S	*	*			trans	-91.9	136.2	160.5	-79.8	-91.3	0	0	0	108.9	A179	A179-F181 HydrophobicContact CB-CD2 4.47Å; A179-F181 HydrophobicContact CB-CE2 4.39Å; A179-F181 PolarHBondContact O-N 3.26Å
182	G	30.9	Very low	31.7	Very low	68 Å²	68	138.6 Å²	138.6	70%	0.701	74%	0.738	S	S	*	*	S	Bend	trans	-70.2	150	-159.6	0	0	0	0	0	116.1
183	D	28.4	Very low	31.4	Very low	177 Å²	177	134.6 Å²	134.6	95%	0.947	73%	0.73	S	S	*	*			trans	49.3	74.1	154.4	-56.9	-19.4	0	0	0	118
184	G	30.3	Very low	31.2	Very low	51 Å²	51	128 Å²	128	53%	0.526	72%	0.721	S	S	.	*			trans	-149.1	122.9	163.3	0	0	0	0	0	111.6
185	I	30.1	Very low	30.8	Very low	165 Å²	165	130.8 Å²	130.8	85%	0.846	75%	0.746	S	S	*	*			trans	-82.3	125	-177	-58	171.9	0	0	0	109.7
186	Y	26	Very low	30.4	Very low	165 Å²	165	133 Å²	133	65%	0.647	74%	0.741	S	S	*	*			trans	-89.4	122.8	174.7	-74.8	-97.7	0	0	0	111.3
187	E	30.5	Very low	29.9	Very low	164 Å²	164	133.7 Å²	133.7	77%	0.766	75%	0.745	S	S	*	*			trans	-107.3	130.3	159.8	-81.1	-159.1	147.5	0	0	110.7
188	Q	30.3	Very low	29.4	Very low	181 Å²	181	133.7 Å²	133.7	85%	0.846	74%	0.742	S	S	*	*			trans	-95.8	112.1	172	-68.8	-178	-10.3	0	0	109.9
189	N	29.2	Very low	29.2	Very low	115 Å²	115	134.3 Å²	134.3	62%	0.615	75%	0.748	S	S	*	*			trans	-112	106.2	172.6	-77.6	-61.4	0	0	0	110.2	F191	N189-F191 HydrophobicContact CB-CD2 4.4Å; N189-F191 HydrophobicContact CB-CE2 4.06Å
190	L	26.6	Very low	29.1	Very low	160 Å²	160	134.7 Å²	134.7	84%	0.838	75%	0.745	S	S	*	*			trans	-77.3	123.8	169	-83.4	89.4	0	0	0	109.9
191	F	27.4	Very low	29.1	Very low	187 Å²	187	133.9 Å²	133.9	82%	0.82	74%	0.736	S	S	*	*			trans	-117.5	132.7	163.9	-77.5	-82	0	0	0	110.3	N189	N189-F191 HydrophobicContact CB-CD2 4.4Å; N189-F191 HydrophobicContact CB-CE2 4.06Å
192	S	24.8	Very low	29	Very low	111 Å²	111	130.2 Å²	130.2	78%	0.776	73%	0.729	S	S	*	*			trans	-119.6	115.1	-172.9	43.2	0	0	0	0	111.3
193	S	27.1	Very low	28.8	Very low	96 Å²	96	135.8 Å²	135.8	67%	0.671	73%	0.73	S	S	*	*			trans	-147.5	113.6	171	57.8	0	0	0	0	111.4
194	S	27	Very low	28.8	Very low	109 Å²	109	135.1 Å²	135.1	76%	0.762	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	37.9	105.6	163	52.3	0	0	0	0	118.5	Q196	S194-Q196 PolarHBondContact O-N 3.03Å
195	S	31.4	Very low	28.7	Very low	129 Å²	129	135.6 Å²	135.6	90%	0.902	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.4	-10.7	161.5	62.6	0	0	0	0	121.2
196	Q	31	Very low	28.5	Very low	135 Å²	135	131.8 Å²	131.8	63%	0.631	73%	0.733	S	S	*	*			trans	-137.4	119.8	168.6	-70.3	-179.1	-34.5	0	0	111.9	S194 H198	S194-Q196 PolarHBondContact O-N 3.03Å; Q196-H198 PolarHBondContact O-N 3.05Å
197	N	28.9	Very low	28.7	Very low	163 Å²	163	129.8 Å²	129.8	87%	0.872	74%	0.737	S	S	*	*			trans	-82.2	100.3	172.4	-75.2	-24.2	0	0	0	109.2
198	H	30.1	Very low	28.6	Very low	73 Å²	73	126.4 Å²	126.4	34%	0.338	75%	0.747	S	S	.	*			trans	-89.6	119.7	173.5	-77.4	-92.6	0	0	0	111.4	Q196 S200	Q196-H198 PolarHBondContact O-N 3.05Å; H198-S200 PolarHBondContact O-N 3.14Å
199	L	28.3	Very low	28.5	Very low	154 Å²	154	124 Å²	124	81%	0.806	74%	0.735	S	S	*	*			trans	-84.2	95.7	165.6	-81.3	157.1	0	0	0	108.9
200	S	30.4	Very low	28.4	Very low	85 Å²	85	129.5 Å²	129.5	59%	0.594	75%	0.747	S	S	*	*			trans	-88.5	114	170.5	-73	0	0	0	0	110.8	H198	H198-S200 PolarHBondContact O-N 3.14Å
201	N	31.1	Very low	28.5	Very low	130 Å²	130	126.7 Å²	126.7	70%	0.695	73%	0.727	S	S	*	*			trans	-87.9	105.2	166.9	-80.6	-20.9	0	0	0	109.5	Y203	N201-Y203 PolarHBondContact O-N 3.49Å
202	T	29.6	Very low	28.7	Very low	116 Å²	116	125.1 Å²	125.1	71%	0.712	72%	0.722	S	S	*	*			trans	-83.1	108.8	176.3	-47.1	0	0	0	0	110.2
203	Y	27.1	Very low	28.9	Very low	186 Å²	186	126.7 Å²	126.7	73%	0.729	72%	0.717	S	S	*	*			trans	-83	118.9	171.1	-83.1	-90.5	0	0	0	110.8	N201	N201-Y203 PolarHBondContact O-N 3.49Å
204	L	27.8	Very low	28.9	Very low	162 Å²	162	128.4 Å²	128.4	85%	0.848	72%	0.716	S	S	*	*			trans	-98.4	84.6	168	-78.5	166.1	0	0	0	109.3
205	G	27.9	Very low	28.8	Very low	61 Å²	61	130.6 Å²	130.6	63%	0.629	71%	0.712	S	S	*	*			trans	-110.5	133.2	171.6	0	0	0	0	0	110.5	T207	G205-T207 PolarHBondContact O-N 2.96Å
206	G	26.7	Very low	28.7	Very low	86 Å²	86	128.9 Å²	128.9	89%	0.887	70%	0.696	S	S	*	*	S	Bend	trans	-74.8	76.1	-164.2	0	0	0	0	0	117
207	T	29.9	Very low	28.5	Very low	122 Å²	122	130 Å²	130	75%	0.748	70%	0.702	S	S	*	*	S	Bend	trans	-163.1	81.7	148	40.9	0	0	0	0	110.9	G205 E209	G205-T207 PolarHBondContact O-N 2.96Å; T207-E209 VanDerWaalsContact C-N 3.26Å; T207-E209 PolarHBondContact O-N 2.88Å
208	G	27.3	Very low	28.4	Very low	93 Å²	93	129.6 Å²	129.6	96%	0.959	70%	0.699	S	S	*	*	S	Bend	trans	57.8	-14.6	149.3	0	0	0	0	0	122.8
209	E	29.1	Very low	28.3	Very low	130 Å²	130	135.1 Å²	135.1	61%	0.607	72%	0.722	S	S	*	*			trans	-103.5	121.3	-166.2	-64.7	-168.7	144.6	0	0	112.9	T207 Y211	T207-E209 VanDerWaalsContact C-N 3.26Å; T207-E209 PolarHBondContact O-N 2.88Å; E209-Y211 HydrophobicContact CB-CD2 4.23Å; E209-Y211 HydrophobicContact CB-CE2 4Å; E209-Y211 PolarHBondContact O-N 3.37Å
210	R	28.2	Very low	28.1	Very low	231 Å²	231	137 Å²	137	87%	0.872	73%	0.729	S	S	*	*			trans	-98	85.3	-168.2	-163.4	-177.5	-172.3	-154.6	-0.3	110.7
211	Y	27.1	Very low	28	Very low	102 Å²	102	136.4 Å²	136.4	40%	0.4	74%	0.737	S	S	.	*			trans	-96.5	110	175.9	-75.9	-73.8	0	0	0	112.2	E209 T251 Q253	E209-Y211 HydrophobicContact CB-CD2 4.23Å; E209-Y211 HydrophobicContact CB-CE2 4Å; E209-Y211 PolarHBondContact O-N 3.37Å; Y211-T251 WeakPolarHBondContact OH-CB 3.39Å; Y211-T251 PolarHBondContact OH-OG1 2.03Å; Y211-T251 VanDerWaalsContact OH-OG1 3.07Å; Y211-Q253 HydrophobicContact CD1-CG 4.4Å; Y211-Q253 VanDerWaalsContact CE1-CD 3.49Å; Y211-Q253 HydrophobicContact CE1-CG 3.75Å
212	E	31.6	Very low	27.7	Very low	153 Å²	153	141.3 Å²	141.3	72%	0.715	75%	0.747	S	S	*	*			trans	-82.1	113.1	167.6	-67.1	-170	146.5	0	0	110
213	Q	29	Very low	27.5	Very low	144 Å²	144	142 Å²	142	67%	0.673	75%	0.747	S	S	*	*			trans	-99.7	102.4	169.2	-70	-172.8	4.1	0	0	110	F215	Q213-F215 PolarHBondContact O-N 2.85Å
214	M	26.8	Very low	27.7	Very low	133 Å²	133	140.6 Å²	140.6	66%	0.655	75%	0.752	S	S	*	*			trans	-76.4	107	168.9	-72.6	-171.8	178.5	0	0	110.3	T216	M214-T216 PolarHBondContact O-N 3.32Å
215	F	26	Very low	27.6	Very low	155 Å²	155	137.5 Å²	137.5	68%	0.68	74%	0.744	S	S	*	*			trans	-82	100.5	166.4	-91.2	-92.7	0	0	0	110.6	Q213	Q213-F215 PolarHBondContact O-N 2.85Å
216	T	28.3	Very low	27.5	Very low	92 Å²	92	142 Å²	142	56%	0.564	75%	0.753	S	S	*	*			trans	-89.5	100.3	165.2	29	0	0	0	0	110.5	M214 N218	M214-T216 PolarHBondContact O-N 3.32Å; T216-N218 PolarHBondContact O-N 3.28Å; T216-N218 VanDerWaalsContact O-N 3.14Å
217	Q	27	Very low	27.6	Very low	160 Å²	160	147 Å²	147	75%	0.748	76%	0.755	S	S	*	*			trans	-73.4	98.6	165.8	-73.5	-172	-3.6	0	0	109.9	F219	Q217-F219 PolarHBondContact O-N 2.75Å
218	N	27.2	Very low	27.4	Very low	153 Å²	153	144.7 Å²	144.7	82%	0.818	76%	0.755	S	S	*	*			trans	-75.6	106.4	167.5	-81.8	-22.6	0	0	0	109.8	T216	T216-N218 PolarHBondContact O-N 3.28Å; T216-N218 VanDerWaalsContact O-N 3.14Å
219	F	27.4	Very low	27.2	Very low	189 Å²	189	146.1 Å²	146.1	83%	0.829	75%	0.751	S	S	*	*			trans	-63.9	138.4	164.3	-90.9	-101.3	0	0	0	110.1	Q217 G221	Q217-F219 PolarHBondContact O-N 2.75Å; F219-G221 PolarHBondContact O-N 3.18Å
220	M	25.2	Very low	27.1	Very low	193 Å²	193	151.6 Å²	151.6	95%	0.951	77%	0.766	S	S	*	*			trans	-60.4	130.2	-179.9	-65.2	172.7	-80.4	0	0	111.5
221	G	27	Very low	26.9	Very low	74 Å²	74	144.1 Å²	144.1	76%	0.763	76%	0.761	S	S	*	*			trans	-156	102.9	-178.5	0	0	0	0	0	112.2	F219	F219-G221 PolarHBondContact O-N 3.18Å
222	Y	26.2	Very low	26.9	Very low	232 Å²	232	150.4 Å²	150.4	91%	0.91	79%	0.785	S	S	*	*			trans	-25.4	152.4	175.2	-85.5	-103.9	0	0	0	120.8
223	D	25.3	Very low	26.6	Very low	132 Å²	132	146 Å²	146	71%	0.706	78%	0.781	S	S	*	*			trans	-16.8	132.8	156.7	-125	-46.5	0	0	0	116.4
224	D	30.4	Very low	26.6	Very low	156 Å²	156	145.5 Å²	145.5	83%	0.834	79%	0.79	S	S	*	*			trans	-153.7	106.6	132.1	-123.3	-25.4	0	0	0	111.4	L226	D224-L226 PolarHBondContact O-N 3.45Å
225	S	25.2	Very low	26.5	Very low	96 Å²	96	144.2 Å²	144.2	67%	0.671	79%	0.79	S	S	*	*			trans	-76	104.6	163.5	-65.9	0	0	0	0	108.8
226	L	26.4	Very low	26.4	Very low	157 Å²	157	143 Å²	143	82%	0.822	80%	0.796	S	S	*	*			trans	173.8	151.6	153.7	-95.9	153.8	0	0	0	111.6	D224	D224-L226 PolarHBondContact O-N 3.45Å
227	M	28.5	Very low	26.2	Very low	190 Å²	190	147.6 Å²	147.6	94%	0.936	80%	0.804	S	S	*	*			trans	68	137.4	-179.2	-41	-165.4	-167.5	0	0	114.4
228	G	25.1	Very low	26	Very low	73 Å²	73	147.6 Å²	147.6	75%	0.753	81%	0.809	S	S	*	*			cis	160.1	112.3	2.8	0	0	0	0	0	108.9	R230	G228-R230 PolarHBondContact O-N 3.47Å
229	S	24.6	Very low	26	Very low	123 Å²	123	149 Å²	149	86%	0.86	81%	0.813	S	S	*	*			trans	-45.3	124.7	-169.9	-42.8	0	0	0	0	115.6
230	R	26.4	Very low	25.8	Very low	245 Å²	245	145 Å²	145	93%	0.925	82%	0.815	S	S	*	*			trans	-163.8	115.2	150.3	-105.6	162.9	-154.6	-142	4.5	109.7	G228	G228-R230 PolarHBondContact O-N 3.47Å
231	G	24	Very low	25.7	Very low	74 Å²	74	141.9 Å²	141.9	76%	0.763	81%	0.812	S	S	*	*			trans	-84.7	157.8	-179.4	0	0	0	0	0	113.4
232	Y	27.9	Very low	25.7	Very low	234 Å²	234	143.2 Å²	143.2	92%	0.918	82%	0.816	S	S	*	*			trans	-136.7	132.9	159.1	-96.2	-90.4	0	0	0	108
233	G	25	Very low	25.6	Very low	61 Å²	61	135.5 Å²	135.5	63%	0.629	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-79.3	169.9	-178.4	0	0	0	0	0	113.3
234	P	29.2	Very low	25.6	Very low	133 Å²	133	137.5 Å²	137.5	86%	0.864	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-71	133.7	-175.8	29.5	-34.5	0	0	0	111.8
235	T	25.1	Very low	25.2	Very low	106 Å²	106	134.7 Å²	134.7	65%	0.65	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-80.1	128.5	170	40.4	0	0	0	0	110.7	Y237	T235-Y237 WeakPolarHBondContact OG1-CE2 3.02Å
236	T	23.1	Very low	25.2	Very low	131 Å²	131	138 Å²	138	80%	0.804	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-81	134.6	173.9	50.1	0	0	0	0	110.7
237	Y	24.8	Very low	25.1	Very low	187 Å²	187	134.8 Å²	134.8	73%	0.733	82%	0.819	S	S	*	*			trans	-129.4	110.5	169.2	-63.9	-75.5	0	0	0	110.5	T235	T235-Y237 WeakPolarHBondContact OG1-CE2 3.02Å
238	D	21.6	Very low	24.8	Very low	161 Å²	161	134.8 Å²	134.8	86%	0.861	81%	0.81	S	S	*	*			trans	-72.6	134.9	167.5	-69.7	-63.1	0	0	0	110.5
239	M	26.7	Very low	24.8	Very low	182 Å²	182	135.8 Å²	135.8	90%	0.897	81%	0.806	S	S	*	*			trans	-137.4	140.6	160.4	-67.1	-162.1	-170.1	0	0	110.9
240	A	24.7	Very low	24.8	Very low	104 Å²	104	138.5 Å²	138.5	86%	0.86	80%	0.804	S	S	*	*			trans	-84.9	155.6	-157.5	0	0	0	0	0	115.3
241	S	22.8	Very low	24.9	Very low	129 Å²	129	129.9 Å²	129.9	90%	0.902	78%	0.779	S	S	*	*			trans	-65.8	129.4	176.8	-43.5	0	0	0	0	113.3
242	A	26.8	Very low	25	Very low	102 Å²	102	130.1 Å²	130.1	84%	0.843	78%	0.782	S	S	*	*			trans	-123.3	130.1	157.4	0	0	0	0	0	108.1
243	G	24.1	Very low	24.9	Very low	70 Å²	70	125.8 Å²	125.8	72%	0.722	77%	0.77	S	S	*	*			trans	-87.5	178.1	-164.9	0	0	0	0	0	116.3
244	N	24.4	Very low	24.9	Very low	173 Å²	173	127.5 Å²	127.5	93%	0.925	78%	0.778	S	S	*	*			trans	72.8	79.4	163.6	-57.3	-14.2	0	0	0	118.2
245	A	23.7	Very low	24.8	Very low	97 Å²	97	130.2 Å²	130.2	80%	0.802	78%	0.779	S	S	*	*				168.8	103.4	125	0	0	0	0	0	110.6	A247	A245-A247 PolarHBondContact O-N 2.79Å
246	M	23.8	Very low	24.9	Very low	166 Å²	166	133.9 Å²	133.9	82%	0.818	78%	0.782	S	S	*	*			trans	-85.8	88	172.7	-65.1	-129.2	-63.4	0	0	110.4
247	A	23.9	Very low	25.2	Very low	90 Å²	90	131.2 Å²	131.2	74%	0.744	76%	0.763	S	S	*	*			trans	-95.6	116.8	161.4	0	0	0	0	0	108.4	A245 S249	A245-A247 PolarHBondContact O-N 2.79Å; A247-S249 PolarHBondContact O-N 2.04Å
248	Y	23.4	Very low	25.4	Very low	190 Å²	190	126.4 Å²	126.4	75%	0.745	75%	0.754	S	S	*	*			trans	-74.4	104	175	-73.9	-98.2	0	0	0	109.7
249	S	24.4	Very low	25.7	Very low	94 Å²	94	127.1 Å²	127.1	66%	0.657	75%	0.746	S	S	*	*			trans	-102.2	111.3	163.8	56.5	0	0	0	0	110.3	A247 T251	A247-S249 PolarHBondContact O-N 2.04Å; S249-T251 PolarHBondContact O-N 3.33Å
250	H	25.2	Very low	25.9	Very low	179 Å²	179	120.2 Å²	120.2	83%	0.829	72%	0.718	S	S	*	*			trans	-86.8	87.3	169.4	-82.1	-93.8	0	0	0	109.5
251	T	27.4	Very low	26.1	Very low	65 Å²	65	117.8 Å²	117.8	40%	0.399	69%	0.693	S	S	.	*			trans	-110.3	84.1	169.6	53.5	0	0	0	0	110.7	Y211 S249 Q253	Y211-T251 WeakPolarHBondContact OH-CB 3.39Å; Y211-T251 PolarHBondContact OH-OG1 2.03Å; Y211-T251 VanDerWaalsContact OH-OG1 3.07Å; S249-T251 PolarHBondContact O-N 3.33Å; T251-Q253 PolarHBondContact O-N 2.93Å
252	G	26.6	Very low	26.4	Very low	79 Å²	79	113.9 Å²	113.9	81%	0.814	67%	0.666	S	S	*	*			trans	-67.2	101.9	172.1	0	0	0	0	0	110.8	A254	G252-A254 PolarHBondContact O-N 2.74Å
253	Q	25.7	Very low	26.6	Very low	143 Å²	143	112.4 Å²	112.4	67%	0.668	64%	0.639	S	S	*	*			trans	-69.7	98.8	172.6	-77.3	169.5	-94.5	0	0	110.1	Y211 T251 H255	Y211-Q253 HydrophobicContact CD1-CG 4.4Å; Y211-Q253 VanDerWaalsContact CE1-CD 3.49Å; Y211-Q253 HydrophobicContact CE1-CG 3.75Å; T251-Q253 PolarHBondContact O-N 2.93Å; Q253-H255 PolarHBondContact O-N 3.28Å
254	A	26	Very low	27	Very low	97 Å²	97	114.2 Å²	114.2	80%	0.802	62%	0.624	S	S	*	*			trans	-64.6	112.1	168.1	0	0	0	0	0	109.5	G252 Y256	G252-A254 PolarHBondContact O-N 2.74Å; A254-Y256 PolarHBondContact O-N 3.32Å; A254-Y256 VanDerWaalsContact O-N 3.14Å
255	H	26.1	Very low	27.4	Very low	189 Å²	189	113.3 Å²	113.3	88%	0.875	62%	0.615	S	S	*	*			trans	-74.1	104	174.3	-140.8	-88	0	0	0	108.4	Q253 D257	Q253-H255 PolarHBondContact O-N 3.28Å; H255-D257 PolarHBondContact O-N 2.67Å
256	Y	26.8	Very low	27.7	Very low	183 Å²	183	115.5 Å²	115.5	72%	0.718	61%	0.608	S	S	*	*			trans	-74.2	97.2	-176.9	-161.2	-83.8	0	0	0	109.8	A254 P258	A254-Y256 PolarHBondContact O-N 3.32Å; A254-Y256 VanDerWaalsContact O-N 3.14Å; Y256-P258 VanDerWaalsContact O-CD 3.24Å; Y256-P258 WeakPolarHBondContact O-CD 3.38Å
257	D	30	Very low	28.3	Very low	76 Å²	76	112.2 Å²	112.2	41%	0.406	59%	0.591	S	S	.	*			trans	-82.9	109.3	170.4	179.2	10.8	0	0	0	110.1	H255 Y259 A260 T261	H255-D257 PolarHBondContact O-N 2.67Å; D257-Y259 PolarHBondContact O-N 3.41Å; D257-Y259 WeakPolarHBondContact OD1-CB 3.12Å; D257-Y259 WeakPolarHBondContact OD1-CD2 3.35Å; D257-Y259 PolarHBondContact OD1-N 2.95Å; D257-A260 HydrophobicContact CB-CB 4.01Å; D257-A260 PolarHBondContact O-N 3.36Å; D257-A260 PolarHBondContact OD2-N 2.71Å; D257-T261 PolarHBondContact O-OG1 3.32Å
258	P	28.7	Very low	28.6	Very low	85 Å²	85	110.9 Å²	110.9	55%	0.552	59%	0.586	S	S	*	*	H	α-helix	trans	-63.7	-19.6	177.8	28.1	-35.7	0	0	0	113.2	Y256	Y256-P258 VanDerWaalsContact O-CD 3.24Å; Y256-P258 WeakPolarHBondContact O-CD 3.38Å
259	Y	29.2	Very low	28.9	Very low	176 Å²	176	108.2 Å²	108.2	69%	0.69	58%	0.575	S	S	*	*	H	α-helix	trans	-77.7	-36.1	175.6	-65.6	-81.5	0	0	0	112.2	D257 T261 S262 Y263	D257-Y259 PolarHBondContact O-N 3.41Å; D257-Y259 WeakPolarHBondContact OD1-CB 3.12Å; D257-Y259 WeakPolarHBondContact OD1-CD2 3.35Å; D257-Y259 PolarHBondContact OD1-N 2.95Å; Y259-T261 VanDerWaalsContact C-N 3.34Å; Y259-T261 PolarHBondContact O-N 2.89Å; Y259-S262 PolarHBondContact O-N 3.3Å; Y259-S262 PolarHBondContact O-OG 2.7Å; Y259-Y263 PolarHBondContact O-N 3.25Å; Y259-Y263 VanDerWaalsContact O-N 3.12Å
260	A	30.6	Very low	29.3	Very low	38 Å²	38	108.3 Å²	108.3	31%	0.314	58%	0.576	S	S	.	*	H	α-helix	trans	-58.4	-45.1	175.2	0	0	0	0	0	111.6	D257 S262 Y263 Y264	D257-A260 HydrophobicContact CB-CB 4.01Å; D257-A260 PolarHBondContact O-N 3.36Å; D257-A260 PolarHBondContact OD2-N 2.71Å; A260-S262 VanDerWaalsContact C-N 3.29Å; A260-S262 PolarHBondContact O-N 3.37Å; A260-Y263 WeakPolarHBondContact O-CB 3.22Å; A260-Y263 PolarHBondContact O-N 3Å; A260-Y263 VanDerWaalsContact O-N 3.09Å; A260-Y264 VanDerWaalsContact O-CD2 3.22Å; A260-Y264 WeakPolarHBondContact O-CD2 3.49Å; A260-Y264 PolarHBondContact O-N 2.78Å
261	T	29.2	Very low	29.6	Very low	52 Å²	52	102.5 Å²	102.5	32%	0.319	56%	0.564	S	S	.	*	H	α-helix	trans	-59.6	-40.3	178	-30.3	0	0	0	0	112.1	D257 Y259 Y263 Q265	D257-T261 PolarHBondContact O-OG1 3.32Å; Y259-T261 VanDerWaalsContact C-N 3.34Å; Y259-T261 PolarHBondContact O-N 2.89Å; T261-Y263 VanDerWaalsContact C-N 3.29Å; T261-Y263 PolarHBondContact O-N 3.21Å; T261-Q265 WeakPolarHBondContact O-CB 3.42Å; T261-Q265 WeakPolarHBondContact O-CG 3.18Å; T261-Q265 PolarHBondContact O-N 3.07Å
262	S	27.9	Very low	29.7	Very low	48 Å²	48	106.1 Å²	106.1	34%	0.336	59%	0.587	S	S	.	*	H	α-helix	trans	-65.9	-32.2	177.7	80.1	0	0	0	0	112.7	Y259 A260 Q266	Y259-S262 PolarHBondContact O-N 3.3Å; Y259-S262 PolarHBondContact O-OG 2.7Å; A260-S262 VanDerWaalsContact C-N 3.29Å; A260-S262 PolarHBondContact O-N 3.37Å; S262-Q266 WeakPolarHBondContact O-CB 3.07Å; S262-Q266 WeakPolarHBondContact O-CG 3.49Å; S262-Q266 PolarHBondContact O-N 3.41Å
263	Y	30.8	Very low	29.8	Very low	71 Å²	71	111.1 Å²	111.1	28%	0.278	58%	0.582	S	S	.	*	H	α-helix	trans	-75.3	-45.7	-176.5	-167.7	-99.1	0	0	0	112.8	A97 Y259 A260 T261 Q265 Q266 H267	A97-Y263 VanDerWaalsContact CA-OH 3.23Å; A97-Y263 WeakPolarHBondContact CA-OH 3.34Å; A97-Y263 HydrophobicContact CB-CE1 3.85Å; A97-Y263 VanDerWaalsContact CB-OH 3.23Å; A97-Y263 WeakPolarHBondContact CB-OH 3.47Å; A97-Y263 WeakPolarHBondContact O-CE1 3.44Å; A97-Y263 VanDerWaalsContact O-CZ 3.24Å; A97-Y263 PolarHBondContact O-OH 3.24Å; Y259-Y263 PolarHBondContact O-N 3.25Å; Y259-Y263 VanDerWaalsContact O-N 3.12Å; A260-Y263 WeakPolarHBondContact O-CB 3.22Å; A260-Y263 PolarHBondContact O-N 3Å; A260-Y263 VanDerWaalsContact O-N 3.09Å; T261-Y263 VanDerWaalsContact C-N 3.29Å; T261-Y263 PolarHBondContact O-N 3.21Å; Y263-Q265 VanDerWaalsContact C-N 3.29Å; Y263-Q265 PolarHBondContact O-N 2.85Å; Y263-Q266 PolarHBondContact O-N 2.8Å; Y263-H267 AromaticContact CD2-CD2 3.94Å; Y263-H267 AromaticContact CE1-CD2 3.82Å; Y263-H267 AromaticContact CE2-CD2 3.41Å; Y263-H267 VanDerWaalsContact CE2-CD2 3.41Å; Y263-H267 WeakPolarHBondContact CE2-CD2 3.49Å; Y263-H267 AromaticContact CE2-NE2 3.39Å; Y263-H267 WeakPolarHBondContact CE2-NE2 3.41Å; Y263-H267 AromaticContact CZ-CD2 3.33Å; Y263-H267 AromaticContact CZ-NE2 3.57Å; Y263-H267 PolarHBondContact O-N 3.4Å; Y263-H267 PolarHBondContact OH-CD2 3.42Å; Y263-H267 PolarHBondContact OH-NE2 3.19Å
264	Y	34	Very low	29.8	Very low	107 Å²	107	107 Å²	107	42%	0.42	58%	0.578	S	S	.	*	H	α-helix	trans	-66.9	-31.4	175.5	-70.2	-73.6	0	0	0	112.4	A260 Y269	A260-Y264 VanDerWaalsContact O-CD2 3.22Å; A260-Y264 WeakPolarHBondContact O-CD2 3.49Å; A260-Y264 PolarHBondContact O-N 2.78Å; Y264-Y269 PolarHBondContact O-N 3.41Å
265	Q	32.1	Very low	29.8	Very low	154 Å²	154	111.9 Å²	111.9	72%	0.72	58%	0.584	S	S	*	*	H	α-helix	trans	-74.2	-31.4	174.4	-75.2	175.3	-22	0	0	113.6	T261 Y263	T261-Q265 WeakPolarHBondContact O-CB 3.42Å; T261-Q265 WeakPolarHBondContact O-CG 3.18Å; T261-Q265 PolarHBondContact O-N 3.07Å; Y263-Q265 VanDerWaalsContact C-N 3.29Å; Y263-Q265 PolarHBondContact O-N 2.85Å
266	Q	30.9	Very low	29.8	Very low	144 Å²	144	109.5 Å²	109.5	67%	0.673	58%	0.576	S	S	*	*	H	α-helix	trans	-76.5	-25.1	176.8	-80	-177.5	2.4	0	0	114.3	S262 Y263	S262-Q266 WeakPolarHBondContact O-CB 3.07Å; S262-Q266 WeakPolarHBondContact O-CG 3.49Å; S262-Q266 PolarHBondContact O-N 3.41Å; Y263-Q266 PolarHBondContact O-N 2.8Å
267	H	35.1	Very low	29.8	Very low	97 Å²	97	103.8 Å²	103.8	45%	0.449	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.9	13.2	-174.9	-71.2	-61.8	0	0	0	115.3	Y263 Y269	Y263-H267 AromaticContact CD2-CD2 3.94Å; Y263-H267 AromaticContact CE1-CD2 3.82Å; Y263-H267 AromaticContact CE2-CD2 3.41Å; Y263-H267 VanDerWaalsContact CE2-CD2 3.41Å; Y263-H267 WeakPolarHBondContact CE2-CD2 3.49Å; Y263-H267 AromaticContact CE2-NE2 3.39Å; Y263-H267 WeakPolarHBondContact CE2-NE2 3.41Å; Y263-H267 AromaticContact CZ-CD2 3.33Å; Y263-H267 AromaticContact CZ-NE2 3.57Å; Y263-H267 PolarHBondContact O-N 3.4Å; Y263-H267 PolarHBondContact OH-CD2 3.42Å; Y263-H267 PolarHBondContact OH-NE2 3.19Å; H267-Y269 VanDerWaalsContact C-N 3.28Å; H267-Y269 HydrophobicContact CB-CD2 3.87Å; H267-Y269 HydrophobicContact CB-CE2 4.03Å; H267-Y269 VanDerWaalsContact O-CD2 3.31Å; H267-Y269 WeakPolarHBondContact O-CD2 3.38Å; H267-Y269 PolarHBondContact O-N 3.34Å
268	G	30	Very low	29.7	Very low	62 Å²	62	110.9 Å²	110.9	64%	0.639	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.8	6.7	169.7	0	0	0	0	0	115.9	S270	G268-S270 VanDerWaalsContact C-N 3.29Å; G268-S270 PolarHBondContact O-N 3.07Å
269	Y	31.2	Very low	29.7	Very low	133 Å²	133	109.5 Å²	109.5	52%	0.522	60%	0.597	S	S	.	*			trans	-81.1	72.6	179.2	-68.7	-77.5	0	0	0	111.4	T132 Y264 H267 G271	T132-Y269 HydrophobicContact CG2-CE1 4.48Å; Y264-Y269 PolarHBondContact O-N 3.41Å; H267-Y269 VanDerWaalsContact C-N 3.28Å; H267-Y269 HydrophobicContact CB-CD2 3.87Å; H267-Y269 HydrophobicContact CB-CE2 4.03Å; H267-Y269 VanDerWaalsContact O-CD2 3.31Å; H267-Y269 WeakPolarHBondContact O-CD2 3.38Å; H267-Y269 PolarHBondContact O-N 3.34Å; Y269-G271 PolarHBondContact O-N 2.89Å
270	S	31.8	Very low	29.6	Very low	96 Å²	96	106.8 Å²	106.8	67%	0.671	60%	0.601	S	S	*	*			trans	-77.8	58.6	171	53.3	0	0	0	0	112	G268 T272	G268-S270 VanDerWaalsContact C-N 3.29Å; G268-S270 PolarHBondContact O-N 3.07Å; S270-T272 PolarHBondContact O-N 2.74Å
271	G	31.3	Very low	29.4	Very low	57 Å²	57	112.5 Å²	112.5	59%	0.588	63%	0.625	S	S	*	*			trans	-77.5	105.3	167.8	0	0	0	0	0	109.9	Y269 Y273	Y269-G271 PolarHBondContact O-N 2.89Å; G271-Y273 VanDerWaalsContact C-N 3.34Å; G271-Y273 PolarHBondContact O-N 2.97Å
272	T	29.1	Very low	29.5	Very low	142 Å²	142	117.2 Å²	117.2	87%	0.871	65%	0.648	S	S	*	*			trans	-66.8	95.4	167.8	50.3	0	0	0	0	108.9	S270 G274	S270-T272 PolarHBondContact O-N 2.74Å; T272-G274 PolarHBondContact O-N 3.37Å
273	Y	28.4	Very low	29.5	Very low	184 Å²	184	120 Å²	120	72%	0.722	66%	0.664	S	S	*	*			trans	-65.6	84.9	160.5	-89.8	-91.2	0	0	0	108	G271 Q275	G271-Y273 VanDerWaalsContact C-N 3.34Å; G271-Y273 PolarHBondContact O-N 2.97Å; Y273-Q275 PolarHBondContact O-N 2.81Å
274	G	27.1	Very low	29.3	Very low	55 Å²	55	123.4 Å²	123.4	57%	0.567	69%	0.687	S	S	*	*			trans	-58.6	131.9	161.4	0	0	0	0	0	107.9	T272 I276	T272-G274 PolarHBondContact O-N 3.37Å; G274-I276 VanDerWaalsContact C-N 3.31Å; G274-I276 PolarHBondContact O-N 3.29Å
275	Q	25.4	Very low	29.1	Very low	201 Å²	201	129 Å²	129	94%	0.939	71%	0.714	S	S	*	*			trans	-61.2	95.2	172	-72.1	174.5	-42.1	0	0	108.8	Y273 G277	Y273-Q275 PolarHBondContact O-N 2.81Å; Q275-G277 PolarHBondContact O-N 3.27Å
276	I	26.9	Very low	29	Very low	139 Å²	139	124.7 Å²	124.7	71%	0.713	71%	0.711	S	S	*	*			trans	-75.2	80.1	159.4	-49.1	-179.5	0	0	0	105.6	G274 Y278	G274-I276 VanDerWaalsContact C-N 3.31Å; G274-I276 PolarHBondContact O-N 3.29Å; I276-Y278 PolarHBondContact O-N 3.4Å; I276-Y278 VanDerWaalsContact O-N 3.16Å
277	G	25.9	Very low	28.9	Very low	63 Å²	63	124.1 Å²	124.1	65%	0.649	71%	0.712	S	S	*	*			trans	-60.1	117	164.6	0	0	0	0	0	107.2	Q275 G279	Q275-G277 PolarHBondContact O-N 3.27Å; G277-G279 PolarHBondContact O-N 3.27Å
278	Y	28.5	Very low	28.7	Very low	225 Å²	225	126 Å²	126	88%	0.882	73%	0.733	S	S	*	*			trans	-69.4	73.9	170.3	-71.6	-84.5	0	0	0	109.2	I276	I276-Y278 PolarHBondContact O-N 3.4Å; I276-Y278 VanDerWaalsContact O-N 3.16Å
279	G	27.7	Very low	28.8	Very low	55 Å²	55	131.6 Å²	131.6	57%	0.567	74%	0.74	S	S	*	*			trans	-65	142.5	158.8	0	0	0	0	0	108.8	G277	G277-G279 PolarHBondContact O-N 3.27Å
280	P	27.2	Very low	28.7	Very low	120 Å²	120	130.8 Å²	130.8	78%	0.779	75%	0.754	S	S	*	*	S	Bend	trans	-67.8	145.5	169.8	30.7	-33.3	0	0	0	109.3
281	L	27.4	Very low	28.8	Very low	158 Å²	158	131 Å²	131	83%	0.827	76%	0.761	S	S	*	*			trans	85.8	102.2	-179.5	-49.6	160.3	0	0	0	115.3
282	D	30.3	Very low	28.8	Very low	150 Å²	150	134 Å²	134	80%	0.802	77%	0.773	S	S	*	*			trans	167.7	93.7	134	-86.2	-17.7	0	0	0	107.8
283	T	27.9	Very low	28.9	Very low	108 Å²	108	135.5 Å²	135.5	66%	0.663	77%	0.774	S	S	*	*				55.7	114.1	86.6	70.1	0	0	0	0	116
284	N	26.7	Very low	29.3	Very low	141 Å²	141	133.3 Å²	133.3	75%	0.754	78%	0.78	S	S	*	*			trans	57.8	103.9	153.6	-56.3	-47.5	0	0	0	119.4
285	F	31.1	Very low	29.6	Very low	225 Å²	225	133.5 Å²	133.5	99%	0.987	78%	0.782	S	S	*	*				-165.8	126.3	128.3	-86.4	-68.8	0	0	0	106.1
286	G	29.2	Very low	30	Very low	64 Å²	64	133.1 Å²	133.1	66%	0.66	79%	0.786	S	S	*	*			cis	124.3	104.9	14.5	0	0	0	0	0	108
287	D	29.3	Very low	30.6	Very low	132 Å²	132	133.7 Å²	133.7	71%	0.706	83%	0.826	S	S	*	*			trans	-62.3	146.1	-166.5	-49.3	-76.2	0	0	0	113.7	F289	D287-F289 HydrophobicContact CB-CD2 3.94Å; D287-F289 HydrophobicContact CB-CE2 4.26Å; D287-F289 PolarHBondContact O-N 3.19Å
288	P	30	Very low	30.9	Very low	136 Å²	136	137.3 Å²	137.3	88%	0.883	84%	0.835	S	S	*	*			trans	-78.2	70.8	171.7	34.1	-34.7	0	0	0	110.7	S290	P288-S290 PolarHBondContact O-N 3.4Å
289	F	32.1	Very low	31	Very low	180 Å²	180	132.6 Å²	132.6	79%	0.789	83%	0.833	S	S	*	*			trans	-72.2	126.2	168	-94.6	-78.1	0	0	0	111.1	D287	D287-F289 HydrophobicContact CB-CD2 3.94Å; D287-F289 HydrophobicContact CB-CE2 4.26Å; D287-F289 PolarHBondContact O-N 3.19Å
290	S	29.8	Very low	31.2	Very low	116 Å²	116	136.9 Å²	136.9	81%	0.811	85%	0.847	S	S	*	*			trans	-64.2	124.4	176.4	37.6	0	0	0	0	112.6	P288	P288-S290 PolarHBondContact O-N 3.4Å
291	A	32.9	Very low	31.4	Very low	100 Å²	100	137.9 Å²	137.9	83%	0.826	85%	0.851	S	S	*	*			trans	-145.6	140	163.3	0	0	0	0	0	111.1
292	S	32.3	Very low	31.7	Very low	120 Å²	120	136.7 Å²	136.7	84%	0.839	85%	0.853	S	S	*	*			trans	-80.6	155.9	-164.5	-62.5	0	0	0	0	115.6	T294	S292-T294 PolarHBondContact O-N 3.31Å
293	I	31.8	Very low	31.7	Very low	173 Å²	173	135.8 Å²	135.8	89%	0.887	86%	0.856	S	S	*	*			trans	-60	115.9	173.9	-38.7	170.6	0	0	0	111.8
294	T	35.6	Very low	32	Very low	138 Å²	138	137.8 Å²	137.8	85%	0.847	87%	0.87	S	S	*	*			trans	-166.7	137.9	151	-21.8	0	0	0	0	106.8	S292	S292-T294 PolarHBondContact O-N 3.31Å
295	G	34.6	Very low	32.4	Very low	60 Å²	60	137.5 Å²	137.5	62%	0.619	88%	0.879	S	S	*	*			cis	142	117.3	1.9	0	0	0	0	0	109.6
296	L	32.1	Very low	32.5	Very low	192 Å²	192	130.3 Å²	130.3	100%	1.005	87%	0.87	S	S	*	*			trans	72.8	136.1	172.1	-55.4	166.7	0	0	0	117.4
297	G	40.9	Very low	32.8	Very low	152 Å²	152	136.3 Å²	136.3	100%	1.567	89%	0.889	S	S	*	*			trans	159.9	0	-176.5	0	0	0	0	0	109.9

Retrieved 297 of 297 residues in 149.7 ms (Link to these results)

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