A0A096N498_PAPAN Loading...

Twisted gastrulation BMP signaling modulator 1

AlphaFold DB , UniProt , Accession A0A096N498, Species PAPAN (Papio anubis, Olive baboon), Gene TWSG1, Length 237 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	60.4	Low	77.3	Confident	208 Å²	208	123.8 Å²	123.8	100%	1.025	63%	0.631	S	S	*	*				0	-50.7	0	-74	179.4	111.8	0	0	113.6	L3 H4 Y5	M1-L3 VanDerWaalsContact C-N 3.35Å; M1-L3 PolarHBondContact O-N 3.05Å; M1-H4 PolarHBondContact O-N 3.07Å; M1-Y5 PolarHBondContact O-N 3.45Å
2	K	64.8	Low	77.7	Confident	187 Å²	187	118.3 Å²	118.3	81%	0.813	62%	0.618	S	S	*	*	H	α-helix	trans	-58	-39.7	-179.7	-67.8	179.8	177.4	177.5	0	114.3	Y5 V6	K2-Y5 PolarHBondContact O-N 2.74Å; K2-V6 WeakPolarHBondContact O-CG2 3.31Å; K2-V6 PolarHBondContact O-N 3.21Å; K2-V6 VanDerWaalsContact O-N 3.13Å
3	L	71	Confident	78	Confident	143 Å²	143	115.9 Å²	115.9	75%	0.749	61%	0.605	S	S	*	*	H	α-helix	trans	-68.3	-39.4	-179.1	-167	65.4	0	0	0	113.3	M1 Y5 V6 A7	M1-L3 VanDerWaalsContact C-N 3.35Å; M1-L3 PolarHBondContact O-N 3.05Å; L3-Y5 VanDerWaalsContact C-N 3.35Å; L3-V6 PolarHBondContact O-N 3.2Å; L3-A7 PolarHBondContact O-N 2.82Å
4	H	73.3	Confident	77.9	Confident	142 Å²	142	115.5 Å²	115.5	66%	0.657	60%	0.603	S	S	*	*	H	α-helix	trans	-68.1	-36	176.1	-68	-75.6	0	0	0	111.9	M1 A7 V8	M1-H4 PolarHBondContact O-N 3.07Å; H4-A7 PolarHBondContact O-N 2.83Å; H4-V8 VanDerWaalsContact O-CG2 3.27Å; H4-V8 WeakPolarHBondContact O-CG2 3.5Å; H4-V8 PolarHBondContact O-N 3.06Å
5	Y	80.8	Confident	77.6	Confident	169 Å²	169	115.1 Å²	115.1	66%	0.663	60%	0.599	S	S	*	*	H	α-helix	trans	-65.4	-42.4	176.4	-172.9	-97.7	0	0	0	111.9	M1 K2 L3 V8 L9	M1-Y5 PolarHBondContact O-N 3.45Å; K2-Y5 PolarHBondContact O-N 2.74Å; L3-Y5 VanDerWaalsContact C-N 3.35Å; Y5-V8 PolarHBondContact O-N 3.19Å; Y5-L9 WeakPolarHBondContact O-CB 3.31Å; Y5-L9 PolarHBondContact O-N 3.14Å
6	V	82.1	Confident	77.1	Confident	84 Å²	84	117.6 Å²	117.6	51%	0.509	60%	0.604	S	S	.	*	H	α-helix	trans	-63.3	-43.9	175.1	174.6	0	0	0	0	110.9	K2 L3 V8 L9 T10	K2-V6 WeakPolarHBondContact O-CG2 3.31Å; K2-V6 PolarHBondContact O-N 3.21Å; K2-V6 VanDerWaalsContact O-N 3.13Å; L3-V6 PolarHBondContact O-N 3.2Å; V6-V8 PolarHBondContact O-N 3.01Å; V6-L9 PolarHBondContact O-N 3.07Å; V6-T10 HydrophobicContact CG1-CG2 4.48Å; V6-T10 WeakPolarHBondContact O-CG2 3.34Å; V6-T10 PolarHBondContact O-N 3.21Å; V6-T10 PolarHBondContact O-OG1 3.1Å; V6-T10 VanDerWaalsContact O-OG1 3.11Å
7	A	83.8	Confident	76.5	Confident	43 Å²	43	117.2 Å²	117.2	36%	0.355	60%	0.603	S	S	.	*	H	α-helix	trans	-63	-41.6	179.1	0	0	0	0	0	113	L3 H4 T10 L11	L3-A7 PolarHBondContact O-N 2.82Å; H4-A7 PolarHBondContact O-N 2.83Å; A7-T10 WeakPolarHBondContact CA-OG1 3.42Å; A7-T10 PolarHBondContact O-N 3.28Å; A7-T10 PolarHBondContact O-OG1 3.04Å; A7-L11 PolarHBondContact O-N 3.37Å
8	V	86.3	Confident	75.7	Confident	100 Å²	100	116.5 Å²	116.5	61%	0.606	61%	0.605	S	S	*	*	H	α-helix	trans	-66.5	-41.6	176.8	171.7	0	0	0	0	111	H4 Y5 V6 L11 A12	H4-V8 VanDerWaalsContact O-CG2 3.27Å; H4-V8 WeakPolarHBondContact O-CG2 3.5Å; H4-V8 PolarHBondContact O-N 3.06Å; Y5-V8 PolarHBondContact O-N 3.19Å; V6-V8 PolarHBondContact O-N 3.01Å; V8-L11 PolarHBondContact O-N 2.77Å; V8-A12 WeakPolarHBondContact O-CB 3.42Å; V8-A12 PolarHBondContact O-N 2.8Å
9	L	82.2	Confident	74.7	Confident	90 Å²	90	120.8 Å²	120.8	47%	0.471	61%	0.612	S	S	.	*	H	α-helix	trans	-63.9	-41.8	177.2	-165.6	76.6	0	0	0	111.5	Y5 V6 A12 I13	Y5-L9 WeakPolarHBondContact O-CB 3.31Å; Y5-L9 PolarHBondContact O-N 3.14Å; V6-L9 PolarHBondContact O-N 3.07Å; L9-A12 PolarHBondContact O-N 3.41Å; L9-I13 HydrophobicContact CD2-CD1 4.48Å; L9-I13 HydrophobicContact CG-CD1 4.04Å; L9-I13 WeakPolarHBondContact O-CD1 3.4Å; L9-I13 VanDerWaalsContact O-CG1 3.23Å; L9-I13 WeakPolarHBondContact O-CG1 3.41Å; L9-I13 PolarHBondContact O-N 3.31Å
10	T	81.9	Confident	73.5	Confident	80 Å²	80	120.5 Å²	120.5	49%	0.491	61%	0.612	S	S	.	*	H	α-helix	trans	-65.4	-38.9	176.8	49.9	0	0	0	0	112.7	V6 A7 I13 L14	V6-T10 HydrophobicContact CG1-CG2 4.48Å; V6-T10 WeakPolarHBondContact O-CG2 3.34Å; V6-T10 PolarHBondContact O-N 3.21Å; V6-T10 PolarHBondContact O-OG1 3.1Å; V6-T10 VanDerWaalsContact O-OG1 3.11Å; A7-T10 WeakPolarHBondContact CA-OG1 3.42Å; A7-T10 PolarHBondContact O-N 3.28Å; A7-T10 PolarHBondContact O-OG1 3.04Å; T10-I13 PolarHBondContact O-N 2.97Å; T10-L14 WeakPolarHBondContact O-CB 3.41Å; T10-L14 PolarHBondContact O-N 3.12Å
11	L	84.1	Confident	72.6	Confident	116 Å²	116	119.8 Å²	119.8	61%	0.607	62%	0.616	S	S	*	*	H	α-helix	trans	-67.3	-39.2	176.6	-84.6	159.6	0	0	0	111.8	A7 V8 L14 M15	A7-L11 PolarHBondContact O-N 3.37Å; V8-L11 PolarHBondContact O-N 2.77Å; L11-L14 PolarHBondContact O-N 2.83Å; L11-M15 WeakPolarHBondContact O-CB 3.29Å; L11-M15 PolarHBondContact O-N 2.93Å
12	A	81.7	Confident	71.9	Confident	57 Å²	57	113.7 Å²	113.7	47%	0.471	60%	0.598	S	S	.	*	H	α-helix	trans	-65.8	-41.1	176.2	0	0	0	0	0	112.2	V8 L9 M15 F16	V8-A12 WeakPolarHBondContact O-CB 3.42Å; V8-A12 PolarHBondContact O-N 2.8Å; L9-A12 PolarHBondContact O-N 3.41Å; A12-M15 PolarHBondContact O-N 2.83Å; A12-F16 WeakPolarHBondContact O-CB 3.15Å; A12-F16 PolarHBondContact O-N 3.49Å
13	I	81.3	Confident	71.3	Confident	88 Å²	88	110.1 Å²	110.1	45%	0.451	60%	0.596	S	S	.	*	H	α-helix	trans	-66.7	-41.9	176.5	-66.5	163.9	0	0	0	110.9	L9 T10 M15 F16 L17	L9-I13 HydrophobicContact CD2-CD1 4.48Å; L9-I13 HydrophobicContact CG-CD1 4.04Å; L9-I13 WeakPolarHBondContact O-CD1 3.4Å; L9-I13 VanDerWaalsContact O-CG1 3.23Å; L9-I13 WeakPolarHBondContact O-CG1 3.41Å; L9-I13 PolarHBondContact O-N 3.31Å; T10-I13 PolarHBondContact O-N 2.97Å; I13-M15 VanDerWaalsContact C-N 3.34Å; I13-M15 PolarHBondContact O-N 2.72Å; I13-F16 PolarHBondContact O-N 2.54Å; I13-L17 HydrophobicContact CG2-CD1 3.85Å; I13-L17 HydrophobicContact CG2-CG 4.4Å; I13-L17 WeakPolarHBondContact O-CB 3.38Å; I13-L17 WeakPolarHBondContact O-CG 3.47Å; I13-L17 PolarHBondContact O-N 3.48Å
14	L	77.4	Confident	70.4	Confident	110 Å²	110	109.6 Å²	109.6	58%	0.576	59%	0.594	S	S	*	*	H	α-helix	trans	-62.5	-42.7	177.2	-160.5	79.9	0	0	0	111.4	T10 L11 F16 L17 T18	T10-L14 WeakPolarHBondContact O-CB 3.41Å; T10-L14 PolarHBondContact O-N 3.12Å; L11-L14 PolarHBondContact O-N 2.83Å; L14-F16 VanDerWaalsContact C-N 3.34Å; L14-F16 PolarHBondContact O-N 2.86Å; L14-L17 PolarHBondContact O-N 3.35Å; L14-T18 WeakPolarHBondContact O-CG2 3.45Å; L14-T18 PolarHBondContact O-N 3.27Å; L14-T18 PolarHBondContact O-OG1 2.96Å
15	M	73.6	Confident	69.7	Low	109 Å²	109	107.3 Å²	107.3	54%	0.537	59%	0.594	S	S	.	*	H	α-helix	trans	-62.7	-37.5	174.4	-87.6	-99.9	38.5	0	0	113.1	L11 A12 I13 T18 W19	L11-M15 WeakPolarHBondContact O-CB 3.29Å; L11-M15 PolarHBondContact O-N 2.93Å; A12-M15 PolarHBondContact O-N 2.83Å; I13-M15 VanDerWaalsContact C-N 3.34Å; I13-M15 PolarHBondContact O-N 2.72Å; M15-T18 WeakPolarHBondContact CA-OG1 3.47Å; M15-T18 PolarHBondContact O-OG1 2.82Å; M15-W19 PolarHBondContact O-N 3.18Å
16	F	69.8	Low	69.2	Low	155 Å²	155	100.2 Å²	100.2	68%	0.68	57%	0.569	S	S	*	*	H	α-helix	trans	-70.9	-39.2	177	-162.2	-100.9	0	0	0	111.9	A12 I13 L14 T18 W19 L20	A12-F16 WeakPolarHBondContact O-CB 3.15Å; A12-F16 PolarHBondContact O-N 3.49Å; I13-F16 PolarHBondContact O-N 2.54Å; L14-F16 VanDerWaalsContact C-N 3.34Å; L14-F16 PolarHBondContact O-N 2.86Å; F16-T18 VanDerWaalsContact C-N 3.34Å; F16-T18 PolarHBondContact O-N 2.89Å; F16-W19 PolarHBondContact O-N 3.11Å; F16-W19 VanDerWaalsContact O-N 3.1Å; F16-L20 PolarHBondContact O-N 2.69Å
17	L	66.3	Low	69	Low	111 Å²	111	100.5 Å²	100.5	58%	0.581	57%	0.568	S	S	*	*	H	α-helix	trans	-66	-33.8	175.3	-73.2	165.8	0	0	0	112.6	I13 L14 W19 L20	I13-L17 HydrophobicContact CG2-CD1 3.85Å; I13-L17 HydrophobicContact CG2-CG 4.4Å; I13-L17 WeakPolarHBondContact O-CB 3.38Å; I13-L17 WeakPolarHBondContact O-CG 3.47Å; I13-L17 PolarHBondContact O-N 3.48Å; L14-L17 PolarHBondContact O-N 3.35Å; L17-W19 PolarHBondContact O-N 3Å; L17-L20 HydrophobicContact CD2-CD1 4.3Å
18	T	63.1	Low	68.7	Low	105 Å²	105	106.4 Å²	106.4	64%	0.644	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-10.8	173	52.6	0	0	0	0	113.9	L14 M15 F16	L14-T18 WeakPolarHBondContact O-CG2 3.45Å; L14-T18 PolarHBondContact O-N 3.27Å; L14-T18 PolarHBondContact O-OG1 2.96Å; M15-T18 WeakPolarHBondContact CA-OG1 3.47Å; M15-T18 PolarHBondContact O-OG1 2.82Å; F16-T18 VanDerWaalsContact C-N 3.34Å; F16-T18 PolarHBondContact O-N 2.89Å
19	W	55	Low	68.3	Low	198 Å²	198	106 Å²	106	75%	0.75	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-2.9	-179.9	-136.1	-28.5	0	0	0	113.6	M15 F16 L17 P21	M15-W19 PolarHBondContact O-N 3.18Å; F16-W19 PolarHBondContact O-N 3.11Å; F16-W19 VanDerWaalsContact O-N 3.1Å; L17-W19 PolarHBondContact O-N 3Å; W19-P21 WeakPolarHBondContact O-CD 3.32Å
20	L	51.6	Low	68.2	Low	115 Å²	115	105.3 Å²	105.3	60%	0.602	59%	0.589	S	S	*	*			trans	-69.6	107.9	163.3	-80.6	108.3	0	0	0	107.5	F16 L17 A22	F16-L20 PolarHBondContact O-N 2.69Å; L17-L20 HydrophobicContact CD2-CD1 4.3Å; L20-A22 PolarHBondContact O-N 3.11Å
21	P	54.3	Low	68.2	Low	106 Å²	106	101.5 Å²	101.5	69%	0.688	57%	0.566	S	S	*	*			trans	-66.6	122	164.9	11.1	5.4	0	0	0	105.2	W19 S23	W19-P21 WeakPolarHBondContact O-CD 3.32Å; P21-S23 PolarHBondContact O-N 3.24Å
22	A	45.6	Very low	68.2	Low	79 Å²	79	98.4 Å²	98.4	65%	0.653	56%	0.556	S	S	*	*			trans	-52.9	112.5	161.8	0	0	0	0	0	106.9	L20 L24	L20-A22 PolarHBondContact O-N 3.11Å; A22-L24 PolarHBondContact O-N 3.07Å
23	S	51.4	Low	68.4	Low	112 Å²	112	99.9 Å²	99.9	78%	0.783	56%	0.563	S	S	*	*	S	Bend	trans	-68.9	79.5	173	49.7	0	0	0	0	108.7	P21	P21-S23 PolarHBondContact O-N 3.24Å
24	L	54.1	Low	68.4	Low	132 Å²	132	98 Å²	98	69%	0.691	55%	0.554	S	S	*	*			trans	-145.2	34.3	163.3	-90.9	115.3	0	0	0	108.9	A22	A22-L24 PolarHBondContact O-N 3.07Å
25	S	57.6	Low	68.7	Low	95 Å²	95	93.4 Å²	93.4	66%	0.664	53%	0.531	S	S	*	.	S	Bend	trans	-134.6	128.2	178.2	66.7	0	0	0	0	110.1
26	C	70.3	Confident	69.2	Low	20 Å²	20	91 Å²	91	14%	0.135	53%	0.525	C	S	.	.			trans	-52.7	138.6	-174.5	178	0	0	0	0	113.3	K28 D72 C73	C26-K28 PolarHBondContact O-N 3.36Å; C26-D72 HydrophobicContact CB-CB 3.86Å; C26-C73 HydrophobicContact CB-CB 3.75Å; C26-C73 VanDerWaalsContact CB-N 3.34Å; C26-C73 WeakPolarHBondContact CB-SG 2.92Å; C26-C73 WeakPolarHBondContact SG-CB 3.41Å; C26-C73 CovalentContact SG-SG 2Å; C26-C73 PolarHBondContact SG-SG 2.93Å
27	N	78.6	Confident	70	Confident	90 Å²	90	89 Å²	89	48%	0.481	52%	0.516	S	S	.	.			trans	-74.6	88.3	174.4	-172.4	-16.1	0	0	0	110.8	A29 L30 C31	N27-A29 PolarHBondContact O-N 3.26Å; N27-A29 VanDerWaalsContact O-N 3.09Å; N27-A29 PolarHBondContact OD1-N 2.84Å; N27-L30 HydrophobicContact CB-CB 4.3Å; N27-L30 PolarHBondContact O-N 3.04Å; N27-L30 PolarHBondContact OD1-N 3.01Å; N27-C31 WeakPolarHBondContact O-CB 3.16Å; N27-C31 PolarHBondContact O-N 2.99Å; N27-C31 PolarHBondContact O-SG 3.02Å
28	K	76.9	Confident	70.9	Confident	166 Å²	166	83.7 Å²	83.7	72%	0.722	49%	0.488	S	S	*	.	H	α-helix	trans	-56.4	-27.1	-179	-67.7	179.1	-178.2	177.2	0	113.7	C26 A32	C26-K28 PolarHBondContact O-N 3.36Å; K28-A32 WeakPolarHBondContact O-CA 3.42Å; K28-A32 WeakPolarHBondContact O-CB 3.14Å; K28-A32 PolarHBondContact O-N 2.88Å
29	A	78.5	Confident	71.8	Confident	92 Å²	92	82 Å²	82	76%	0.76	48%	0.475	S	S	*	.	H	α-helix	trans	-73.9	-38.9	-179.1	0	0	0	0	0	112.3	N27	N27-A29 PolarHBondContact O-N 3.26Å; N27-A29 VanDerWaalsContact O-N 3.09Å; N27-A29 PolarHBondContact OD1-N 2.84Å
30	L	79.1	Confident	73.3	Confident	76 Å²	76	79.3 Å²	79.3	40%	0.398	47%	0.473	S	S	.	.	H	α-helix	trans	-75.6	-43.7	176.4	-168.2	106.1	0	0	0	111	N27 L66 E69	N27-L30 HydrophobicContact CB-CB 4.3Å; N27-L30 PolarHBondContact O-N 3.04Å; N27-L30 PolarHBondContact OD1-N 3.01Å; L30-L66 HydrophobicContact CD2-CD2 3.87Å; L30-L66 HydrophobicContact CD2-CG 4.4Å; L30-L66 HydrophobicContact CG-CD2 4.27Å; L30-E69 HydrophobicContact CD2-CB 4.38Å; L30-E69 WeakPolarHBondContact CD2-OE2 3.31Å
31	C	82.4	Confident	74.8	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	47%	0.468	C	S	.	.	H	α-helix	trans	-84.6	-15.7	-171.4	-58.6	0	0	0	0	114.2	N27 S33 V35 C70	N27-C31 WeakPolarHBondContact O-CB 3.16Å; N27-C31 PolarHBondContact O-N 2.99Å; N27-C31 PolarHBondContact O-SG 3.02Å; C31-S33 VanDerWaalsContact C-N 3.33Å; C31-S33 PolarHBondContact O-N 2.82Å; C31-V35 HydrophobicContact CB-CG2 3.86Å; C31-V35 WeakPolarHBondContact O-CB 3.28Å; C31-V35 WeakPolarHBondContact O-CG2 3.27Å; C31-V35 PolarHBondContact O-N 3.48Å; C31-C70 VanDerWaalsContact CA-SG 3.53Å; C31-C70 HydrophobicContact CB-CB 3.7Å; C31-C70 WeakPolarHBondContact CB-SG 2.9Å; C31-C70 WeakPolarHBondContact SG-CA 3.06Å; C31-C70 WeakPolarHBondContact SG-CB 3.45Å; C31-C70 CovalentContact SG-SG 2.02Å; C31-C70 PolarHBondContact SG-SG 3.47Å
32	A	83.9	Confident	76	Confident	50 Å²	50	80.4 Å²	80.4	41%	0.413	47%	0.466	S	S	.	.	H	α-helix	trans	-55.5	-43.6	-172.7	0	0	0	0	0	113.4	K28 S36	K28-A32 WeakPolarHBondContact O-CA 3.42Å; K28-A32 WeakPolarHBondContact O-CB 3.14Å; K28-A32 PolarHBondContact O-N 2.88Å; A32-S36 WeakPolarHBondContact O-CB 3.41Å; A32-S36 PolarHBondContact O-N 3.05Å; A32-S36 VanDerWaalsContact O-N 3.1Å; A32-S36 PolarHBondContact O-OG 2.96Å
33	S	84.8	Confident	77.5	Confident	88 Å²	88	79.3 Å²	79.3	62%	0.615	45%	0.449	S	S	*	.	H	α-helix	trans	-65.6	-57.1	-176.3	178.7	0	0	0	0	111.7	C31 S36 K37	C31-S33 VanDerWaalsContact C-N 3.33Å; C31-S33 PolarHBondContact O-N 2.82Å; S33-S36 PolarHBondContact O-N 2.9Å; S33-K37 WeakPolarHBondContact O-CB 3.26Å; S33-K37 PolarHBondContact O-N 2.98Å
34	D	83.1	Confident	78.7	Confident	50 Å²	50	74.3 Å²	74.3	27%	0.267	41%	0.414	S	S	.	.	H	α-helix	trans	-73.5	-38.9	-174.7	-64.6	-76.7	0	0	0	112.5	S36 K37 C38 L63	D34-S36 VanDerWaalsContact C-N 3.34Å; D34-S36 PolarHBondContact O-N 2.03Å; D34-K37 PolarHBondContact O-N 3.09Å; D34-C38 WeakPolarHBondContact O-CB 3.34Å; D34-C38 PolarHBondContact O-N 3.26Å; D34-C38 PolarHBondContact O-SG 2.88Å; D34-L63 HydrophobicContact CB-CD2 4.33Å
35	V	83.3	Confident	79.6	Confident	13 Å²	13	73.9 Å²	73.9	8%	0.079	41%	0.409	C	S	.	.	H	α-helix	trans	-62.3	-43.1	173.9	172.7	0	0	0	0	110.7	C31 C38 L39 L63 C70 C73 V74	C31-V35 HydrophobicContact CB-CG2 3.86Å; C31-V35 WeakPolarHBondContact O-CB 3.28Å; C31-V35 WeakPolarHBondContact O-CG2 3.27Å; C31-V35 PolarHBondContact O-N 3.48Å; V35-C38 PolarHBondContact O-N 3.1Å; V35-L39 HydrophobicContact CG1-CD1 3.63Å; V35-L39 HydrophobicContact CG1-CG 4.37Å; V35-L39 WeakPolarHBondContact O-CB 3.08Å; V35-L39 WeakPolarHBondContact O-CD1 3.29Å; V35-L39 WeakPolarHBondContact O-CG 3.03Å; V35-L39 PolarHBondContact O-N 3.3Å; V35-L63 HydrophobicContact CG2-CD2 3.77Å; V35-C70 HydrophobicContact CG2-CB 4.19Å; V35-C73 HydrophobicContact CG2-CB 4.19Å; V35-V74 HydrophobicContact CG1-CG1 3.73Å; V35-V74 HydrophobicContact CG2-CG1 4.3Å
36	S	84.6	Confident	80.2	Confident	59 Å²	59	70.4 Å²	70.4	41%	0.413	38%	0.384	S	S	.	.	H	α-helix	trans	-65.7	-40.5	178	-60.6	0	0	0	0	111.7	A32 S33 D34 L39 I40	A32-S36 WeakPolarHBondContact O-CB 3.41Å; A32-S36 PolarHBondContact O-N 3.05Å; A32-S36 VanDerWaalsContact O-N 3.1Å; A32-S36 PolarHBondContact O-OG 2.96Å; S33-S36 PolarHBondContact O-N 2.9Å; D34-S36 VanDerWaalsContact C-N 3.34Å; D34-S36 PolarHBondContact O-N 2.03Å; S36-L39 PolarHBondContact O-N 3.04Å; S36-I40 WeakPolarHBondContact O-CB 3.46Å; S36-I40 WeakPolarHBondContact O-CD1 3.21Å; S36-I40 WeakPolarHBondContact O-CG1 3.46Å; S36-I40 PolarHBondContact O-N 3.01Å
37	K	86.3	Confident	79.9	Confident	112 Å²	112	78.4 Å²	78.4	49%	0.487	41%	0.411	S	S	.	.	H	α-helix	trans	-59.5	-47.5	174.6	-178.3	-174.4	174.2	-167.1	0	111.5	S33 D34 I40 Q41	S33-K37 WeakPolarHBondContact O-CB 3.26Å; S33-K37 PolarHBondContact O-N 2.98Å; D34-K37 PolarHBondContact O-N 3.09Å; K37-I40 PolarHBondContact O-N 2.62Å; K37-Q41 WeakPolarHBondContact O-CG 3.32Å; K37-Q41 PolarHBondContact O-N 2.96Å; K37-Q41 VanDerWaalsContact O-N 3.11Å
38	C	84.6	Confident	79	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-71.8	-31	-178	-61.3	0	0	0	0	113.4	D34 V35 E42 L43 C44 C62	D34-C38 WeakPolarHBondContact O-CB 3.34Å; D34-C38 PolarHBondContact O-N 3.26Å; D34-C38 PolarHBondContact O-SG 2.88Å; V35-C38 PolarHBondContact O-N 3.1Å; C38-E42 PolarHBondContact O-N 3.21Å; C38-L43 PolarHBondContact O-N 3.25Å; C38-L43 VanDerWaalsContact O-N 3.09Å; C38-C44 HydrophobicContact CB-CB 4.36Å; C38-C44 WeakPolarHBondContact CB-SG 3.45Å; C38-C44 PolarHBondContact O-N 3.46Å; C38-C62 WeakPolarHBondContact CA-SG 3.47Å; C38-C62 HydrophobicContact CB-CB 3.82Å; C38-C62 WeakPolarHBondContact CB-SG 3.48Å; C38-C62 WeakPolarHBondContact SG-CB 3.4Å; C38-C62 CovalentContact SG-SG 2.02Å; C38-C62 PolarHBondContact SG-SG 3.42Å
39	L	82.4	Confident	78.1	Confident	70 Å²	70	72.6 Å²	72.6	37%	0.366	41%	0.409	S	S	.	.	H	α-helix	trans	-69.2	-39.7	172.3	-80.6	163.1	0	0	0	112.4	V35 S36 Q41 E42 C44 Q45	V35-L39 HydrophobicContact CG1-CD1 3.63Å; V35-L39 HydrophobicContact CG1-CG 4.37Å; V35-L39 WeakPolarHBondContact O-CB 3.08Å; V35-L39 WeakPolarHBondContact O-CD1 3.29Å; V35-L39 WeakPolarHBondContact O-CG 3.03Å; V35-L39 PolarHBondContact O-N 3.3Å; S36-L39 PolarHBondContact O-N 3.04Å; L39-Q41 VanDerWaalsContact C-N 3.31Å; L39-E42 PolarHBondContact O-N 2.72Å; L39-E42 VanDerWaalsContact O-N 3.14Å; L39-C44 HydrophobicContact CD2-CB 4.23Å; L39-C44 HydrophobicContact CG-CB 4.34Å; L39-Q45 HydrophobicContact CD2-CG 4.36Å
40	I	85.4	Confident	77	Confident	141 Å²	141	75.2 Å²	75.2	72%	0.723	41%	0.406	S	S	*	.	H	α-helix	trans	-68.5	-32.5	177.2	-69.3	165.8	0	0	0	111.2	S36 K37 E42	S36-I40 WeakPolarHBondContact O-CB 3.46Å; S36-I40 WeakPolarHBondContact O-CD1 3.21Å; S36-I40 WeakPolarHBondContact O-CG1 3.46Å; S36-I40 PolarHBondContact O-N 3.01Å; K37-I40 PolarHBondContact O-N 2.62Å; I40-E42 PolarHBondContact O-N 3.21Å
41	Q	82.9	Confident	75.8	Confident	105 Å²	105	74.8 Å²	74.8	49%	0.491	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	4	173.6	-68.7	-178.7	-8	0	0	113.5	K37 L39 L43	K37-Q41 WeakPolarHBondContact O-CG 3.32Å; K37-Q41 PolarHBondContact O-N 2.96Å; K37-Q41 VanDerWaalsContact O-N 3.11Å; L39-Q41 VanDerWaalsContact C-N 3.31Å; Q41-L43 HydrophobicContact CB-CD1 3.97Å; Q41-L43 HydrophobicContact CB-CG 3.88Å; Q41-L43 PolarHBondContact O-N 2.93Å; Q41-L43 VanDerWaalsContact O-N 3.08Å
42	E	80.4	Confident	74.5	Confident	139 Å²	139	81.6 Å²	81.6	65%	0.65	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	12.6	-177.6	-55	-170.8	166.1	0	0	114.7	C38 L39 I40	C38-E42 PolarHBondContact O-N 3.21Å; L39-E42 PolarHBondContact O-N 2.72Å; L39-E42 VanDerWaalsContact O-N 3.14Å; I40-E42 PolarHBondContact O-N 3.21Å
43	L	78.1	Confident	73.7	Confident	55 Å²	55	81.5 Å²	81.5	29%	0.288	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-25.1	-178.3	-58.1	176.1	0	0	0	112.3	C38 Q41 E58 C59 C62	C38-L43 PolarHBondContact O-N 3.25Å; C38-L43 VanDerWaalsContact O-N 3.09Å; Q41-L43 HydrophobicContact CB-CD1 3.97Å; Q41-L43 HydrophobicContact CB-CG 3.88Å; Q41-L43 PolarHBondContact O-N 2.93Å; Q41-L43 VanDerWaalsContact O-N 3.08Å; L43-E58 HydrophobicContact CB-CB 4.37Å; L43-E58 HydrophobicContact CD2-CB 4.12Å; L43-C59 WeakPolarHBondContact O-CB 3.13Å; L43-C59 PolarHBondContact O-N 3.27Å; L43-C62 HydrophobicContact CB-CB 4.37Å; L43-C62 HydrophobicContact CD1-CB 3.8Å
44	C	75.4	Confident	73.2	Confident	7 Å²	7	82.3 Å²	82.3	5%	0.047	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	19.6	-177	-65.3	0	0	0	0	114.3	C38 L39 C46 C59 M76	C38-C44 HydrophobicContact CB-CB 4.36Å; C38-C44 WeakPolarHBondContact CB-SG 3.45Å; C38-C44 PolarHBondContact O-N 3.46Å; L39-C44 HydrophobicContact CD2-CB 4.23Å; L39-C44 HydrophobicContact CG-CB 4.34Å; C44-C46 PolarHBondContact O-N 2.7Å; C44-C46 VanDerWaalsContact O-N 3.13Å; C44-C59 HydrophobicContact CB-CB 3.91Å; C44-C59 WeakPolarHBondContact CB-SG 3.27Å; C44-C59 WeakPolarHBondContact SG-CA 3.07Å; C44-C59 WeakPolarHBondContact SG-CB 3.24Å; C44-C59 CovalentContact SG-SG 2.03Å; C44-C59 PolarHBondContact SG-SG 2.85Å; C44-M76 HydrophobicContact CB-CE 4.32Å
45	Q	73.4	Confident	72.8	Confident	124 Å²	124	81.3 Å²	81.3	58%	0.579	46%	0.455	S	S	*	.			trans	-85.6	49.7	176.2	-79.8	177	6.8	0	0	112.5	L39	L39-Q45 HydrophobicContact CD2-CG 4.36Å
46	C	70.4	Confident	72.4	Confident	22 Å²	22	82.5 Å²	82.5	15%	0.149	46%	0.463	C	S	.	.			trans	-92.2	146.9	178	-51.3	0	0	0	0	111.5	C44 P48 C55 M76	C44-C46 PolarHBondContact O-N 2.7Å; C44-C46 VanDerWaalsContact O-N 3.13Å; C46-P48 WeakPolarHBondContact O-CD 3.43Å; C46-C55 WeakPolarHBondContact CA-SG 3.48Å; C46-C55 HydrophobicContact CB-CB 4.5Å; C46-C55 WeakPolarHBondContact CB-SG 3.31Å; C46-C55 VanDerWaalsContact SG-CA 3.55Å; C46-C55 WeakPolarHBondContact SG-CB 3.32Å; C46-C55 CovalentContact SG-SG 2Å; C46-C55 PolarHBondContact SG-SG 2.77Å; C46-M76 HydrophobicContact CB-SD 3.74Å
47	R	63.7	Low	72.2	Confident	187 Å²	187	86.4 Å²	86.4	71%	0.706	47%	0.473	S	S	*	.			trans	-115.1	88.1	166.6	-159.6	179	-174.6	117.8	0.1	109.3	G49 E50	R47-G49 PolarHBondContact O-N 2.9Å; R47-E50 PolarHBondContact O-N 3.44Å
48	P	59.5	Low	72	Confident	56 Å²	56	84.8 Å²	84.8	36%	0.364	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-64	-16.8	-171.4	-23.1	34.8	0	0	0	114.6	C46 E50 G51 M76	C46-P48 WeakPolarHBondContact O-CD 3.43Å; P48-E50 PolarHBondContact O-N 2.9Å; P48-G51 PolarHBondContact O-N 2.96Å; P48-M76 HydrophobicContact CG-CG 3.62Å
49	G	57.2	Low	71.8	Confident	78 Å²	78	84.8 Å²	84.8	80%	0.804	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-67.8	-10.8	-179	0	0	0	0	0	115.6	R47	R47-G49 PolarHBondContact O-N 2.9Å
50	E	56.9	Low	71.7	Confident	147 Å²	147	85.7 Å²	85.7	69%	0.687	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-103.7	6.5	-178	-70.6	175.3	-164.5	0	0	113.6	R47 P48 N52	R47-E50 PolarHBondContact O-N 3.44Å; P48-E50 PolarHBondContact O-N 2.9Å; E50-N52 VanDerWaalsContact C-N 3.27Å; E50-N52 PolarHBondContact O-N 3.37Å
51	G	53.1	Low	71.4	Confident	68 Å²	68	84.7 Å²	84.7	70%	0.701	47%	0.466	S	S	*	.	S	Bend	trans	80.8	-8.8	170.7	0	0	0	0	0	116.1	P48	P48-G51 PolarHBondContact O-N 2.96Å
52	N	55.9	Low	71.4	Confident	142 Å²	142	81.1 Å²	81.1	76%	0.759	45%	0.452	S	S	*	.			trans	-107.1	101.2	174.5	-67.3	-33.2	0	0	0	109.9	E50	E50-N52 VanDerWaalsContact C-N 3.27Å; E50-N52 PolarHBondContact O-N 3.37Å
53	C	67.6	Low	71.5	Confident	49 Å²	49	74.9 Å²	74.9	33%	0.331	42%	0.423	S	S	.	.			trans	-108	68.1	175.2	-150.1	0	0	0	0	113.4	C55 C56	C53-C55 VanDerWaalsContact C-N 3.27Å; C53-C55 PolarHBondContact O-N 2.95Å; C53-C56 HydrophobicContact CB-CB 3.89Å; C53-C56 WeakPolarHBondContact CB-SG 3.37Å; C53-C56 WeakPolarHBondContact SG-CB 3.28Å; C53-C56 PolarHBondContact SG-N 3.03Å; C53-C56 VanDerWaalsContact SG-N 3.45Å; C53-C56 CovalentContact SG-SG 2Å; C53-C56 PolarHBondContact SG-SG 2.97Å
54	S	72.7	Confident	71.8	Confident	104 Å²	104	74.2 Å²	74.2	73%	0.727	43%	0.43	S	S	*	.	S	Bend	trans	-67.8	-24	175.6	49.7	0	0	0	0	113.7	E58	S54-E58 VanDerWaalsContact O-OE2 3.04Å
55	C	74.6	Confident	71.9	Confident	30 Å²	30	78.7 Å²	78.7	20%	0.203	47%	0.467	C	S	.	.	S	Bend	trans	-104.2	-2.9	-176.1	52.2	0	0	0	0	114.6	C46 C53 K57 E58 C59	C46-C55 WeakPolarHBondContact CA-SG 3.48Å; C46-C55 HydrophobicContact CB-CB 4.5Å; C46-C55 WeakPolarHBondContact CB-SG 3.31Å; C46-C55 VanDerWaalsContact SG-CA 3.55Å; C46-C55 WeakPolarHBondContact SG-CB 3.32Å; C46-C55 CovalentContact SG-SG 2Å; C46-C55 PolarHBondContact SG-SG 2.77Å; C53-C55 VanDerWaalsContact C-N 3.27Å; C53-C55 PolarHBondContact O-N 2.95Å; C55-K57 PolarHBondContact O-N 3.19Å; C55-E58 WeakPolarHBondContact CA-OE2 3.29Å; C55-E58 PolarHBondContact O-N 3.2Å; C55-C59 PolarHBondContact O-N 3.37Å
56	C	76.3	Confident	72.2	Confident	38 Å²	38	75.2 Å²	75.2	26%	0.257	45%	0.452	S	S	.	.	H	α-helix	trans	-57.8	-37.9	178.3	-86.9	0	0	0	0	111.5	C53 M60 M76	C53-C56 HydrophobicContact CB-CB 3.89Å; C53-C56 WeakPolarHBondContact CB-SG 3.37Å; C53-C56 WeakPolarHBondContact SG-CB 3.28Å; C53-C56 PolarHBondContact SG-N 3.03Å; C53-C56 VanDerWaalsContact SG-N 3.45Å; C53-C56 CovalentContact SG-SG 2Å; C53-C56 PolarHBondContact SG-SG 2.97Å; C56-M60 WeakPolarHBondContact O-CB 3.33Å; C56-M60 PolarHBondContact O-N 3.03Å; C56-M76 HydrophobicContact CB-SD 4.49Å
57	K	79.9	Confident	72.6	Confident	140 Å²	140	76 Å²	76	61%	0.609	45%	0.452	S	S	*	.	H	α-helix	trans	-66.7	-46.9	-177.6	-177.2	-175.7	178.3	-174.9	0	111.3	C55 C59 M60 L61	C55-K57 PolarHBondContact O-N 3.19Å; K57-C59 VanDerWaalsContact C-N 3.34Å; K57-M60 PolarHBondContact O-N 2.87Å; K57-L61 HydrophobicContact CG-CD1 4.38Å; K57-L61 WeakPolarHBondContact O-CG 3.46Å; K57-L61 PolarHBondContact O-N 2.71Å
58	E	81.7	Confident	73.1	Confident	78 Å²	78	72.4 Å²	72.4	36%	0.364	45%	0.447	S	S	.	.	H	α-helix	trans	-66.9	-38.4	179.7	-69.5	71	-153.8	0	0	111.2	L43 S54 C55 L61 C62	L43-E58 HydrophobicContact CB-CB 4.37Å; L43-E58 HydrophobicContact CD2-CB 4.12Å; S54-E58 VanDerWaalsContact O-OE2 3.04Å; C55-E58 WeakPolarHBondContact CA-OE2 3.29Å; C55-E58 PolarHBondContact O-N 3.2Å; E58-L61 PolarHBondContact O-N 3.39Å; E58-C62 WeakPolarHBondContact O-CB 3.42Å; E58-C62 PolarHBondContact O-N 3.3Å
59	C	81.3	Confident	74	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	46%	0.455	C	S	.	.	H	α-helix	trans	-64.3	-42.1	174.4	-171.9	0	0	0	0	112.4	L43 C44 C55 K57 L61 C62 L63 W67 M76	L43-C59 WeakPolarHBondContact O-CB 3.13Å; L43-C59 PolarHBondContact O-N 3.27Å; C44-C59 HydrophobicContact CB-CB 3.91Å; C44-C59 WeakPolarHBondContact CB-SG 3.27Å; C44-C59 WeakPolarHBondContact SG-CA 3.07Å; C44-C59 WeakPolarHBondContact SG-CB 3.24Å; C44-C59 CovalentContact SG-SG 2.03Å; C44-C59 PolarHBondContact SG-SG 2.85Å; C55-C59 PolarHBondContact O-N 3.37Å; K57-C59 VanDerWaalsContact C-N 3.34Å; C59-L61 VanDerWaalsContact C-N 3.35Å; C59-L61 PolarHBondContact O-N 3.31Å; C59-C62 PolarHBondContact O-N 2.86Å; C59-L63 PolarHBondContact O-N 3.37Å; C59-W67 HydrophobicContact CB-CZ3 4.25Å; C59-M76 HydrophobicContact CB-CE 3.76Å; C59-M76 HydrophobicContact CB-SD 4.3Å; C59-M76 WeakPolarHBondContact SG-CE 3.33Å
60	M	79.9	Confident	75.2	Confident	89 Å²	89	71.5 Å²	71.5	44%	0.438	42%	0.417	S	S	.	.	H	α-helix	trans	-60.9	-44.3	176	-170.4	-170.4	85.9	0	0	111.6	C56 K57 C62 L63 G64 W67	C56-M60 WeakPolarHBondContact O-CB 3.33Å; C56-M60 PolarHBondContact O-N 3.03Å; K57-M60 PolarHBondContact O-N 2.87Å; M60-C62 VanDerWaalsContact C-N 3.3Å; M60-C62 PolarHBondContact O-N 2.05Å; M60-L63 PolarHBondContact O-N 2.93Å; M60-G64 PolarHBondContact O-N 2.85Å; M60-W67 VanDerWaalsContact CA-CE3 3.46Å; M60-W67 HydrophobicContact CB-CD2 4.12Å; M60-W67 HydrophobicContact CB-CE3 3.98Å; M60-W67 HydrophobicContact CB-CH2 4.16Å; M60-W67 HydrophobicContact CB-CZ2 4.33Å; M60-W67 HydrophobicContact CB-CZ3 3.99Å; M60-W67 HydrophobicContact CG-CD2 3.74Å; M60-W67 HydrophobicContact CG-CE3 4.09Å; M60-W67 HydrophobicContact CG-CG 3.96Å; M60-W67 HydrophobicContact CG-CZ2 4.39Å
61	L	79.3	Confident	76.1	Confident	120 Å²	120	64.7 Å²	64.7	63%	0.628	39%	0.386	S	S	*	.	H	α-helix	trans	-66.3	-31.9	176.9	-70	171.7	0	0	0	112.7	K57 E58 C59	K57-L61 HydrophobicContact CG-CD1 4.38Å; K57-L61 WeakPolarHBondContact O-CG 3.46Å; K57-L61 PolarHBondContact O-N 2.71Å; E58-L61 PolarHBondContact O-N 3.39Å; C59-L61 VanDerWaalsContact C-N 3.35Å; C59-L61 PolarHBondContact O-N 3.31Å
62	C	82.6	Confident	77.2	Confident	31 Å²	31	64.4 Å²	64.4	21%	0.209	37%	0.368	C	S	.	.	H	α-helix	trans	-72.7	-39.6	178	-172	0	0	0	0	112.8	C38 L43 E58 C59 M60	C38-C62 WeakPolarHBondContact CA-SG 3.47Å; C38-C62 HydrophobicContact CB-CB 3.82Å; C38-C62 WeakPolarHBondContact CB-SG 3.48Å; C38-C62 WeakPolarHBondContact SG-CB 3.4Å; C38-C62 CovalentContact SG-SG 2.02Å; C38-C62 PolarHBondContact SG-SG 3.42Å; L43-C62 HydrophobicContact CB-CB 4.37Å; L43-C62 HydrophobicContact CD1-CB 3.8Å; E58-C62 WeakPolarHBondContact O-CB 3.42Å; E58-C62 PolarHBondContact O-N 3.3Å; C59-C62 PolarHBondContact O-N 2.86Å; M60-C62 VanDerWaalsContact C-N 3.3Å; M60-C62 PolarHBondContact O-N 2.05Å
63	L	82.9	Confident	78.4	Confident	7 Å²	7	59.9 Å²	59.9	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-77.4	-29.9	176.3	-78.9	159.1	0	0	0	112.8	D34 V35 C59 M60 A65 L66 W67 C70 V74	D34-L63 HydrophobicContact CB-CD2 4.33Å; V35-L63 HydrophobicContact CG2-CD2 3.77Å; C59-L63 PolarHBondContact O-N 3.37Å; M60-L63 PolarHBondContact O-N 2.93Å; L63-A65 PolarHBondContact O-N 3.34Å; L63-L66 PolarHBondContact O-N 3.35Å; L63-L66 VanDerWaalsContact O-N 3.14Å; L63-W67 HydrophobicContact CB-CB 4.41Å; L63-W67 HydrophobicContact CB-CE3 4.01Å; L63-W67 HydrophobicContact CD1-CE3 3.5Å; L63-W67 VanDerWaalsContact CD1-CE3 3.5Å; L63-W67 HydrophobicContact CD1-CZ3 3.72Å; L63-W67 HydrophobicContact CG-CE3 4.38Å; L63-C70 HydrophobicContact CD2-CB 3.96Å; L63-V74 HydrophobicContact CD1-CG2 4.22Å
64	G	83.8	Confident	78.9	Confident	41 Å²	41	58.7 Å²	58.7	42%	0.423	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	55.9	-124.2	174.6	0	0	0	0	0	112.5	M60 L66 W67	M60-G64 PolarHBondContact O-N 2.85Å; G64-L66 PolarHBondContact O-N 2.89Å; G64-W67 VanDerWaalsContact O-CB 3.27Å; G64-W67 WeakPolarHBondContact O-CB 3.4Å; G64-W67 PolarHBondContact O-N 2.92Å; G64-W67 VanDerWaalsContact O-N 3.12Å
65	A	78.4	Confident	78.9	Confident	101 Å²	101	56.3 Å²	56.3	84%	0.835	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-64.7	-18.6	-177.3	0	0	0	0	0	114.3	L63 W67	L63-A65 PolarHBondContact O-N 3.34Å; A65-W67 VanDerWaalsContact C-N 3.32Å
66	L	78.2	Confident	78.8	Confident	51 Å²	51	55.6 Å²	55.6	27%	0.267	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-88.1	1.1	178	-82.9	79.5	0	0	0	112.7	L30 L63 G64 D68 E69 C70	L30-L66 HydrophobicContact CD2-CD2 3.87Å; L30-L66 HydrophobicContact CD2-CG 4.4Å; L30-L66 HydrophobicContact CG-CD2 4.27Å; L63-L66 PolarHBondContact O-N 3.35Å; L63-L66 VanDerWaalsContact O-N 3.14Å; G64-L66 PolarHBondContact O-N 2.89Å; L66-D68 PolarHBondContact O-N 3.07Å; L66-E69 PolarHBondContact O-N 3.04Å; L66-C70 WeakPolarHBondContact O-CB 3.46Å; L66-C70 PolarHBondContact O-N 3.13Å; L66-C70 PolarHBondContact O-SG 3.3Å; L66-C70 VanDerWaalsContact O-SG 3.37Å
67	W	79.5	Confident	78.4	Confident	38 Å²	38	55 Å²	55	14%	0.144	32%	0.32	C	S	.	.	H	α-helix	trans	-56.6	-48.6	-174.7	175.9	-99.1	0	0	0	113.4	C59 M60 L63 G64 A65 E69 C70 C71 V74 M76	C59-W67 HydrophobicContact CB-CZ3 4.25Å; M60-W67 VanDerWaalsContact CA-CE3 3.46Å; M60-W67 HydrophobicContact CB-CD2 4.12Å; M60-W67 HydrophobicContact CB-CE3 3.98Å; M60-W67 HydrophobicContact CB-CH2 4.16Å; M60-W67 HydrophobicContact CB-CZ2 4.33Å; M60-W67 HydrophobicContact CB-CZ3 3.99Å; M60-W67 HydrophobicContact CG-CD2 3.74Å; M60-W67 HydrophobicContact CG-CE3 4.09Å; M60-W67 HydrophobicContact CG-CG 3.96Å; M60-W67 HydrophobicContact CG-CZ2 4.39Å; L63-W67 HydrophobicContact CB-CB 4.41Å; L63-W67 HydrophobicContact CB-CE3 4.01Å; L63-W67 HydrophobicContact CD1-CE3 3.5Å; L63-W67 VanDerWaalsContact CD1-CE3 3.5Å; L63-W67 HydrophobicContact CD1-CZ3 3.72Å; L63-W67 HydrophobicContact CG-CE3 4.38Å; G64-W67 VanDerWaalsContact O-CB 3.27Å; G64-W67 WeakPolarHBondContact O-CB 3.4Å; G64-W67 PolarHBondContact O-N 2.92Å; G64-W67 VanDerWaalsContact O-N 3.12Å; A65-W67 VanDerWaalsContact C-N 3.32Å; W67-E69 PolarHBondContact O-N 3.09Å; W67-C70 PolarHBondContact O-N 3.37Å; W67-C71 HydrophobicContact CD2-CB 3.93Å; W67-C71 HydrophobicContact CE3-CB 4.29Å; W67-C71 HydrophobicContact CG-CB 4.41Å; W67-C71 HydrophobicContact CH2-CB 4.4Å; W67-C71 HydrophobicContact CZ2-CB 3.99Å; W67-C71 WeakPolarHBondContact O-CA 3.24Å; W67-C71 WeakPolarHBondContact O-CB 3.46Å; W67-C71 PolarHBondContact O-N 3.15Å; W67-C71 PolarHBondContact O-SG 3.27Å; W67-C71 VanDerWaalsContact O-SG 3.34Å; W67-V74 HydrophobicContact CZ3-CG2 4.44Å; W67-M76 HydrophobicContact CH2-CB 3.68Å; W67-M76 HydrophobicContact CH2-SD 4.47Å; W67-M76 HydrophobicContact CZ2-CB 4.18Å
68	D	74.9	Confident	77.6	Confident	113 Å²	113	54.7 Å²	54.7	60%	0.604	33%	0.325	S	S	*	.	H	α-helix	trans	-66.1	-22.6	-176.1	-73.2	-48.7	0	0	0	114.2	L66 R80	L66-D68 PolarHBondContact O-N 3.07Å; D68-R80 PolarHBondContact O-NH2 2.84Å
69	E	77.6	Confident	76.2	Confident	114 Å²	114	55.9 Å²	55.9	53%	0.533	34%	0.34	S	S	.	.	H	α-helix	trans	-92.8	-27.7	177.9	-62	-177.1	-157.3	0	0	112	L30 L66 W67	L30-E69 HydrophobicContact CD2-CB 4.38Å; L30-E69 WeakPolarHBondContact CD2-OE2 3.31Å; L66-E69 PolarHBondContact O-N 3.04Å; W67-E69 PolarHBondContact O-N 3.09Å
70	C	81.5	Confident	74.6	Confident	0 Å²	0	64 Å²	64	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-112.9	-8.4	-171.1	-59.4	0	0	0	0	115	C31 V35 L63 L66 W67 D72 C73	C31-C70 VanDerWaalsContact CA-SG 3.53Å; C31-C70 HydrophobicContact CB-CB 3.7Å; C31-C70 WeakPolarHBondContact CB-SG 2.9Å; C31-C70 WeakPolarHBondContact SG-CA 3.06Å; C31-C70 WeakPolarHBondContact SG-CB 3.45Å; C31-C70 CovalentContact SG-SG 2.02Å; C31-C70 PolarHBondContact SG-SG 3.47Å; V35-C70 HydrophobicContact CG2-CB 4.19Å; L63-C70 HydrophobicContact CD2-CB 3.96Å; L66-C70 WeakPolarHBondContact O-CB 3.46Å; L66-C70 PolarHBondContact O-N 3.13Å; L66-C70 PolarHBondContact O-SG 3.3Å; L66-C70 VanDerWaalsContact O-SG 3.37Å; W67-C70 PolarHBondContact O-N 3.37Å; C70-D72 PolarHBondContact O-N 3.04Å; C70-D72 VanDerWaalsContact O-N 3.15Å; C70-C73 VanDerWaalsContact O-CB 3.3Å; C70-C73 WeakPolarHBondContact O-CB 3.38Å; C70-C73 PolarHBondContact O-N 3.3Å
71	C	77.3	Confident	72.9	Confident	4 Å²	4	66 Å²	66	3%	0.027	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.1	-179.8	59.9	0	0	0	0	112.4	W67 C73 V74 G75 M76 C77	W67-C71 HydrophobicContact CD2-CB 3.93Å; W67-C71 HydrophobicContact CE3-CB 4.29Å; W67-C71 HydrophobicContact CG-CB 4.41Å; W67-C71 HydrophobicContact CH2-CB 4.4Å; W67-C71 HydrophobicContact CZ2-CB 3.99Å; W67-C71 WeakPolarHBondContact O-CA 3.24Å; W67-C71 WeakPolarHBondContact O-CB 3.46Å; W67-C71 PolarHBondContact O-N 3.15Å; W67-C71 PolarHBondContact O-SG 3.27Å; W67-C71 VanDerWaalsContact O-SG 3.34Å; C71-C73 VanDerWaalsContact C-N 3.3Å; C71-C73 PolarHBondContact O-N 2.85Å; C71-V74 CarbonylContact O-C 3.59Å; C71-V74 VanDerWaalsContact O-CG2 3.27Å; C71-V74 WeakPolarHBondContact O-CG2 3.24Å; C71-V74 PolarHBondContact O-N 3.47Å; C71-G75 PolarHBondContact O-N 3.42Å; C71-M76 PolarHBondContact O-N 3.36Å; C71-C77 VanDerWaalsContact CA-SG 3.57Å; C71-C77 HydrophobicContact CB-CB 3.99Å; C71-C77 WeakPolarHBondContact CB-SG 3.35Å; C71-C77 PolarHBondContact O-N 3.34Å; C71-C77 WeakPolarHBondContact SG-CA 3.41Å; C71-C77 WeakPolarHBondContact SG-CB 3.48Å; C71-C77 CovalentContact SG-SG 2.03Å; C71-C77 PolarHBondContact SG-SG 3.12Å
72	D	75.2	Confident	71.1	Confident	62 Å²	62	71 Å²	71	33%	0.332	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-28.8	178.2	-82.1	-35.5	0	0	0	110.3	C26 C70 V74 G75 C77	C26-D72 HydrophobicContact CB-CB 3.86Å; C70-D72 PolarHBondContact O-N 3.04Å; C70-D72 VanDerWaalsContact O-N 3.15Å; D72-V74 VanDerWaalsContact C-N 3.26Å; D72-V74 PolarHBondContact O-N 2.82Å; D72-G75 PolarHBondContact O-N 3.16Å; D72-C77 VanDerWaalsContact CA-SG 3.56Å; D72-C77 PolarHBondContact N-SG 3.3Å; D72-C77 PolarHBondContact OD1-SG 3.26Å
73	C	80.6	Confident	69.3	Low	48 Å²	48	73.1 Å²	73.1	32%	0.324	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-28.7	175.9	-87.7	0	0	0	0	112.2	C26 V35 C70 C71	C26-C73 HydrophobicContact CB-CB 3.75Å; C26-C73 VanDerWaalsContact CB-N 3.34Å; C26-C73 WeakPolarHBondContact CB-SG 2.92Å; C26-C73 WeakPolarHBondContact SG-CB 3.41Å; C26-C73 CovalentContact SG-SG 2Å; C26-C73 PolarHBondContact SG-SG 2.93Å; V35-C73 HydrophobicContact CG2-CB 4.19Å; C70-C73 VanDerWaalsContact O-CB 3.3Å; C70-C73 WeakPolarHBondContact O-CB 3.38Å; C70-C73 PolarHBondContact O-N 3.3Å; C71-C73 VanDerWaalsContact C-N 3.3Å; C71-C73 PolarHBondContact O-N 2.85Å
74	V	79.1	Confident	67.5	Low	23 Å²	23	80.1 Å²	80.1	14%	0.139	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	3.7	-177.7	-63.5	0	0	0	0	112.1	V35 L63 W67 C71 D72 M76	V35-V74 HydrophobicContact CG1-CG1 3.73Å; V35-V74 HydrophobicContact CG2-CG1 4.3Å; L63-V74 HydrophobicContact CD1-CG2 4.22Å; W67-V74 HydrophobicContact CZ3-CG2 4.44Å; C71-V74 CarbonylContact O-C 3.59Å; C71-V74 VanDerWaalsContact O-CG2 3.27Å; C71-V74 WeakPolarHBondContact O-CG2 3.24Å; C71-V74 PolarHBondContact O-N 3.47Å; D72-V74 VanDerWaalsContact C-N 3.26Å; D72-V74 PolarHBondContact O-N 2.82Å; V74-M76 HydrophobicContact CB-CE 3.52Å; V74-M76 HydrophobicContact CG1-CE 4.48Å; V74-M76 HydrophobicContact CG2-CB 4.13Å; V74-M76 HydrophobicContact CG2-CE 3.43Å; V74-M76 VanDerWaalsContact CG2-CE 3.43Å; V74-M76 PolarHBondContact O-N 2.9Å
75	G	72.4	Confident	65.8	Low	54 Å²	54	81.5 Å²	81.5	56%	0.557	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	25	176.7	0	0	0	0	0	113.9	C71 D72	C71-G75 PolarHBondContact O-N 3.42Å; D72-G75 PolarHBondContact O-N 3.16Å
76	M	71.8	Confident	64.7	Low	16 Å²	16	80.2 Å²	80.2	8%	0.079	43%	0.431	C	S	.	.			trans	-117.5	10.7	-176.1	-72.5	-177.5	-78.8	0	0	113	C44 C46 P48 C56 C59 W67 C71 V74 N78	C44-M76 HydrophobicContact CB-CE 4.32Å; C46-M76 HydrophobicContact CB-SD 3.74Å; P48-M76 HydrophobicContact CG-CG 3.62Å; C56-M76 HydrophobicContact CB-SD 4.49Å; C59-M76 HydrophobicContact CB-CE 3.76Å; C59-M76 HydrophobicContact CB-SD 4.3Å; C59-M76 WeakPolarHBondContact SG-CE 3.33Å; W67-M76 HydrophobicContact CH2-CB 3.68Å; W67-M76 HydrophobicContact CH2-SD 4.47Å; W67-M76 HydrophobicContact CZ2-CB 4.18Å; C71-M76 PolarHBondContact O-N 3.36Å; V74-M76 HydrophobicContact CB-CE 3.52Å; V74-M76 HydrophobicContact CG1-CE 4.48Å; V74-M76 HydrophobicContact CG2-CB 4.13Å; V74-M76 HydrophobicContact CG2-CE 3.43Å; V74-M76 VanDerWaalsContact CG2-CE 3.43Å; V74-M76 PolarHBondContact O-N 2.9Å; M76-N78 PolarHBondContact O-N 3.43Å
77	C	68.1	Low	63.4	Low	24 Å²	24	79.7 Å²	79.7	16%	0.162	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-59.1	135.3	168.3	-71.1	0	0	0	0	109.7	C71 D72	C71-C77 VanDerWaalsContact CA-SG 3.57Å; C71-C77 HydrophobicContact CB-CB 3.99Å; C71-C77 WeakPolarHBondContact CB-SG 3.35Å; C71-C77 PolarHBondContact O-N 3.34Å; C71-C77 WeakPolarHBondContact SG-CA 3.41Å; C71-C77 WeakPolarHBondContact SG-CB 3.48Å; C71-C77 CovalentContact SG-SG 2.03Å; C71-C77 PolarHBondContact SG-SG 3.12Å; D72-C77 VanDerWaalsContact CA-SG 3.56Å; D72-C77 PolarHBondContact N-SG 3.3Å; D72-C77 PolarHBondContact OD1-SG 3.26Å
78	N	63.4	Low	62.3	Low	134 Å²	134	79.2 Å²	79.2	72%	0.717	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-53.3	129.3	163.7	-174.1	31.9	0	0	0	107.2	M76 R80	M76-N78 PolarHBondContact O-N 3.43Å; N78-R80 PolarHBondContact O-N 3.27Å
79	P	53.3	Low	61.4	Low	104 Å²	104	76.2 Å²	76.2	68%	0.675	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-49.4	117.2	173.8	16.5	-30.1	0	0	0	107.8	N81	P79-N81 PolarHBondContact O-N 2.86Å
80	R	47	Very low	60.8	Low	169 Å²	169	76.9 Å²	76.9	64%	0.638	42%	0.421	S	S	*	.			trans	-66.4	72.9	175	-74.2	-162.3	168.8	127.7	3.6	108.3	D68 N78	D68-R80 PolarHBondContact O-NH2 2.84Å; N78-R80 PolarHBondContact O-N 3.27Å
81	N	43.2	Very low	60.3	Low	133 Å²	133	78.5 Å²	78.5	71%	0.711	43%	0.432	S	S	*	.			trans	-67.1	133.3	147.5	-112	-22.1	0	0	0	105.6	P79 S83	P79-N81 PolarHBondContact O-N 2.86Å; N81-S83 PolarHBondContact O-N 3.19Å
82	Y	41.9	Very low	60.3	Low	223 Å²	223	80.2 Å²	80.2	88%	0.875	44%	0.443	S	S	*	.			trans	-60	64.7	168.8	-142.3	-94.3	0	0	0	109.1
83	S	44.8	Very low	60.6	Low	76 Å²	76	80.1 Å²	80.1	53%	0.531	45%	0.445	S	S	.	.			trans	-111.2	47.2	-178.9	-77	0	0	0	0	109.5	N81 T85	N81-S83 PolarHBondContact O-N 3.19Å; S83-T85 PolarHBondContact O-N 3.07Å
84	D	46.2	Very low	60.6	Low	155 Å²	155	81 Å²	81	83%	0.829	44%	0.444	S	S	*	.			trans	-69.1	51.9	137.4	-73	-40	0	0	0	108.9	P86	D84-P86 VanDerWaalsContact O-CD 3.31Å; D84-P86 WeakPolarHBondContact O-CD 2.94Å
85	T	47.4	Very low	60.9	Low	69 Å²	69	85.8 Å²	85.8	42%	0.423	46%	0.464	S	S	.	.			trans	-78.4	113.1	160	35.2	0	0	0	0	103.2	S83 S89	S83-T85 PolarHBondContact O-N 3.07Å; T85-S89 VanDerWaalsContact C-CB 3.47Å; T85-S89 VanDerWaalsContact CB-OG 3.26Å; T85-S89 WeakPolarHBondContact CB-OG 3.18Å; T85-S89 PolarHBondContact O-OG 3.11Å
86	P	56	Low	61.6	Low	75 Å²	75	83.5 Å²	83.5	49%	0.487	44%	0.44	S	S	.	.			trans	-44.6	158.4	-176.8	-30.7	34.9	0	0	0	112.1	D84 T88 S89	D84-P86 VanDerWaalsContact O-CD 3.31Å; D84-P86 WeakPolarHBondContact O-CD 2.94Å; P86-T88 PolarHBondContact O-N 3.33Å; P86-S89 WeakPolarHBondContact O-CA 3.3Å; P86-S89 WeakPolarHBondContact O-CB 3.46Å; P86-S89 PolarHBondContact O-N 3.23Å; P86-S89 PolarHBondContact O-OG 3.3Å
87	P	50.3	Low	62.1	Low	40 Å²	40	90.3 Å²	90.3	26%	0.26	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-22.9	175.9	-26.9	34.4	0	0	0	113.9	H202 P217	P87-H202 HydrophobicContact CB-CB 4.39Å; P87-H202 HydrophobicContact CG-CB 4.3Å; P87-P217 HydrophobicContact CB-CB 4.05Å; P87-P217 HydrophobicContact CG-CB 4.29Å
88	T	56.2	Low	62.9	Low	27 Å²	27	97.7 Å²	97.7	17%	0.166	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-5.7	177.1	59.5	0	0	0	0	115.9	P86 K90 R194 F196	P86-T88 PolarHBondContact O-N 3.33Å; T88-K90 VanDerWaalsContact C-N 3.26Å; T88-K90 PolarHBondContact O-N 2.89Å; T88-R194 PolarHBondContact O-NH2 3.28Å; T88-F196 VanDerWaalsContact CA-CD1 3.46Å; T88-F196 HydrophobicContact CG2-CD1 3.98Å; T88-F196 HydrophobicContact CG2-CE1 3.68Å; T88-F196 HydrophobicContact CG2-CG 4.5Å; T88-F196 HydrophobicContact CG2-CZ 4.01Å
89	S	56	Low	64.1	Low	51 Å²	51	94.3 Å²	94.3	36%	0.357	49%	0.488	S	S	.	.	S	Bend	trans	-59.4	-29.9	-173.3	53.8	0	0	0	0	115.5	T85 P86	T85-S89 VanDerWaalsContact C-CB 3.47Å; T85-S89 VanDerWaalsContact CB-OG 3.26Å; T85-S89 WeakPolarHBondContact CB-OG 3.18Å; T85-S89 PolarHBondContact O-OG 3.11Å; P86-S89 WeakPolarHBondContact O-CA 3.3Å; P86-S89 WeakPolarHBondContact O-CB 3.46Å; P86-S89 PolarHBondContact O-N 3.23Å; P86-S89 PolarHBondContact O-OG 3.3Å
90	K	65.3	Low	65.8	Low	127 Å²	127	93.3 Å²	93.3	55%	0.552	48%	0.477	S	S	*	.	S	Bend	trans	-123.5	120.7	172.6	-164.9	-175.1	178.3	178.2	0	107.9	T88 H197	T88-K90 VanDerWaalsContact C-N 3.26Å; T88-K90 PolarHBondContact O-N 2.89Å; K90-H197 HydrophobicContact CB-CB 4.42Å; K90-H197 HydrophobicContact CD-CB 4.36Å; K90-H197 HydrophobicContact CG-CB 4.49Å; K90-H197 PolarHBondContact O-CD2 2Å; K90-H197 PolarHBondContact O-N 3.14Å
91	S	71.6	Confident	67.7	Low	34 Å²	34	88.8 Å²	88.8	24%	0.238	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	145.9	176.4	59	0	0	0	0	111.2	R194 W195	S91-R194 VanDerWaalsContact CB-NE 3.32Å; S91-R194 PolarHBondContact OG-NE 3.02Å; S91-R194 PolarHBondContact OG-NH2 3.03Å; S91-R194 VanDerWaalsContact OG-NH2 3.16Å; S91-W195 CarbonylContact C-O 3.29Å; S91-W195 WeakPolarHBondContact CA-O 3Å; S91-W195 WeakPolarHBondContact CB-O 3.32Å
92	T	75.4	Confident	69.8	Low	41 Å²	41	86.1 Å²	86.1	25%	0.252	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	133.8	162.4	-57.6	0	0	0	0	108.6	I178 R194 W195 H197	T92-I178 HydrophobicContact CG2-CD1 3.58Å; T92-R194 CarbonylContact O-C 3.55Å; T92-R194 VanDerWaalsContact O-CA 3.29Å; T92-R194 WeakPolarHBondContact O-CA 2.95Å; T92-W195 PolarHBondContact N-O 2.92Å; T92-W195 PolarHBondContact O-N 3.47Å; T92-H197 PolarHBondContact N-NE2 2.99Å; T92-H197 PolarHBondContact OG1-CE1 3.23Å; T92-H197 VanDerWaalsContact OG1-CE1 3.28Å; T92-H197 PolarHBondContact OG1-NE2 3.49Å
93	V	81.5	Confident	72	Confident	60 Å²	60	78.6 Å²	78.6	36%	0.364	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	133	174.7	178.7	0	0	0	0	107.5	Y193 R194 S231	V93-Y193 WeakPolarHBondContact CA-O 3.04Å; V93-R194 HydrophobicContact CG2-CB 4.17Å; V93-R194 HydrophobicContact CG2-CG 3.82Å; V93-S231 WeakPolarHBondContact CG1-OG 3.43Å; V93-S231 VanDerWaalsContact CG2-OG 3.32Å; V93-S231 WeakPolarHBondContact CG2-OG 3.27Å
94	E	80.8	Confident	74.1	Confident	67 Å²	67	75.1 Å²	75.1	31%	0.313	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	148.6	176.3	174.7	-173.8	167.4	0	0	109.8	K182 K192 Y193	E94-K182 IonicContact OE1-NZ 2.73Å; E94-K182 PolarHBondContact OE1-NZ 2.58Å; E94-K182 IonicContact OE2-NZ 3.97Å; E94-K192 WeakPolarHBondContact O-CA 3.33Å; E94-Y193 HydrophobicContact CB-CD1 4.17Å; E94-Y193 HydrophobicContact CB-CE1 3.46Å; E94-Y193 VanDerWaalsContact CB-CE1 3.46Å; E94-Y193 HydrophobicContact CG-CE1 3.9Å; E94-Y193 PolarHBondContact N-O 3.29Å; E94-Y193 PolarHBondContact O-N 3.03Å; E94-Y193 WeakPolarHBondContact OE2-CE1 3.47Å; E94-Y193 PolarHBondContact OE2-OH 3.38Å
95	E	85.5	Confident	76.1	Confident	122 Å²	122	73.6 Å²	73.6	57%	0.57	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	131.5	174.5	-171.3	155.3	-127.3	0	0	110	K192	E95-K192 HydrophobicContact CB-CG 4.38Å; E95-K192 HydrophobicContact CG-CG 4.29Å; E95-K192 VanDerWaalsContact OE1-CE 3.24Å; E95-K192 WeakPolarHBondContact OE1-CE 3.11Å
96	L	86.9	Confident	78	Confident	7 Å²	7	73.4 Å²	73.4	4%	0.037	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-84	140.1	-176.8	-64.6	176.6	0	0	0	109.9	K182 C185 E186 A190 S191 Y193	L96-K182 HydrophobicContact CD2-CG 3.83Å; L96-C185 HydrophobicContact CD1-CB 3.62Å; L96-E186 HydrophobicContact CB-CG 4.28Å; L96-E186 HydrophobicContact CD1-CG 3.89Å; L96-E186 HydrophobicContact CD2-CG 3.53Å; L96-E186 HydrophobicContact CG-CG 4.09Å; L96-A190 HydrophobicContact CD1-CB 4.12Å; L96-A190 WeakPolarHBondContact CD1-O 3.01Å; L96-S191 PolarHBondContact N-O 3.44Å; L96-Y193 HydrophobicContact CD2-CD1 3.52Å; L96-Y193 HydrophobicContact CD2-CE1 3.95Å; L96-Y193 HydrophobicContact CG-CD1 4.12Å
97	H	82.3	Confident	79.5	Confident	158 Å²	158	72.5 Å²	72.5	73%	0.731	39%	0.39	S	S	*	.	S	Bend	trans	-78.7	136.5	174.6	-72.9	63.2	0	0	0	108.7
98	E	86.2	Confident	81.1	Confident	179 Å²	179	71.3 Å²	71.3	84%	0.836	38%	0.382	S	S	*	.	S	Bend	trans	62.2	57.9	177.7	-51.9	-175.1	156.6	0	0	115
99	P	87.2	Confident	82.4	Confident	63 Å²	63	74.4 Å²	74.4	41%	0.409	39%	0.394	S	S	.	.			trans	-61.4	147.5	174.3	26.8	-34.1	0	0	0	112.1	P101	P99-P101 WeakPolarHBondContact O-CD 3.39Å
100	I	90.6	Very high	83.1	Confident	84 Å²	84	74.9 Å²	74.9	43%	0.431	41%	0.407	S	S	.	.			trans	-122.5	78.5	175.1	-49.6	177.7	0	0	0	108.3	S102 L103 F104 G189	I100-S102 PolarHBondContact O-N 2.73Å; I100-S102 VanDerWaalsContact O-N 3.11Å; I100-L103 HydrophobicContact CB-CB 4.07Å; I100-L103 HydrophobicContact CG2-CB 3.68Å; I100-L103 WeakPolarHBondContact O-CB 3.43Å; I100-L103 PolarHBondContact O-N 3.21Å; I100-F104 PolarHBondContact O-N 3.23Å; I100-G189 CarbonylContact C-O 3.42Å; I100-G189 VanDerWaalsContact C-O 3.29Å; I100-G189 PolarHBondContact N-O 3.49Å; I100-G189 VanDerWaalsContact N-O 3.09Å
101	P	85.6	Confident	82.7	Confident	73 Å²	73	76.9 Å²	76.9	47%	0.474	42%	0.424	S	S	.	.	H	α-helix	trans	-59.1	-29.4	-173.4	-25.8	34.9	0	0	0	114	P99 R105 T224	P99-P101 WeakPolarHBondContact O-CD 3.39Å; P101-R105 VanDerWaalsContact O-CB 3.31Å; P101-R105 WeakPolarHBondContact O-CB 3.26Å; P101-R105 PolarHBondContact O-N 3.41Å; P101-T224 HydrophobicContact CB-CG2 4.1Å
102	S	87.4	Confident	82.1	Confident	77 Å²	77	77.2 Å²	77.2	54%	0.538	42%	0.424	S	S	.	.	H	α-helix	trans	-66.4	-37.9	176.3	53.6	0	0	0	0	112.7	I100 A106	I100-S102 PolarHBondContact O-N 2.73Å; I100-S102 VanDerWaalsContact O-N 3.11Å; S102-A106 WeakPolarHBondContact O-CB 3.02Å; S102-A106 PolarHBondContact O-N 3.17Å
103	L	88.6	Confident	81.3	Confident	66 Å²	66	84.7 Å²	84.7	35%	0.346	46%	0.456	S	S	.	.	H	α-helix	trans	-69.2	-47.1	175.8	176.2	61.3	0	0	0	110.4	I100 R105 A106 L107 S187	I100-L103 HydrophobicContact CB-CB 4.07Å; I100-L103 HydrophobicContact CG2-CB 3.68Å; I100-L103 WeakPolarHBondContact O-CB 3.43Å; I100-L103 PolarHBondContact O-N 3.21Å; L103-R105 VanDerWaalsContact C-N 3.3Å; L103-R105 PolarHBondContact O-N 3.42Å; L103-A106 PolarHBondContact O-N 3.42Å; L103-A106 VanDerWaalsContact O-N 3.12Å; L103-L107 HydrophobicContact CD1-CD1 4.08Å; L103-L107 HydrophobicContact CD1-CG 4.23Å; L103-L107 HydrophobicContact CG-CD1 4.09Å; L103-L107 WeakPolarHBondContact O-CG 3.11Å; L103-L107 PolarHBondContact O-N 3.43Å; L103-S187 WeakPolarHBondContact CD2-O 3.29Å
104	F	89	Confident	80.5	Confident	3 Å²	3	85.5 Å²	85.5	1%	0.013	46%	0.458	C	S	.	.	H	α-helix	trans	-58.6	-44.6	178.4	-170.3	-94.2	0	0	0	111.4	I100 L107 T108 T168 V170 M188 A190 C222 T224	I100-F104 PolarHBondContact O-N 3.23Å; F104-L107 PolarHBondContact O-N 3.4Å; F104-T108 HydrophobicContact CD1-CG2 4.16Å; F104-T108 HydrophobicContact CE1-CG2 3.93Å; F104-T108 HydrophobicContact CZ-CG2 4.14Å; F104-T108 WeakPolarHBondContact O-CB 3.48Å; F104-T108 VanDerWaalsContact O-CG2 3.32Å; F104-T108 WeakPolarHBondContact O-CG2 3.37Å; F104-T108 PolarHBondContact O-N 3.42Å; F104-T108 PolarHBondContact O-OG1 3.4Å; F104-T168 HydrophobicContact CE1-CG2 3.76Å; F104-T168 WeakPolarHBondContact CE1-O 3.07Å; F104-T168 HydrophobicContact CZ-CG2 4.5Å; F104-V170 HydrophobicContact CE1-CG2 4.49Å; F104-V170 HydrophobicContact CE2-CG2 4.02Å; F104-V170 HydrophobicContact CZ-CB 4.48Å; F104-V170 HydrophobicContact CZ-CG2 3.67Å; F104-M188 WeakPolarHBondContact CA-O 3.38Å; F104-M188 VanDerWaalsContact CB-O 3.28Å; F104-M188 WeakPolarHBondContact CB-O 3.41Å; F104-M188 HydrophobicContact CD2-CB 4.02Å; F104-M188 HydrophobicContact CE2-CB 4.46Å; F104-M188 HydrophobicContact CE2-CE 4.26Å; F104-M188 PolarHBondContact N-O 3.36Å; F104-M188 VanDerWaalsContact N-O 3.11Å; F104-A190 HydrophobicContact CD2-CB 3.77Å; F104-A190 HydrophobicContact CE2-CB 3.74Å; F104-C222 HydrophobicContact CE2-CB 3.85Å; F104-C222 HydrophobicContact CZ-CB 4.37Å; F104-T224 HydrophobicContact CD1-CG2 4.21Å; F104-T224 WeakPolarHBondContact CD1-OG1 2.92Å; F104-T224 WeakPolarHBondContact CE1-OG1 3.31Å; F104-T224 WeakPolarHBondContact CG-OG1 3.39Å
105	R	87.7	Confident	79.9	Confident	122 Å²	122	89.1 Å²	89.1	46%	0.46	48%	0.48	S	S	.	.	H	α-helix	trans	-61.4	-44.8	175.2	-172.7	173.3	69.1	-161.6	-1	111.8	P101 L103 L107 T108 E109	P101-R105 VanDerWaalsContact O-CB 3.31Å; P101-R105 WeakPolarHBondContact O-CB 3.26Å; P101-R105 PolarHBondContact O-N 3.41Å; L103-R105 VanDerWaalsContact C-N 3.3Å; L103-R105 PolarHBondContact O-N 3.42Å; R105-L107 VanDerWaalsContact C-N 3.26Å; R105-L107 PolarHBondContact O-N 2.83Å; R105-T108 WeakPolarHBondContact CA-OG1 3.04Å; R105-T108 PolarHBondContact O-N 2.6Å; R105-T108 VanDerWaalsContact O-N 3.14Å; R105-T108 PolarHBondContact O-OG1 2.75Å; R105-E109 WeakPolarHBondContact CD-OE1 3.12Å; R105-E109 HydrophobicContact CG-CG 3.62Å; R105-E109 WeakPolarHBondContact CG-OE2 3.27Å; R105-E109 IonicContact NE-OE2 3.92Å; R105-E109 VanDerWaalsContact O-CB 3.31Å; R105-E109 WeakPolarHBondContact O-CB 3.27Å; R105-E109 WeakPolarHBondContact O-CG 3.49Å; R105-E109 PolarHBondContact O-N 3.22Å
106	A	87.5	Confident	79.7	Confident	66 Å²	66	87.1 Å²	87.1	55%	0.545	47%	0.467	S	S	.	.	H	α-helix	trans	-62.9	-31.6	178.2	0	0	0	0	0	113.4	S102 L103	S102-A106 WeakPolarHBondContact O-CB 3.02Å; S102-A106 PolarHBondContact O-N 3.17Å; L103-A106 PolarHBondContact O-N 3.42Å; L103-A106 VanDerWaalsContact O-N 3.12Å
107	L	87.1	Confident	79.5	Confident	56 Å²	56	90.3 Å²	90.3	29%	0.293	48%	0.484	S	S	.	.	H	α-helix	trans	-80.8	-19.4	176.9	-68.4	173.5	0	0	0	113.4	L103 F104 R105 M188	L103-L107 HydrophobicContact CD1-CD1 4.08Å; L103-L107 HydrophobicContact CD1-CG 4.23Å; L103-L107 HydrophobicContact CG-CD1 4.09Å; L103-L107 WeakPolarHBondContact O-CG 3.11Å; L103-L107 PolarHBondContact O-N 3.43Å; F104-L107 PolarHBondContact O-N 3.4Å; R105-L107 VanDerWaalsContact C-N 3.26Å; R105-L107 PolarHBondContact O-N 2.83Å; L107-M188 HydrophobicContact CD1-CB 4.2Å; L107-M188 HydrophobicContact CD1-CG 4.25Å
108	T	85.5	Confident	79.7	Confident	15 Å²	15	85.1 Å²	85.1	9%	0.092	46%	0.461	C	S	.	.	H	α-helix	trans	-109.6	-17.3	-174.9	54.1	0	0	0	0	114.1	F104 R105 I118 T168 V170	F104-T108 HydrophobicContact CD1-CG2 4.16Å; F104-T108 HydrophobicContact CE1-CG2 3.93Å; F104-T108 HydrophobicContact CZ-CG2 4.14Å; F104-T108 WeakPolarHBondContact O-CB 3.48Å; F104-T108 VanDerWaalsContact O-CG2 3.32Å; F104-T108 WeakPolarHBondContact O-CG2 3.37Å; F104-T108 PolarHBondContact O-N 3.42Å; F104-T108 PolarHBondContact O-OG1 3.4Å; R105-T108 WeakPolarHBondContact CA-OG1 3.04Å; R105-T108 PolarHBondContact O-N 2.6Å; R105-T108 VanDerWaalsContact O-N 3.14Å; R105-T108 PolarHBondContact O-OG1 2.75Å; T108-I118 HydrophobicContact CG2-CD1 4.26Å; T108-I118 HydrophobicContact CG2-CG2 4.13Å; T108-T168 HydrophobicContact CG2-CG2 3.98Å; T108-V170 HydrophobicContact CG2-CG2 3.41Å; T108-V170 VanDerWaalsContact CG2-CG2 3.41Å
109	E	83.2	Confident	79.6	Confident	92 Å²	92	79.4 Å²	79.4	43%	0.43	44%	0.439	S	S	.	.	S	Bend	trans	-83.6	110	172.3	-72.8	-173.7	144	0	0	110.8	R105 K163	R105-E109 WeakPolarHBondContact CD-OE1 3.12Å; R105-E109 HydrophobicContact CG-CG 3.62Å; R105-E109 WeakPolarHBondContact CG-OE2 3.27Å; R105-E109 IonicContact NE-OE2 3.92Å; R105-E109 VanDerWaalsContact O-CB 3.31Å; R105-E109 WeakPolarHBondContact O-CB 3.27Å; R105-E109 WeakPolarHBondContact O-CG 3.49Å; R105-E109 PolarHBondContact O-N 3.22Å; E109-K163 IonicContact OE1-NZ 2.83Å; E109-K163 PolarHBondContact OE1-NZ 2.9Å
110	G	69.3	Low	79.3	Confident	60 Å²	60	79.1 Å²	79.1	62%	0.619	44%	0.438	S	S	*	.	S	Bend	trans	116.7	174	172.7	0	0	0	0	0	114.1	T112	G110-T112 PolarHBondContact O-N 3.29Å
111	D	58.2	Low	78.6	Confident	170 Å²	170	77.5 Å²	77.5	91%	0.909	43%	0.428	S	S	*	.			trans	-79.7	84.5	176.1	-170	21.1	0	0	0	109
112	T	59.3	Low	78.3	Confident	41 Å²	41	78.8 Å²	78.8	25%	0.252	44%	0.436	S	S	.	.			trans	-82	133.5	173.1	53.4	0	0	0	0	108.6	G110 L114	G110-T112 PolarHBondContact O-N 3.29Å; T112-L114 PolarHBondContact O-N 2.75Å
113	Q	57.6	Low	77.3	Confident	197 Å²	197	76.3 Å²	76.3	92%	0.921	42%	0.418	S	S	*	.	S	Bend	trans	-68.9	22.7	178.3	-63	-176.2	15.6	0	0	113.7
114	L	65.4	Low	75.7	Confident	77 Å²	77	76.7 Å²	76.7	40%	0.403	43%	0.431	S	S	.	.	S	Bend	trans	-91.9	133.6	-176.6	-62.2	165	0	0	0	107.4	T112 W116	T112-L114 PolarHBondContact O-N 2.75Å; L114-W116 HydrophobicContact CB-CD2 3.81Å; L114-W116 HydrophobicContact CB-CE3 3.9Å; L114-W116 HydrophobicContact CB-CG 4.17Å; L114-W116 HydrophobicContact CB-CZ3 4.37Å; L114-W116 HydrophobicContact CD1-CD2 4.41Å; L114-W116 HydrophobicContact CD1-CE3 3.76Å; L114-W116 HydrophobicContact CD1-CH2 3.74Å; L114-W116 HydrophobicContact CD1-CZ2 4.36Å; L114-W116 HydrophobicContact CD1-CZ3 3.41Å; L114-W116 VanDerWaalsContact CD1-CZ3 3.41Å; L114-W116 HydrophobicContact CD2-CH2 4.43Å; L114-W116 HydrophobicContact CD2-CZ2 4.36Å; L114-W116 HydrophobicContact CG-CE3 4.39Å; L114-W116 HydrophobicContact CG-CZ3 4.36Å; L114-W116 PolarHBondContact O-N 3.32Å
115	N	68.1	Low	74	Confident	144 Å²	144	84.2 Å²	84.2	77%	0.77	47%	0.466	S	S	*	.	S	Bend	trans	-72.1	51.6	176.4	-88	44.5	0	0	0	111.4
116	W	80.9	Confident	72	Confident	80 Å²	80	86.1 Å²	86.1	30%	0.303	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.1	-179.8	-57.7	-23.3	0	0	0	109.8	L114 I118 V170 F172 M188	L114-W116 HydrophobicContact CB-CD2 3.81Å; L114-W116 HydrophobicContact CB-CE3 3.9Å; L114-W116 HydrophobicContact CB-CG 4.17Å; L114-W116 HydrophobicContact CB-CZ3 4.37Å; L114-W116 HydrophobicContact CD1-CD2 4.41Å; L114-W116 HydrophobicContact CD1-CE3 3.76Å; L114-W116 HydrophobicContact CD1-CH2 3.74Å; L114-W116 HydrophobicContact CD1-CZ2 4.36Å; L114-W116 HydrophobicContact CD1-CZ3 3.41Å; L114-W116 VanDerWaalsContact CD1-CZ3 3.41Å; L114-W116 HydrophobicContact CD2-CH2 4.43Å; L114-W116 HydrophobicContact CD2-CZ2 4.36Å; L114-W116 HydrophobicContact CG-CE3 4.39Å; L114-W116 HydrophobicContact CG-CZ3 4.36Å; L114-W116 PolarHBondContact O-N 3.32Å; W116-I118 HydrophobicContact CB-CG1 4.42Å; W116-V170 HydrophobicContact CB-CG1 3.84Å; W116-V170 HydrophobicContact CD2-CG1 4.24Å; W116-V170 HydrophobicContact CE3-CG1 4.14Å; W116-V170 HydrophobicContact CG-CG1 4.15Å; W116-F172 AromaticContact CD1-CD1 3.9Å; W116-F172 HydrophobicContact CD2-CE1 4.36Å; W116-F172 AromaticContact CE2-CE1 3.95Å; W116-F172 HydrophobicContact CZ2-CE1 4.34Å; W116-F172 AromaticContact NE1-CD1 3.84Å; W116-F172 AromaticContact NE1-CE1 3.84Å; W116-M188 HydrophobicContact CE3-CE 3.92Å; W116-M188 HydrophobicContact CH2-CE 4.15Å; W116-M188 HydrophobicContact CH2-SD 4.21Å; W116-M188 HydrophobicContact CZ3-CE 3.49Å; W116-M188 VanDerWaalsContact CZ3-CE 3.49Å; W116-M188 HydrophobicContact CZ3-SD 4.14Å
117	N	83.3	Confident	69.8	Low	74 Å²	74	88.5 Å²	88.5	40%	0.396	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	109	174.7	-177	5.9	0	0	0	108.8	Y171	N117-Y171 PolarHBondContact N-O 3.35Å; N117-Y171 PolarHBondContact O-N 3.33Å
118	I	85.9	Confident	67.7	Low	48 Å²	48	88.9 Å²	88.9	25%	0.246	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	120.7	-175.9	-51.1	178.9	0	0	0	108.8	T108 W116 T168 V169 V170	T108-I118 HydrophobicContact CG2-CD1 4.26Å; T108-I118 HydrophobicContact CG2-CG2 4.13Å; W116-I118 HydrophobicContact CB-CG1 4.42Å; I118-T168 HydrophobicContact CG2-CG2 3.84Å; I118-V169 WeakPolarHBondContact CA-O 3.21Å; I118-V170 HydrophobicContact CG1-CG2 4.25Å; I118-V170 HydrophobicContact CG2-CG2 4.43Å
119	V	83.1	Confident	65.7	Low	60 Å²	60	95.5 Å²	95.5	36%	0.364	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.8	179.3	-176.6	0	0	0	0	109.1	V169 Y171	V119-V169 PolarHBondContact N-O 3.05Å; V119-V169 PolarHBondContact O-N 2.9Å; V119-Y171 HydrophobicContact CB-CE2 4.39Å; V119-Y171 HydrophobicContact CG2-CD2 4.44Å; V119-Y171 HydrophobicContact CG2-CE2 4.13Å
120	S	81.6	Confident	63.9	Low	57 Å²	57	96.8 Å²	96.8	40%	0.399	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130	174.6	-60.6	0	0	0	0	110.1	C167 T168	S120-C167 CarbonylContact C-O 3.59Å; S120-C167 VanDerWaalsContact CA-O 3.29Å; S120-C167 WeakPolarHBondContact CA-O 3.41Å; S120-T168 WeakPolarHBondContact OG-CG2 3.43Å; S120-T168 PolarHBondContact OG-OG1 3.41Å
121	F	77.3	Confident	62.7	Low	49 Å²	49	101.3 Å²	101.3	22%	0.215	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.6	176.3	53.8	-88.7	0	0	0	110.3	V123 M166 C167 V169 L229 I234	F121-V123 PolarHBondContact O-N 2.67Å; F121-M166 WeakPolarHBondContact O-CA 3.41Å; F121-C167 HydrophobicContact CD1-CB 4.47Å; F121-C167 HydrophobicContact CD2-CB 3.9Å; F121-C167 HydrophobicContact CE1-CB 4.07Å; F121-C167 HydrophobicContact CE2-CB 3.44Å; F121-C167 VanDerWaalsContact CE2-CB 3.44Å; F121-C167 HydrophobicContact CG-CB 4.4Å; F121-C167 HydrophobicContact CZ-CB 3.53Å; F121-C167 WeakPolarHBondContact CZ-SG 3.4Å; F121-C167 PolarHBondContact N-O 3.28Å; F121-C167 PolarHBondContact O-N 2.99Å; F121-V169 HydrophobicContact CE1-CG2 3.74Å; F121-V169 HydrophobicContact CZ-CG2 4.35Å; F121-L229 HydrophobicContact CE2-CD2 3.77Å; F121-L229 HydrophobicContact CZ-CD2 4.26Å; F121-I234 HydrophobicContact CE1-CG2 4.39Å; F121-I234 HydrophobicContact CZ-CD1 4.37Å; F121-I234 HydrophobicContact CZ-CG1 4.13Å; F121-I234 HydrophobicContact CZ-CG2 4.37Å
122	P	77.5	Confident	62.1	Low	100 Å²	100	97.5 Å²	97.5	65%	0.649	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.6	133.2	171.7	28.1	-33.2	0	0	0	109.2	A124 H165	P122-A124 PolarHBondContact O-N 3.19Å; P122-H165 CarbonylContact C-O 3.51Å; P122-H165 WeakPolarHBondContact CA-O 3.36Å
123	V	67	Low	61.5	Low	25 Å²	25	100.7 Å²	100.7	15%	0.152	53%	0.525	C	S	.	.			trans	-62.6	105.9	167.5	169.3	0	0	0	0	106.5	F121 E125 H165 C167 L229	F121-V123 PolarHBondContact O-N 2.67Å; V123-E125 PolarHBondContact O-N 3.27Å; V123-H165 WeakPolarHBondContact CB-O 3.38Å; V123-H165 PolarHBondContact N-O 3.26Å; V123-C167 HydrophobicContact CG2-CB 3.93Å; V123-L229 HydrophobicContact CB-CD1 4.11Å; V123-L229 HydrophobicContact CG1-CD1 3.35Å; V123-L229 HydrophobicContact CG2-CD1 4.04Å
124	A	55.9	Low	61	Low	74 Å²	74	95.9 Å²	95.9	61%	0.612	51%	0.509	S	S	*	.			trans	-63.5	122.4	175.2	0	0	0	0	0	109	P122 E126	P122-A124 PolarHBondContact O-N 3.19Å; A124-E126 PolarHBondContact O-N 3.4Å
125	E	52.9	Low	59.9	Low	162 Å²	162	95.4 Å²	95.4	76%	0.757	51%	0.512	S	S	*	.			trans	-74	36	175.5	-161.9	167.7	176.1	0	0	112.2	V123 S128	V123-E125 PolarHBondContact O-N 3.27Å; E125-S128 PolarHBondContact O-OG 3.14Å
126	E	44.6	Very low	58.5	Low	161 Å²	161	95 Å²	95	75%	0.752	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	40.4	-178.4	-77.1	-151.3	131.3	0	0	113.1	A124	A124-E126 PolarHBondContact O-N 3.4Å
127	L	43.1	Very low	56.9	Low	117 Å²	117	98.4 Å²	98.4	61%	0.613	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-1.1	153.9	-79.1	169.8	0	0	0	113	H129 H130 E131	L127-H129 PolarHBondContact O-N 3.12Å; L127-H129 VanDerWaalsContact O-N 3.13Å; L127-H130 PolarHBondContact O-N 3.19Å; L127-H130 VanDerWaalsContact O-N 3.09Å; L127-E131 PolarHBondContact O-N 2.87Å
128	S	41.3	Very low	55	Low	63 Å²	63	102.7 Å²	102.7	44%	0.441	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.5	174.6	55.1	0	0	0	0	113.6	E125	E125-S128 PolarHBondContact O-OG 3.14Å
129	H	43.9	Very low	53.1	Low	154 Å²	154	105.4 Å²	105.4	71%	0.713	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-14.7	175.1	-81	-67.2	0	0	0	115	L127	L127-H129 PolarHBondContact O-N 3.12Å; L127-H129 VanDerWaalsContact O-N 3.13Å
130	H	45.1	Very low	51.1	Low	119 Å²	119	108.2 Å²	108.2	55%	0.551	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-21.2	178.9	-147.2	63.6	0	0	0	113.9	L127 N132 L133	L127-H130 PolarHBondContact O-N 3.19Å; L127-H130 VanDerWaalsContact O-N 3.09Å; H130-N132 VanDerWaalsContact C-N 3.26Å; H130-N132 PolarHBondContact O-N 3.45Å; H130-L133 PolarHBondContact O-N 3.03Å
131	E	45.8	Very low	48.9	Very low	155 Å²	155	112.7 Å²	112.7	72%	0.724	60%	0.6	S	S	*	*	H	α-helix	trans	-68.1	-24.7	173.5	-68.8	-153.7	146.6	0	0	113.2	L127 L133 S135	L127-E131 PolarHBondContact O-N 2.87Å; E131-L133 VanDerWaalsContact C-N 3.31Å; E131-L133 PolarHBondContact O-N 3.43Å; E131-S135 PolarHBondContact O-N 2.97Å
132	N	44.6	Very low	46.9	Very low	91 Å²	91	118.8 Å²	118.8	49%	0.487	63%	0.629	S	S	.	*	H	α-helix	trans	-65	-34.3	173.6	-108.5	-53.9	0	0	0	112.1	H130 V134 S135 F136	H130-N132 VanDerWaalsContact C-N 3.26Å; H130-N132 PolarHBondContact O-N 3.45Å; N132-V134 VanDerWaalsContact C-N 3.34Å; N132-V134 PolarHBondContact O-N 3.02Å; N132-S135 PolarHBondContact O-N 3.49Å; N132-F136 HydrophobicContact CB-CD2 4.43Å; N132-F136 HydrophobicContact CB-CE2 4.08Å; N132-F136 WeakPolarHBondContact O-CD2 2.99Å; N132-F136 PolarHBondContact O-N 3.4Å; N132-F136 WeakPolarHBondContact OD1-CE2 3.02Å
133	L	47.1	Very low	45.1	Very low	107 Å²	107	119.1 Å²	119.1	56%	0.56	63%	0.631	S	S	*	*	H	α-helix	trans	-73.4	-26.8	-173.7	-150.2	80.9	0	0	0	113	H130 E131	H130-L133 PolarHBondContact O-N 3.03Å; E131-L133 VanDerWaalsContact C-N 3.31Å; E131-L133 PolarHBondContact O-N 3.43Å
134	V	45.8	Very low	43.4	Very low	96 Å²	96	125.2 Å²	125.2	58%	0.582	66%	0.658	S	S	*	*	H	α-helix	trans	-82	-30	176.6	-175.3	0	0	0	0	111.1	N132	N132-V134 VanDerWaalsContact C-N 3.34Å; N132-V134 PolarHBondContact O-N 3.02Å
135	S	42.4	Very low	42.4	Very low	67 Å²	67	128.3 Å²	128.3	47%	0.469	66%	0.659	S	S	.	*	H	α-helix	trans	-71.6	-31.8	174	-171.4	0	0	0	0	113.2	E131 N132 L137 E138 T139	E131-S135 PolarHBondContact O-N 2.97Å; N132-S135 PolarHBondContact O-N 3.49Å; S135-L137 VanDerWaalsContact C-N 3.34Å; S135-L137 PolarHBondContact O-N 3.2Å; S135-E138 PolarHBondContact O-N 3.42Å; S135-T139 PolarHBondContact O-N 3.17Å; S135-T139 PolarHBondContact O-OG1 2.02Å
136	F	40.1	Very low	41.4	Very low	137 Å²	137	128.9 Å²	128.9	60%	0.601	66%	0.662	S	S	*	*	H	α-helix	trans	-70	-25.2	177.1	-78.3	-65	0	0	0	114.2	N132	N132-F136 HydrophobicContact CB-CD2 4.43Å; N132-F136 HydrophobicContact CB-CE2 4.08Å; N132-F136 WeakPolarHBondContact O-CD2 2.99Å; N132-F136 PolarHBondContact O-N 3.4Å; N132-F136 WeakPolarHBondContact OD1-CE2 3.02Å
137	L	46.8	Very low	41.3	Very low	150 Å²	150	128.8 Å²	128.8	79%	0.785	67%	0.667	S	S	*	*	H	α-helix	trans	-85.1	-18.6	177.8	-72.2	173.9	0	0	0	113.4	S135	S135-L137 VanDerWaalsContact C-N 3.34Å; S135-L137 PolarHBondContact O-N 3.2Å
138	E	43.9	Very low	40.7	Very low	165 Å²	165	129.5 Å²	129.5	77%	0.771	68%	0.676	S	S	*	*	H	α-helix	trans	-92.8	-13.9	178.8	-156.4	155.3	-170.3	0	0	113	S135	S135-E138 PolarHBondContact O-N 3.42Å
139	T	44.5	Very low	40.9	Very low	105 Å²	105	131.9 Å²	131.9	64%	0.644	69%	0.692	S	S	*	*	S	Bend	trans	-95	-1.9	-177.4	-43.3	0	0	0	0	114.3	S135	S135-T139 PolarHBondContact O-N 3.17Å; S135-T139 PolarHBondContact O-OG1 2.02Å
140	V	42.1	Very low	40.3	Very low	119 Å²	119	130.5 Å²	130.5	72%	0.721	69%	0.694	S	S	*	*	S	Bend	trans	-87.1	-7.5	-178	178.2	0	0	0	0	113.8
141	N	35.9	Very low	40.2	Very low	150 Å²	150	130.5 Å²	130.5	80%	0.802	71%	0.705	S	S	*	*	S	Bend	trans	-110.6	81.9	173.9	-92.9	-28.6	0	0	0	113
142	Q	35.2	Very low	39.6	Very low	178 Å²	178	128.3 Å²	128.3	83%	0.832	71%	0.707	S	S	*	*			trans	79.1	156.1	143.9	-92.2	-172.6	-15.2	0	0	119.7
143	P	39.1	Very low	39.8	Very low	106 Å²	106	131.4 Å²	131.4	69%	0.688	72%	0.723	S	S	*	*				-119.3	177	-126.5	28.9	-7.6	0	0	0	114
144	H	32.5	Very low	39.3	Very low	153 Å²	153	133.4 Å²	133.4	71%	0.708	74%	0.735	S	S	*	*			trans	99.9	116.3	157	-96.2	-70.7	0	0	0	120
145	H	33	Very low	39.2	Very low	140 Å²	140	135.5 Å²	135.5	65%	0.648	75%	0.747	S	S	*	*			trans	98	104.6	138.5	-71.6	-58.7	0	0	0	121.7
146	Q	33.8	Very low	39	Very low	173 Å²	173	140.8 Å²	140.8	81%	0.808	76%	0.764	S	S	*	*				101.1	112.9	120.3	-73.2	178.8	-12.1	0	0	121.1
147	N	41.2	Very low	38.7	Very low	160 Å²	160	138 Å²	138	86%	0.856	77%	0.767	S	S	*	*			trans	-29.8	130.1	155.4	-77.2	-12.6	0	0	0	115.8
148	V	31.8	Very low	38.3	Very low	132 Å²	132	137.5 Å²	137.5	80%	0.8	77%	0.772	S	S	*	*			trans	-144.3	118.4	139	-177.5	0	0	0	0	109.7	V150	V148-V150 HydrophobicContact CG1-CG2 4.02Å
149	S	43.6	Very low	38.1	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	77%	0.77	S	S	*	*			trans	-82.3	134.1	165.1	49.7	0	0	0	0	110.7
150	V	31.5	Very low	38	Very low	124 Å²	124	136 Å²	136	75%	0.752	76%	0.757	S	S	*	*			trans	-140.8	127.6	161.3	-171.9	0	0	0	0	109.6	V148	V148-V150 HydrophobicContact CG1-CG2 4.02Å
151	P	44.7	Very low	38.3	Very low	120 Å²	120	133.5 Å²	133.5	78%	0.779	75%	0.745	S	S	*	*			trans	-90.4	137.2	174.1	34.2	-27.6	0	0	0	110.3
152	S	32	Very low	39.1	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	74%	0.742	S	S	*	*			trans	-133.7	105.6	167	-161.5	0	0	0	0	110.2	N154	S152-N154 PolarHBondContact O-N 3.37Å
153	N	49.5	Very low	39.9	Very low	156 Å²	156	129.3 Å²	129.3	83%	0.834	72%	0.724	S	S	*	*			trans	-59.9	123.8	166.1	-78.6	-24.8	0	0	0	109.1
154	N	35.8	Very low	40.8	Very low	148 Å²	148	130 Å²	130	79%	0.791	72%	0.717	S	S	*	*			trans	-132.5	116.7	151.3	-83.4	-32.1	0	0	0	109.3	S152 H156	S152-N154 PolarHBondContact O-N 3.37Å; N154-H156 PolarHBondContact O-N 3.3Å
155	V	43.5	Very low	42.6	Very low	140 Å²	140	126.8 Å²	126.8	85%	0.848	70%	0.703	S	S	*	*			trans	-59.1	110.5	166.4	175.3	0	0	0	0	107.5
156	H	39.3	Very low	44.7	Very low	179 Å²	179	123.4 Å²	123.4	83%	0.829	69%	0.688	S	S	*	*			trans	-125.8	126.7	155	-106.1	51.5	0	0	0	107.3	N154	N154-H156 PolarHBondContact O-N 3.3Å
157	A	34	Very low	47	Very low	79 Å²	79	115.1 Å²	115.1	65%	0.653	65%	0.649	S	S	*	*			trans	-51.4	142.6	172.6	0	0	0	0	0	109.4	Y159	A157-Y159 PolarHBondContact O-N 2.99Å
158	P	37.1	Very low	49.1	Very low	138 Å²	138	108.4 Å²	108.4	90%	0.896	61%	0.614	S	S	*	*			trans	-73.1	75.2	174.4	31.3	-32.3	0	0	0	108.4	S160	P158-S160 VanDerWaalsContact C-N 3.27Å; P158-S160 PolarHBondContact O-N 3.18Å
159	Y	40.6	Very low	51.8	Low	185 Å²	185	102.1 Å²	102.1	73%	0.725	58%	0.576	S	S	*	*			trans	-75	89.6	165.6	-169.7	-96.2	0	0	0	106.4	A157 S161	A157-Y159 PolarHBondContact O-N 2.99Å; Y159-S161 PolarHBondContact O-N 3.09Å
160	S	41.6	Very low	53.9	Low	53 Å²	53	96.8 Å²	96.8	37%	0.371	54%	0.538	S	S	.	.			trans	20.2	76.9	167.9	61.2	0	0	0	0	115.1	P158 D162 K163	P158-S160 VanDerWaalsContact C-N 3.27Å; P158-S160 PolarHBondContact O-N 3.18Å; S160-D162 PolarHBondContact O-N 3.02Å; S160-K163 PolarHBondContact O-N 2.03Å
161	S	49.1	Very low	56.6	Low	68 Å²	68	91.7 Å²	91.7	48%	0.476	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-51.8	-21.8	172.3	175.6	0	0	0	0	112.3	Y159 K163 E164 H165	Y159-S161 PolarHBondContact O-N 3.09Å; S161-K163 VanDerWaalsContact C-N 3.25Å; S161-K163 PolarHBondContact O-N 2.97Å; S161-E164 PolarHBondContact O-N 2.93Å; S161-E164 VanDerWaalsContact O-N 3.1Å; S161-H165 PolarHBondContact O-CD2 3.38Å
162	D	51.8	Low	58.5	Low	137 Å²	137	86.4 Å²	86.4	73%	0.733	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-58.1	-29.7	177.7	-61.8	-32.7	0	0	0	114.5	S160	S160-D162 PolarHBondContact O-N 3.02Å
163	K	53	Low	60.7	Low	103 Å²	103	83.8 Å²	83.8	45%	0.448	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-85.1	-15.6	178.8	-73.5	-163.9	171.5	-163.5	0	114	E109 S160 S161 H165	E109-K163 IonicContact OE1-NZ 2.83Å; E109-K163 PolarHBondContact OE1-NZ 2.9Å; S160-K163 PolarHBondContact O-N 2.03Å; S161-K163 VanDerWaalsContact C-N 3.25Å; S161-K163 PolarHBondContact O-N 2.97Å; K163-H165 PolarHBondContact O-N 2.67Å
164	E	57.8	Low	62.3	Low	119 Å²	119	82 Å²	82	56%	0.556	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-83.2	-1.3	178.3	-71.2	-175.3	166	0	0	112.6	S161 S226	S161-E164 PolarHBondContact O-N 2.93Å; S161-E164 VanDerWaalsContact O-N 3.1Å; E164-S226 WeakPolarHBondContact O-CB 3.39Å; E164-S226 PolarHBondContact O-OG 3.05Å
165	H	69.7	Low	64.2	Low	87 Å²	87	77.3 Å²	77.3	40%	0.403	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-123.4	32.6	177.1	-56.8	-68.9	0	0	0	111.6	P122 V123 S161 K163	P122-H165 CarbonylContact C-O 3.51Å; P122-H165 WeakPolarHBondContact CA-O 3.36Å; V123-H165 WeakPolarHBondContact CB-O 3.38Å; V123-H165 PolarHBondContact N-O 3.26Å; S161-H165 PolarHBondContact O-CD2 3.38Å; K163-H165 PolarHBondContact O-N 2.67Å
166	M	76.5	Confident	66.1	Low	68 Å²	68	72.1 Å²	72.1	34%	0.335	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	134	175.5	-61.1	-167.7	85.8	0	0	110.8	F121 S226	F121-M166 WeakPolarHBondContact O-CA 3.41Å; M166-S226 PolarHBondContact O-OG 2.62Å
167	C	82.4	Confident	68	Low	0 Å²	0	66 Å²	66	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.3	164.2	-172.4	0	0	0	0	107.4	S120 F121 V123	S120-C167 CarbonylContact C-O 3.59Å; S120-C167 VanDerWaalsContact CA-O 3.29Å; S120-C167 WeakPolarHBondContact CA-O 3.41Å; F121-C167 HydrophobicContact CD1-CB 4.47Å; F121-C167 HydrophobicContact CD2-CB 3.9Å; F121-C167 HydrophobicContact CE1-CB 4.07Å; F121-C167 HydrophobicContact CE2-CB 3.44Å; F121-C167 VanDerWaalsContact CE2-CB 3.44Å; F121-C167 HydrophobicContact CG-CB 4.4Å; F121-C167 HydrophobicContact CZ-CB 3.53Å; F121-C167 WeakPolarHBondContact CZ-SG 3.4Å; F121-C167 PolarHBondContact N-O 3.28Å; F121-C167 PolarHBondContact O-N 2.99Å; V123-C167 HydrophobicContact CG2-CB 3.93Å
168	T	85.8	Confident	70.2	Confident	19 Å²	19	65.2 Å²	65.2	12%	0.117	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.7	176.6	-62.3	0	0	0	0	109.1	F104 T108 I118 S120 T224	F104-T168 HydrophobicContact CE1-CG2 3.76Å; F104-T168 WeakPolarHBondContact CE1-O 3.07Å; F104-T168 HydrophobicContact CZ-CG2 4.5Å; T108-T168 HydrophobicContact CG2-CG2 3.98Å; I118-T168 HydrophobicContact CG2-CG2 3.84Å; S120-T168 WeakPolarHBondContact OG-CG2 3.43Å; S120-T168 PolarHBondContact OG-OG1 3.41Å; T168-T224 PolarHBondContact N-O 3.1Å; T168-T224 PolarHBondContact O-N 2.8Å
169	V	88.3	Confident	72.3	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.6	-179.6	-172.4	0	0	0	0	108.6	I118 V119 F121 Y171 C222 I223 I234	I118-V169 WeakPolarHBondContact CA-O 3.21Å; V119-V169 PolarHBondContact N-O 3.05Å; V119-V169 PolarHBondContact O-N 2.9Å; F121-V169 HydrophobicContact CE1-CG2 3.74Å; F121-V169 HydrophobicContact CZ-CG2 4.35Å; V169-Y171 HydrophobicContact CB-CE2 4.05Å; V169-Y171 HydrophobicContact CG1-CD1 4.45Å; V169-Y171 HydrophobicContact CG1-CD2 4.04Å; V169-Y171 HydrophobicContact CG1-CE1 4.04Å; V169-Y171 HydrophobicContact CG1-CE2 3.58Å; V169-Y171 HydrophobicContact CG1-CG 4.45Å; V169-C222 CarbonylContact C-O 3.55Å; V169-C222 WeakPolarHBondContact CA-O 3.15Å; V169-I223 HydrophobicContact CG1-CG1 4.09Å; V169-I223 HydrophobicContact CG2-CG1 4.18Å; V169-I223 HydrophobicContact CG2-CG2 4.49Å; V169-I234 HydrophobicContact CG2-CD1 4Å; V169-I234 HydrophobicContact CG2-CG2 4.19Å
170	V	88.8	Confident	74.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.4	171.9	-179.2	0	0	0	0	107.8	F104 T108 W116 I118 M188 S221 C222	F104-V170 HydrophobicContact CE1-CG2 4.49Å; F104-V170 HydrophobicContact CE2-CG2 4.02Å; F104-V170 HydrophobicContact CZ-CB 4.48Å; F104-V170 HydrophobicContact CZ-CG2 3.67Å; T108-V170 HydrophobicContact CG2-CG2 3.41Å; T108-V170 VanDerWaalsContact CG2-CG2 3.41Å; W116-V170 HydrophobicContact CB-CG1 3.84Å; W116-V170 HydrophobicContact CD2-CG1 4.24Å; W116-V170 HydrophobicContact CE3-CG1 4.14Å; W116-V170 HydrophobicContact CG-CG1 4.15Å; I118-V170 HydrophobicContact CG1-CG2 4.25Å; I118-V170 HydrophobicContact CG2-CG2 4.43Å; V170-M188 HydrophobicContact CB-CE 4.21Å; V170-M188 HydrophobicContact CG1-CE 4.04Å; V170-M188 HydrophobicContact CG2-CE 3.88Å; V170-S221 CarbonylContact O-C 3.6Å; V170-S221 WeakPolarHBondContact O-CA 3.07Å; V170-S221 WeakPolarHBondContact O-CB 3.19Å; V170-C222 HydrophobicContact CB-CB 4.41Å; V170-C222 PolarHBondContact N-O 2.92Å; V170-C222 PolarHBondContact O-N 2.74Å
171	Y	86.5	Confident	76.6	Confident	18 Å²	18	58 Å²	58	7%	0.071	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	140.7	174.4	-61.3	-90.1	0	0	0	111.3	N117 V119 V169 L218 S220	N117-Y171 PolarHBondContact N-O 3.35Å; N117-Y171 PolarHBondContact O-N 3.33Å; V119-Y171 HydrophobicContact CB-CE2 4.39Å; V119-Y171 HydrophobicContact CG2-CD2 4.44Å; V119-Y171 HydrophobicContact CG2-CE2 4.13Å; V169-Y171 HydrophobicContact CB-CE2 4.05Å; V169-Y171 HydrophobicContact CG1-CD1 4.45Å; V169-Y171 HydrophobicContact CG1-CD2 4.04Å; V169-Y171 HydrophobicContact CG1-CE1 4.04Å; V169-Y171 HydrophobicContact CG1-CE2 3.58Å; V169-Y171 HydrophobicContact CG1-CG 4.45Å; Y171-L218 HydrophobicContact CD1-CB 3.92Å; Y171-L218 HydrophobicContact CD1-CD1 3.34Å; Y171-L218 HydrophobicContact CD1-CG 4.15Å; Y171-L218 HydrophobicContact CD2-CD1 3.92Å; Y171-L218 HydrophobicContact CE1-CD1 3.88Å; Y171-L218 HydrophobicContact CE2-CD1 4.4Å; Y171-L218 HydrophobicContact CG-CB 4.38Å; Y171-L218 HydrophobicContact CG-CD1 3.37Å; Y171-L218 HydrophobicContact CG-CD2 4.47Å; Y171-L218 HydrophobicContact CG-CG 4.24Å; Y171-S220 WeakPolarHBondContact CA-O 3.13Å
172	F	85.2	Confident	78.3	Confident	9 Å²	9	57.2 Å²	57.2	4%	0.039	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.4	173.2	-57.5	-76.5	0	0	0	110.6	W116 M176 M188 T219 S220 C222	W116-F172 AromaticContact CD1-CD1 3.9Å; W116-F172 HydrophobicContact CD2-CE1 4.36Å; W116-F172 AromaticContact CE2-CE1 3.95Å; W116-F172 HydrophobicContact CZ2-CE1 4.34Å; W116-F172 AromaticContact NE1-CD1 3.84Å; W116-F172 AromaticContact NE1-CE1 3.84Å; F172-M176 HydrophobicContact CB-CE 3.65Å; F172-M176 HydrophobicContact CD1-CE 3.97Å; F172-M176 HydrophobicContact CD2-CE 3.97Å; F172-M176 HydrophobicContact CD2-SD 4.38Å; F172-M176 HydrophobicContact CG-CE 3.59Å; F172-M188 HydrophobicContact CE1-SD 4.35Å; F172-M188 HydrophobicContact CZ-SD 3.83Å; F172-T219 PolarHBondContact O-N 3.33Å; F172-T219 PolarHBondContact O-OG1 2.99Å; F172-T219 VanDerWaalsContact O-OG1 3.05Å; F172-S220 VanDerWaalsContact CD2-OG 3.31Å; F172-S220 WeakPolarHBondContact CD2-OG 3.48Å; F172-S220 PolarHBondContact N-O 3.34Å; F172-C222 WeakPolarHBondContact CE2-SG 3.4Å; F172-C222 VanDerWaalsContact CZ-SG 3.53Å
173	D	79.1	Confident	80.1	Confident	54 Å²	54	54.6 Å²	54.6	29%	0.289	27%	0.274	S	S	.	.			trans	-81.7	-38	168.8	-64.3	-31.6	0	0	0	110	K203 L218 T219	D173-K203 WeakPolarHBondContact O-CD 3.41Å; D173-K203 WeakPolarHBondContact O-CE 3.21Å; D173-K203 PolarHBondContact O-NZ 3.44Å; D173-L218 VanDerWaalsContact OD1-CD2 3.26Å; D173-L218 WeakPolarHBondContact OD1-CD2 3.32Å; D173-T219 VanDerWaalsContact O-CG2 3.31Å; D173-T219 WeakPolarHBondContact O-CG2 3.43Å
174	D	81.8	Confident	81.9	Confident	117 Å²	117	51.5 Å²	51.5	63%	0.626	27%	0.265	S	S	*	.	S	Bend	trans	-69	142.9	-172	-72.6	-29.9	0	0	0	113.3	M176 T219	D174-M176 PolarHBondContact O-N 3.3Å; D174-T219 PolarHBondContact O-OG1 3.05Å
175	C	77.4	Confident	83.5	Confident	51 Å²	51	45.8 Å²	45.8	35%	0.345	24%	0.238	S	C	.	.			trans	-77.1	120.3	178.2	-90.2	0	0	0	0	112	C200	C175-C200 WeakPolarHBondContact CA-SG 3.3Å; C175-C200 HydrophobicContact CB-CB 4.07Å; C175-C200 WeakPolarHBondContact CB-SG 3.15Å; C175-C200 WeakPolarHBondContact SG-CA 3.42Å; C175-C200 WeakPolarHBondContact SG-CB 3.42Å; C175-C200 CovalentContact SG-SG 2.05Å; C175-C200 PolarHBondContact SG-SG 3.45Å
176	M	82.6	Confident	84.6	Confident	30 Å²	30	45.3 Å²	45.3	15%	0.148	24%	0.236	C	C	.	.			trans	-137.6	154.8	179.9	68.2	-174.9	73.6	0	0	111.6	F172 D174 Q180 C181 W195	F172-M176 HydrophobicContact CB-CE 3.65Å; F172-M176 HydrophobicContact CD1-CE 3.97Å; F172-M176 HydrophobicContact CD2-CE 3.97Å; F172-M176 HydrophobicContact CD2-SD 4.38Å; F172-M176 HydrophobicContact CG-CE 3.59Å; D174-M176 PolarHBondContact O-N 3.3Å; M176-Q180 HydrophobicContact CB-CB 3.95Å; M176-C181 HydrophobicContact CG-CB 4.13Å; M176-C181 VanDerWaalsContact SD-CA 3.52Å; M176-C181 HydrophobicContact SD-CB 3.87Å; M176-W195 PolarHBondContact O-NE1 3.13Å
177	S	78.9	Confident	85.3	Confident	52 Å²	52	46 Å²	46	36%	0.364	25%	0.247	S	C	.	.			trans	-68.7	158.3	171.2	63.7	0	0	0	0	111.4	H179 Q180 C181	S177-H179 PolarHBondContact O-N 3.11Å; S177-Q180 PolarHBondContact O-N 2.02Å; S177-Q180 VanDerWaalsContact O-N 3.07Å; S177-Q180 VanDerWaalsContact OG-CG 3.3Å; S177-Q180 WeakPolarHBondContact OG-CG 3.01Å; S177-Q180 PolarHBondContact OG-N 2.91Å; S177-Q180 PolarHBondContact OG-OE1 3.45Å; S177-C181 PolarHBondContact O-N 3Å
178	I	80.3	Confident	85.7	Confident	61 Å²	61	46.2 Å²	46.2	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-52.7	-39.5	174.2	-171.8	172.6	0	0	0	112.6	T92 C181 K182 Y193 W195	T92-I178 HydrophobicContact CG2-CD1 3.58Å; I178-C181 WeakPolarHBondContact O-CB 3.43Å; I178-C181 PolarHBondContact O-N 3.35Å; I178-K182 PolarHBondContact O-N 3.22Å; I178-Y193 HydrophobicContact CD1-CE2 4.34Å; I178-Y193 HydrophobicContact CG1-CE2 3.84Å; I178-W195 HydrophobicContact CB-CD2 3.93Å; I178-W195 HydrophobicContact CB-CE3 4.17Å; I178-W195 HydrophobicContact CB-CG 4.05Å; I178-W195 HydrophobicContact CD1-CE3 4.47Å; I178-W195 HydrophobicContact CG1-CB 4.14Å; I178-W195 HydrophobicContact CG1-CD2 4.39Å; I178-W195 HydrophobicContact CG1-CG 4.22Å
179	H	82.1	Confident	85.9	Confident	121 Å²	121	45.4 Å²	45.4	56%	0.56	24%	0.243	S	C	*	.	H	α-helix	trans	-67.1	-41.5	178.3	-179.4	-97.4	0	0	0	112.2	S177 C181 K182 I183	S177-H179 PolarHBondContact O-N 3.11Å; H179-C181 VanDerWaalsContact C-N 3.35Å; H179-K182 PolarHBondContact O-N 2Å; H179-I183 WeakPolarHBondContact CE1-CD1 3.19Å; H179-I183 WeakPolarHBondContact O-CG1 3.42Å; H179-I183 PolarHBondContact O-N 3.39Å
180	Q	85.5	Confident	86	Confident	104 Å²	104	45.4 Å²	45.4	49%	0.486	24%	0.244	S	C	.	.	H	α-helix	trans	-66.7	-37.7	174.4	-74.1	164.8	-43.2	0	0	111.8	M176 S177 S184	M176-Q180 HydrophobicContact CB-CB 3.95Å; S177-Q180 PolarHBondContact O-N 2.02Å; S177-Q180 VanDerWaalsContact O-N 3.07Å; S177-Q180 VanDerWaalsContact OG-CG 3.3Å; S177-Q180 WeakPolarHBondContact OG-CG 3.01Å; S177-Q180 PolarHBondContact OG-N 2.91Å; S177-Q180 PolarHBondContact OG-OE1 3.45Å; Q180-S184 VanDerWaalsContact O-CB 3.28Å; Q180-S184 WeakPolarHBondContact O-CB 3.03Å; Q180-S184 PolarHBondContact O-N 3.38Å; Q180-S184 PolarHBondContact O-OG 3.47Å
181	C	85.9	Confident	86	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-47.3	173.3	-179.6	0	0	0	0	111.1	M176 S177 I178 H179 S184 C185 S220	M176-C181 HydrophobicContact CG-CB 4.13Å; M176-C181 VanDerWaalsContact SD-CA 3.52Å; M176-C181 HydrophobicContact SD-CB 3.87Å; S177-C181 PolarHBondContact O-N 3Å; I178-C181 WeakPolarHBondContact O-CB 3.43Å; I178-C181 PolarHBondContact O-N 3.35Å; H179-C181 VanDerWaalsContact C-N 3.35Å; C181-S184 PolarHBondContact O-N 2.03Å; C181-C185 WeakPolarHBondContact O-CB 3.05Å; C181-C185 PolarHBondContact O-N 3.43Å; C181-C185 PolarHBondContact O-SG 3.35Å; C181-S220 WeakPolarHBondContact SG-CB 3.44Å
182	K	85.3	Confident	86	Confident	52 Å²	52	47 Å²	47	23%	0.226	25%	0.253	C	S	.	.	H	α-helix	trans	-56.5	-56.4	176.8	178.6	170.1	179.8	165	0	111.5	E94 L96 I178 H179 S184 C185 E186 Y193	E94-K182 IonicContact OE1-NZ 2.73Å; E94-K182 PolarHBondContact OE1-NZ 2.58Å; E94-K182 IonicContact OE2-NZ 3.97Å; L96-K182 HydrophobicContact CD2-CG 3.83Å; I178-K182 PolarHBondContact O-N 3.22Å; H179-K182 PolarHBondContact O-N 2Å; K182-S184 VanDerWaalsContact C-N 3.28Å; K182-S184 PolarHBondContact O-N 3.11Å; K182-C185 PolarHBondContact O-N 3.37Å; K182-E186 WeakPolarHBondContact CE-OE1 3.36Å; K182-E186 HydrophobicContact CG-CG 4.42Å; K182-E186 WeakPolarHBondContact O-CG 2.98Å; K182-E186 PolarHBondContact O-N 3.27Å; K182-Y193 HydrophobicContact CB-CD1 4.24Å; K182-Y193 HydrophobicContact CB-CE1 3.82Å; K182-Y193 HydrophobicContact CD-CE1 4.01Å; K182-Y193 HydrophobicContact CG-CD1 4.31Å; K182-Y193 HydrophobicContact CG-CE1 3.84Å
183	I	89.2	Confident	86.1	Confident	82 Å²	82	46.9 Å²	46.9	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-58.7	-41.1	180	-68.9	173.5	0	0	0	111.5	H179 E186 S187	H179-I183 WeakPolarHBondContact CE1-CD1 3.19Å; H179-I183 WeakPolarHBondContact O-CG1 3.42Å; H179-I183 PolarHBondContact O-N 3.39Å; I183-E186 PolarHBondContact O-N 3.45Å; I183-S187 WeakPolarHBondContact O-CB 3.42Å; I183-S187 PolarHBondContact O-N 2.8Å; I183-S187 PolarHBondContact O-OG 2.93Å
184	S	91	Very high	86.3	Confident	37 Å²	37	46.2 Å²	46.2	26%	0.259	25%	0.246	S	C	.	.	H	α-helix	trans	-62.8	-49	179.6	-58	0	0	0	0	110.4	Q180 C181 K182 E186 S187 M188	Q180-S184 VanDerWaalsContact O-CB 3.28Å; Q180-S184 WeakPolarHBondContact O-CB 3.03Å; Q180-S184 PolarHBondContact O-N 3.38Å; Q180-S184 PolarHBondContact O-OG 3.47Å; C181-S184 PolarHBondContact O-N 2.03Å; K182-S184 VanDerWaalsContact C-N 3.28Å; K182-S184 PolarHBondContact O-N 3.11Å; S184-E186 PolarHBondContact O-N 3.43Å; S184-S187 PolarHBondContact O-N 3.09Å; S184-S187 PolarHBondContact O-OG 3.08Å; S184-M188 VanDerWaalsContact O-CG 3.27Å; S184-M188 WeakPolarHBondContact O-CG 3.08Å; S184-M188 PolarHBondContact O-N 2.94Å; S184-M188 VanDerWaalsContact O-N 3.1Å
185	C	91.1	Very high	86.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.4	-37.1	178.1	-64.9	0	0	0	0	113.2	L96 C181 K182 M188 G189 A190 Y193 C222	L96-C185 HydrophobicContact CD1-CB 3.62Å; C181-C185 WeakPolarHBondContact O-CB 3.05Å; C181-C185 PolarHBondContact O-N 3.43Å; C181-C185 PolarHBondContact O-SG 3.35Å; K182-C185 PolarHBondContact O-N 3.37Å; C185-M188 PolarHBondContact O-N 3.02Å; C185-G189 PolarHBondContact O-N 3.06Å; C185-A190 HydrophobicContact CB-CB 4.03Å; C185-A190 VanDerWaalsContact O-CB 3.29Å; C185-A190 WeakPolarHBondContact O-CB 3.38Å; C185-A190 PolarHBondContact O-N 3.46Å; C185-Y193 VanDerWaalsContact SG-CB 3.59Å; C185-C222 WeakPolarHBondContact CA-SG 3.4Å; C185-C222 HydrophobicContact CB-CB 3.81Å; C185-C222 WeakPolarHBondContact CB-SG 3.45Å; C185-C222 WeakPolarHBondContact SG-CA 3.43Å; C185-C222 WeakPolarHBondContact SG-CB 3.36Å; C185-C222 CovalentContact SG-SG 2.03Å; C185-C222 PolarHBondContact SG-SG 3.45Å
186	E	92.4	Very high	86.7	Confident	77 Å²	77	40.3 Å²	40.3	36%	0.36	21%	0.208	S	C	.	.	H	α-helix	trans	-61.2	-46.3	172.9	-74	174.1	168.8	0	0	110.9	L96 K182 I183 S184 M188 G189	L96-E186 HydrophobicContact CB-CG 4.28Å; L96-E186 HydrophobicContact CD1-CG 3.89Å; L96-E186 HydrophobicContact CD2-CG 3.53Å; L96-E186 HydrophobicContact CG-CG 4.09Å; K182-E186 WeakPolarHBondContact CE-OE1 3.36Å; K182-E186 HydrophobicContact CG-CG 4.42Å; K182-E186 WeakPolarHBondContact O-CG 2.98Å; K182-E186 PolarHBondContact O-N 3.27Å; I183-E186 PolarHBondContact O-N 3.45Å; S184-E186 PolarHBondContact O-N 3.43Å; E186-M188 PolarHBondContact O-N 2Å; E186-G189 PolarHBondContact O-N 2.98Å
187	S	91.8	Very high	86.1	Confident	82 Å²	82	42 Å²	42	57%	0.573	22%	0.215	S	C	*	.	H	α-helix	trans	-64.2	-24.3	178.8	77.3	0	0	0	0	113.3	L103 I183 S184 G189	L103-S187 WeakPolarHBondContact CD2-O 3.29Å; I183-S187 WeakPolarHBondContact O-CB 3.42Å; I183-S187 PolarHBondContact O-N 2.8Å; I183-S187 PolarHBondContact O-OG 2.93Å; S184-S187 PolarHBondContact O-N 3.09Å; S184-S187 PolarHBondContact O-OG 3.08Å; S187-G189 VanDerWaalsContact C-N 3.33Å
188	M	90.8	Very high	85.5	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.025	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-8.4	174.6	-66.3	179.3	70.9	0	0	112.9	F104 L107 W116 V170 F172 S184 C185 E186	F104-M188 WeakPolarHBondContact CA-O 3.38Å; F104-M188 VanDerWaalsContact CB-O 3.28Å; F104-M188 WeakPolarHBondContact CB-O 3.41Å; F104-M188 HydrophobicContact CD2-CB 4.02Å; F104-M188 HydrophobicContact CE2-CB 4.46Å; F104-M188 HydrophobicContact CE2-CE 4.26Å; F104-M188 PolarHBondContact N-O 3.36Å; F104-M188 VanDerWaalsContact N-O 3.11Å; L107-M188 HydrophobicContact CD1-CB 4.2Å; L107-M188 HydrophobicContact CD1-CG 4.25Å; W116-M188 HydrophobicContact CE3-CE 3.92Å; W116-M188 HydrophobicContact CH2-CE 4.15Å; W116-M188 HydrophobicContact CH2-SD 4.21Å; W116-M188 HydrophobicContact CZ3-CE 3.49Å; W116-M188 VanDerWaalsContact CZ3-CE 3.49Å; W116-M188 HydrophobicContact CZ3-SD 4.14Å; V170-M188 HydrophobicContact CB-CE 4.21Å; V170-M188 HydrophobicContact CG1-CE 4.04Å; V170-M188 HydrophobicContact CG2-CE 3.88Å; F172-M188 HydrophobicContact CE1-SD 4.35Å; F172-M188 HydrophobicContact CZ-SD 3.83Å; S184-M188 VanDerWaalsContact O-CG 3.27Å; S184-M188 WeakPolarHBondContact O-CG 3.08Å; S184-M188 PolarHBondContact O-N 2.94Å; S184-M188 VanDerWaalsContact O-N 3.1Å; C185-M188 PolarHBondContact O-N 3.02Å; E186-M188 PolarHBondContact O-N 2Å
189	G	90.1	Very high	85	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.01	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	21.8	-175.1	0	0	0	0	0	113.9	I100 C185 E186 S187	I100-G189 CarbonylContact C-O 3.42Å; I100-G189 VanDerWaalsContact C-O 3.29Å; I100-G189 PolarHBondContact N-O 3.49Å; I100-G189 VanDerWaalsContact N-O 3.09Å; C185-G189 PolarHBondContact O-N 3.06Å; E186-G189 PolarHBondContact O-N 2.98Å; S187-G189 VanDerWaalsContact C-N 3.33Å
190	A	90.5	Very high	84.5	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.008	18%	0.181	C	C	.	.			trans	-68.4	154.6	180	0	0	0	0	0	112.4	L96 F104 C185 C222 T224	L96-A190 HydrophobicContact CD1-CB 4.12Å; L96-A190 WeakPolarHBondContact CD1-O 3.01Å; F104-A190 HydrophobicContact CD2-CB 3.77Å; F104-A190 HydrophobicContact CE2-CB 3.74Å; C185-A190 HydrophobicContact CB-CB 4.03Å; C185-A190 VanDerWaalsContact O-CB 3.29Å; C185-A190 WeakPolarHBondContact O-CB 3.38Å; C185-A190 PolarHBondContact O-N 3.46Å; A190-C222 HydrophobicContact CB-CB 3.84Å; A190-T224 WeakPolarHBondContact CA-OG1 3.41Å
191	S	88.4	Confident	83.4	Confident	15 Å²	15	38.3 Å²	38.3	11%	0.105	19%	0.188	C	C	.	.	S	Bend	trans	-87.9	-29.3	174.3	64	0	0	0	0	113.8	L96 I223 T224	L96-S191 PolarHBondContact N-O 3.44Å; S191-I223 PolarHBondContact N-O 3.01Å; S191-I223 PolarHBondContact OG-O 3.15Å; S191-T224 PolarHBondContact N-OG1 3.23Å
192	K	86.5	Confident	82.4	Confident	37 Å²	37	41.8 Å²	41.8	16%	0.161	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	158.1	179.7	-57.5	179.1	-174.7	176.6	0	110.5	E94 E95 I223 L229	E94-K192 WeakPolarHBondContact O-CA 3.33Å; E95-K192 HydrophobicContact CB-CG 4.38Å; E95-K192 HydrophobicContact CG-CG 4.29Å; E95-K192 VanDerWaalsContact OE1-CE 3.24Å; E95-K192 WeakPolarHBondContact OE1-CE 3.11Å; K192-I223 HydrophobicContact CB-CB 4.37Å; K192-I223 PolarHBondContact N-O 3.46Å; K192-I223 PolarHBondContact O-N 3.01Å; K192-L229 PolarHBondContact NZ-O 3.33Å
193	Y	87.4	Confident	81.5	Confident	5 Å²	5	42 Å²	42	2%	0.02	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	154.6	166.1	78.7	-90.3	0	0	0	111.4	V93 E94 L96 I178 K182 C185 W195 S221	V93-Y193 WeakPolarHBondContact CA-O 3.04Å; E94-Y193 HydrophobicContact CB-CD1 4.17Å; E94-Y193 HydrophobicContact CB-CE1 3.46Å; E94-Y193 VanDerWaalsContact CB-CE1 3.46Å; E94-Y193 HydrophobicContact CG-CE1 3.9Å; E94-Y193 PolarHBondContact N-O 3.29Å; E94-Y193 PolarHBondContact O-N 3.03Å; E94-Y193 WeakPolarHBondContact OE2-CE1 3.47Å; E94-Y193 PolarHBondContact OE2-OH 3.38Å; L96-Y193 HydrophobicContact CD2-CD1 3.52Å; L96-Y193 HydrophobicContact CD2-CE1 3.95Å; L96-Y193 HydrophobicContact CG-CD1 4.12Å; I178-Y193 HydrophobicContact CD1-CE2 4.34Å; I178-Y193 HydrophobicContact CG1-CE2 3.84Å; K182-Y193 HydrophobicContact CB-CD1 4.24Å; K182-Y193 HydrophobicContact CB-CE1 3.82Å; K182-Y193 HydrophobicContact CD-CE1 4.01Å; K182-Y193 HydrophobicContact CG-CD1 4.31Å; K182-Y193 HydrophobicContact CG-CE1 3.84Å; C185-Y193 VanDerWaalsContact SG-CB 3.59Å; Y193-W195 HydrophobicContact CD2-CB 4.41Å; Y193-W195 HydrophobicContact CE2-CB 4.32Å; Y193-S221 WeakPolarHBondContact CA-O 3.33Å
194	R	84	Confident	80.3	Confident	41 Å²	41	44.4 Å²	44.4	16%	0.155	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.2	171.9	-176.7	175.2	-170.2	-154.8	-1.2	109.3	T88 S91 T92 V93 F196 S220 S221 I223	T88-R194 PolarHBondContact O-NH2 3.28Å; S91-R194 VanDerWaalsContact CB-NE 3.32Å; S91-R194 PolarHBondContact OG-NE 3.02Å; S91-R194 PolarHBondContact OG-NH2 3.03Å; S91-R194 VanDerWaalsContact OG-NH2 3.16Å; T92-R194 CarbonylContact O-C 3.55Å; T92-R194 VanDerWaalsContact O-CA 3.29Å; T92-R194 WeakPolarHBondContact O-CA 2.95Å; V93-R194 HydrophobicContact CG2-CB 4.17Å; V93-R194 HydrophobicContact CG2-CG 3.82Å; R194-F196 HydrophobicContact CG-CE1 4.15Å; R194-F196 HydrophobicContact CG-CZ 4.12Å; R194-S220 CarbonylContact O-C 3.45Å; R194-S220 WeakPolarHBondContact O-CA 3.23Å; R194-S220 WeakPolarHBondContact O-CB 3.49Å; R194-S221 PolarHBondContact N-O 3.47Å; R194-S221 PolarHBondContact O-N 2.99Å; R194-I223 HydrophobicContact CB-CD1 4.47Å
195	W	83	Confident	78.7	Confident	42 Å²	42	47.8 Å²	47.8	16%	0.159	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.3	178.7	-178.1	82.6	0	0	0	110.6	S91 T92 M176 I178 Y193 H197	S91-W195 CarbonylContact C-O 3.29Å; S91-W195 WeakPolarHBondContact CA-O 3Å; S91-W195 WeakPolarHBondContact CB-O 3.32Å; T92-W195 PolarHBondContact N-O 2.92Å; T92-W195 PolarHBondContact O-N 3.47Å; M176-W195 PolarHBondContact O-NE1 3.13Å; I178-W195 HydrophobicContact CB-CD2 3.93Å; I178-W195 HydrophobicContact CB-CE3 4.17Å; I178-W195 HydrophobicContact CB-CG 4.05Å; I178-W195 HydrophobicContact CD1-CE3 4.47Å; I178-W195 HydrophobicContact CG1-CB 4.14Å; I178-W195 HydrophobicContact CG1-CD2 4.39Å; I178-W195 HydrophobicContact CG1-CG 4.22Å; Y193-W195 HydrophobicContact CD2-CB 4.41Å; Y193-W195 HydrophobicContact CE2-CB 4.32Å; W195-H197 VanDerWaalsContact CZ3-CA 3.49Å; W195-H197 HydrophobicContact CZ3-CB 4.06Å; W195-H197 AromaticContact CZ3-CE1 3.9Å; W195-H197 AromaticContact CZ3-CG 3.68Å; W195-H197 AromaticContact CZ3-ND1 3.49Å; W195-H197 WeakPolarHBondContact CZ3-ND1 3.27Å
196	F	83.1	Confident	77.1	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.009	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122	-174.3	-60.9	-72.4	0	0	0	111.5	T88 R194 N198 A199 L218 T219	T88-F196 VanDerWaalsContact CA-CD1 3.46Å; T88-F196 HydrophobicContact CG2-CD1 3.98Å; T88-F196 HydrophobicContact CG2-CE1 3.68Å; T88-F196 HydrophobicContact CG2-CG 4.5Å; T88-F196 HydrophobicContact CG2-CZ 4.01Å; R194-F196 HydrophobicContact CG-CE1 4.15Å; R194-F196 HydrophobicContact CG-CZ 4.12Å; F196-N198 VanDerWaalsContact C-N 3.3Å; F196-N198 PolarHBondContact O-N 3.31Å; F196-A199 HydrophobicContact CB-CB 3.5Å; F196-A199 VanDerWaalsContact CB-CB 3.5Å; F196-A199 HydrophobicContact CG-CB 4.36Å; F196-L218 WeakPolarHBondContact CD2-O 3.35Å; F196-T219 WeakPolarHBondContact CD2-O 2.98Å; F196-T219 PolarHBondContact N-O 3.39Å
197	H	70.7	Confident	75.2	Confident	65 Å²	65	52.7 Å²	52.7	30%	0.301	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-34.6	-170.6	-70.8	-98.9	0	0	0	113.5	K90 T92 W195	K90-H197 HydrophobicContact CB-CB 4.42Å; K90-H197 HydrophobicContact CD-CB 4.36Å; K90-H197 HydrophobicContact CG-CB 4.49Å; K90-H197 PolarHBondContact O-CD2 2Å; K90-H197 PolarHBondContact O-N 3.14Å; T92-H197 PolarHBondContact N-NE2 2.99Å; T92-H197 PolarHBondContact OG1-CE1 3.23Å; T92-H197 VanDerWaalsContact OG1-CE1 3.28Å; T92-H197 PolarHBondContact OG1-NE2 3.49Å; W195-H197 VanDerWaalsContact CZ3-CA 3.49Å; W195-H197 HydrophobicContact CZ3-CB 4.06Å; W195-H197 AromaticContact CZ3-CE1 3.9Å; W195-H197 AromaticContact CZ3-CG 3.68Å; W195-H197 AromaticContact CZ3-ND1 3.49Å; W195-H197 WeakPolarHBondContact CZ3-ND1 3.27Å
198	N	65.9	Low	73	Confident	67 Å²	67	52 Å²	52	36%	0.358	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-6.8	-171.9	-59	-23.9	0	0	0	112.7	F196 C200 W201 H202	F196-N198 VanDerWaalsContact C-N 3.3Å; F196-N198 PolarHBondContact O-N 3.31Å; N198-C200 VanDerWaalsContact C-N 3.35Å; N198-C200 PolarHBondContact O-N 3.48Å; N198-W201 PolarHBondContact O-N 2.92Å; N198-H202 PolarHBondContact O-N 3.39Å; N198-H202 VanDerWaalsContact O-N 3.12Å; N198-H202 PolarHBondContact O-ND1 3.49Å
199	A	71.2	Confident	70.8	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.1	-39.5	-172	0	0	0	0	0	112.8	F196 H202 K203 L218	F196-A199 HydrophobicContact CB-CB 3.5Å; F196-A199 VanDerWaalsContact CB-CB 3.5Å; F196-A199 HydrophobicContact CG-CB 4.36Å; A199-H202 PolarHBondContact O-N 3.1Å; A199-K203 PolarHBondContact O-N 3.46Å; A199-L218 WeakPolarHBondContact CB-O 2.98Å
200	C	70.4	Confident	68.4	Low	24 Å²	24	68.1 Å²	68.1	16%	0.162	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-40.6	178.5	-89.3	0	0	0	0	114.4	C175 N198 H202 K203 H204 T219	C175-C200 WeakPolarHBondContact CA-SG 3.3Å; C175-C200 HydrophobicContact CB-CB 4.07Å; C175-C200 WeakPolarHBondContact CB-SG 3.15Å; C175-C200 WeakPolarHBondContact SG-CA 3.42Å; C175-C200 WeakPolarHBondContact SG-CB 3.42Å; C175-C200 CovalentContact SG-SG 2.05Å; C175-C200 PolarHBondContact SG-SG 3.45Å; N198-C200 VanDerWaalsContact C-N 3.35Å; N198-C200 PolarHBondContact O-N 3.48Å; C200-H202 VanDerWaalsContact C-N 3.34Å; C200-K203 PolarHBondContact O-N 3.17Å; C200-H204 PolarHBondContact O-CD2 3.24Å; C200-H204 VanDerWaalsContact O-CD2 3.23Å; C200-H204 PolarHBondContact O-N 3.21Å; C200-H204 VanDerWaalsContact O-N 3.11Å; C200-T219 VanDerWaalsContact SG-CG2 3.56Å
201	W	62.9	Low	66.6	Low	169 Å²	169	73.5 Å²	73.5	64%	0.64	38%	0.38	S	S	*	.	H	α-helix	trans	-58	-49.4	172.8	174.9	-92.1	0	0	0	110.6	N198 K203 H204 H205	N198-W201 PolarHBondContact O-N 2.92Å; W201-K203 PolarHBondContact O-N 3.06Å; W201-H204 PolarHBondContact O-N 3.42Å; W201-H205 AromaticContact CD2-CD2 3.63Å; W201-H205 AromaticContact CD2-NE2 3.75Å; W201-H205 AromaticContact CE2-CD2 3.37Å; W201-H205 AromaticContact CE2-NE2 3.27Å; W201-H205 VanDerWaalsContact CE2-NE2 3.27Å; W201-H205 AromaticContact CE3-NE2 3.92Å; W201-H205 AromaticContact CH2-NE2 3.27Å; W201-H205 VanDerWaalsContact CH2-NE2 3.27Å; W201-H205 WeakPolarHBondContact CH2-NE2 3.48Å; W201-H205 AromaticContact CZ2-CD2 3.7Å; W201-H205 AromaticContact CZ2-CE1 3.75Å; W201-H205 AromaticContact CZ2-NE2 3.04Å; W201-H205 WeakPolarHBondContact CZ2-NE2 3.47Å; W201-H205 AromaticContact CZ3-NE2 3.7Å; W201-H205 AromaticContact NE1-CD2 3.59Å; W201-H205 AromaticContact NE1-NE2 3.9Å; W201-H205 PolarHBondContact O-CD2 3.45Å; W201-H205 VanDerWaalsContact O-CD2 3.3Å; W201-H205 PolarHBondContact O-N 3.13Å; W201-H205 VanDerWaalsContact O-N 3.07Å
202	H	65.2	Low	63.9	Low	74 Å²	74	84 Å²	84	34%	0.343	42%	0.417	S	S	.	.	H	α-helix	trans	-61.3	-42.2	178.3	-71.5	82.7	0	0	0	112.2	P87 N198 A199 C200 H204 H205 Q206 P217	P87-H202 HydrophobicContact CB-CB 4.39Å; P87-H202 HydrophobicContact CG-CB 4.3Å; N198-H202 PolarHBondContact O-N 3.39Å; N198-H202 VanDerWaalsContact O-N 3.12Å; N198-H202 PolarHBondContact O-ND1 3.49Å; A199-H202 PolarHBondContact O-N 3.1Å; C200-H202 VanDerWaalsContact C-N 3.34Å; H202-H204 PolarHBondContact O-N 3.39Å; H202-H205 PolarHBondContact O-N 3.37Å; H202-Q206 VanDerWaalsContact O-CB 3.27Å; H202-Q206 WeakPolarHBondContact O-CB 3.33Å; H202-Q206 PolarHBondContact O-N 3.31Å; H202-P217 HydrophobicContact CB-CG 4.16Å
203	K	66.2	Low	61.7	Low	55 Å²	55	87.9 Å²	87.9	24%	0.239	45%	0.446	C	S	.	.	H	α-helix	trans	-59.2	-45	177.9	-166.1	-177.2	-178	-172.6	0	112.4	D173 A199 C200 W201 A207 P217 T219	D173-K203 WeakPolarHBondContact O-CD 3.41Å; D173-K203 WeakPolarHBondContact O-CE 3.21Å; D173-K203 PolarHBondContact O-NZ 3.44Å; A199-K203 PolarHBondContact O-N 3.46Å; C200-K203 PolarHBondContact O-N 3.17Å; W201-K203 PolarHBondContact O-N 3.06Å; K203-A207 PolarHBondContact O-N 3.47Å; K203-P217 HydrophobicContact CB-CG 4.08Å; K203-T219 HydrophobicContact CD-CG2 4.13Å
204	H	63	Low	59.5	Low	133 Å²	133	90.4 Å²	90.4	62%	0.616	47%	0.468	S	S	*	.	H	α-helix	trans	-70.9	-35.5	179.9	-79.2	-67.7	0	0	0	113.2	C200 W201 H202	C200-H204 PolarHBondContact O-CD2 3.24Å; C200-H204 VanDerWaalsContact O-CD2 3.23Å; C200-H204 PolarHBondContact O-N 3.21Å; C200-H204 VanDerWaalsContact O-N 3.11Å; W201-H204 PolarHBondContact O-N 3.42Å; H202-H204 PolarHBondContact O-N 3.39Å
205	H	58.7	Low	57.9	Low	108 Å²	108	92.5 Å²	92.5	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-71.4	-36.6	176.3	-86.3	-86.2	0	0	0	112.6	W201 H202 G208	W201-H205 AromaticContact CD2-CD2 3.63Å; W201-H205 AromaticContact CD2-NE2 3.75Å; W201-H205 AromaticContact CE2-CD2 3.37Å; W201-H205 AromaticContact CE2-NE2 3.27Å; W201-H205 VanDerWaalsContact CE2-NE2 3.27Å; W201-H205 AromaticContact CE3-NE2 3.92Å; W201-H205 AromaticContact CH2-NE2 3.27Å; W201-H205 VanDerWaalsContact CH2-NE2 3.27Å; W201-H205 WeakPolarHBondContact CH2-NE2 3.48Å; W201-H205 AromaticContact CZ2-CD2 3.7Å; W201-H205 AromaticContact CZ2-CE1 3.75Å; W201-H205 AromaticContact CZ2-NE2 3.04Å; W201-H205 WeakPolarHBondContact CZ2-NE2 3.47Å; W201-H205 AromaticContact CZ3-NE2 3.7Å; W201-H205 AromaticContact NE1-CD2 3.59Å; W201-H205 AromaticContact NE1-NE2 3.9Å; W201-H205 PolarHBondContact O-CD2 3.45Å; W201-H205 VanDerWaalsContact O-CD2 3.3Å; W201-H205 PolarHBondContact O-N 3.13Å; W201-H205 VanDerWaalsContact O-N 3.07Å; H202-H205 PolarHBondContact O-N 3.37Å; H205-G208 PolarHBondContact O-N 3.39Å
206	Q	56	Low	56.3	Low	93 Å²	93	92.9 Å²	92.9	44%	0.435	51%	0.506	S	S	.	.	H	α-helix	trans	-74.5	-25.4	179.6	-164.6	163.3	31	0	0	113.3	H202 G208	H202-Q206 VanDerWaalsContact O-CB 3.27Å; H202-Q206 WeakPolarHBondContact O-CB 3.33Å; H202-Q206 PolarHBondContact O-N 3.31Å; Q206-G208 PolarHBondContact O-N 3.02Å
207	A	52.5	Low	55.1	Low	87 Å²	87	93.5 Å²	93.5	72%	0.719	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.2	176.5	0	0	0	0	0	114.2	K203	K203-A207 PolarHBondContact O-N 3.47Å
208	G	46.9	Very low	55	Low	69 Å²	69	90.9 Å²	90.9	71%	0.711	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-12.6	179.6	0	0	0	0	0	115.2	H205 Q206	H205-G208 PolarHBondContact O-N 3.39Å; Q206-G208 PolarHBondContact O-N 3.02Å
209	E	44.6	Very low	55.2	Low	161 Å²	161	87.7 Å²	87.7	75%	0.752	48%	0.482	S	S	*	.	S	Bend	trans	-115.8	142.9	179.3	-66	-177.2	147.3	0	0	109.5
210	H	39.5	Very low	55.6	Low	182 Å²	182	87.7 Å²	87.7	84%	0.843	48%	0.482	S	S	*	.			trans	-28.6	150.1	-171.2	-67.8	-84.1	0	0	0	119.7	W212	H210-W212 PolarHBondContact O-N 3.11Å
211	P	52.7	Low	56.2	Low	115 Å²	115	86.7 Å²	86.7	75%	0.747	48%	0.475	S	S	*	.			trans	-86.3	98.6	-169.8	34.8	-32.3	0	0	0	112.7
212	W	32	Very low	57.3	Low	235 Å²	235	78.7 Å²	78.7	89%	0.89	44%	0.444	S	S	*	.			trans	-141.9	154.7	160.1	-79.9	95.8	0	0	0	109.3	H210 A214	H210-W212 PolarHBondContact O-N 3.11Å; W212-A214 VanDerWaalsContact C-N 3.33Å; W212-A214 PolarHBondContact O-N 3.45Å
213	P	39.3	Very low	58.3	Low	119 Å²	119	75.4 Å²	75.4	77%	0.773	43%	0.43	S	S	*	.			trans	-85	71.5	-146.9	36.5	-37.3	0	0	0	111.1	A215	P213-A215 PolarHBondContact O-N 2.94Å
214	A	41.7	Very low	59	Low	57 Å²	57	73.5 Å²	73.5	47%	0.471	42%	0.422	S	S	.	.			trans	-70.2	116.5	149.9	0	0	0	0	0	105.5	W212 A216	W212-A214 VanDerWaalsContact C-N 3.33Å; W212-A214 PolarHBondContact O-N 3.45Å; A214-A216 PolarHBondContact O-N 3.47Å
215	A	49.4	Very low	59.3	Low	86 Å²	86	68.1 Å²	68.1	71%	0.711	40%	0.4	S	S	*	.			trans	-44.5	119.3	171.9	0	0	0	0	0	107.9	P213	P213-A215 PolarHBondContact O-N 2.94Å
216	A	50.1	Low	59.3	Low	50 Å²	50	66.6 Å²	66.6	41%	0.413	40%	0.401	S	S	.	.			trans	-53.5	131.2	-177.7	0	0	0	0	0	108	A214 L218	A214-A216 PolarHBondContact O-N 3.47Å; A216-L218 PolarHBondContact O-N 2.99Å
217	P	57.5	Low	59	Low	15 Å²	15	63.3 Å²	63.3	10%	0.097	39%	0.392	C	S	.	.			trans	-63.9	113.2	-178.2	22.9	-30.3	0	0	0	108.5	P87 H202 K203 T219	P87-P217 HydrophobicContact CB-CB 4.05Å; P87-P217 HydrophobicContact CG-CB 4.29Å; H202-P217 HydrophobicContact CB-CG 4.16Å; K203-P217 HydrophobicContact CB-CG 4.08Å; P217-T219 PolarHBondContact O-N 3.35Å
218	L	68.8	Low	58.8	Low	9 Å²	9	62.8 Å²	62.8	5%	0.047	40%	0.395	C	S	.	.			trans	-57	130.2	175.7	-58	169	0	0	0	108.3	Y171 D173 F196 A199 A216 P237	Y171-L218 HydrophobicContact CD1-CB 3.92Å; Y171-L218 HydrophobicContact CD1-CD1 3.34Å; Y171-L218 HydrophobicContact CD1-CG 4.15Å; Y171-L218 HydrophobicContact CD2-CD1 3.92Å; Y171-L218 HydrophobicContact CE1-CD1 3.88Å; Y171-L218 HydrophobicContact CE2-CD1 4.4Å; Y171-L218 HydrophobicContact CG-CB 4.38Å; Y171-L218 HydrophobicContact CG-CD1 3.37Å; Y171-L218 HydrophobicContact CG-CD2 4.47Å; Y171-L218 HydrophobicContact CG-CG 4.24Å; D173-L218 VanDerWaalsContact OD1-CD2 3.26Å; D173-L218 WeakPolarHBondContact OD1-CD2 3.32Å; F196-L218 WeakPolarHBondContact CD2-O 3.35Å; A199-L218 WeakPolarHBondContact CB-O 2.98Å; A216-L218 PolarHBondContact O-N 2.99Å; L218-P237 HydrophobicContact CD1-CB 3.93Å; L218-P237 HydrophobicContact CD1-CG 3.82Å; L218-P237 HydrophobicContact CG-CG 4.3Å
219	T	71.4	Confident	58.8	Low	1 Å²	1	60.7 Å²	60.7	1%	0.006	37%	0.368	C	S	.	.			trans	-89.8	-27.4	-167.2	58.9	0	0	0	0	112.3	F172 D173 D174 F196 C200 K203 P217	F172-T219 PolarHBondContact O-N 3.33Å; F172-T219 PolarHBondContact O-OG1 2.99Å; F172-T219 VanDerWaalsContact O-OG1 3.05Å; D173-T219 VanDerWaalsContact O-CG2 3.31Å; D173-T219 WeakPolarHBondContact O-CG2 3.43Å; D174-T219 PolarHBondContact O-OG1 3.05Å; F196-T219 WeakPolarHBondContact CD2-O 2.98Å; F196-T219 PolarHBondContact N-O 3.39Å; C200-T219 VanDerWaalsContact SG-CG2 3.56Å; K203-T219 HydrophobicContact CD-CG2 4.13Å; P217-T219 PolarHBondContact O-N 3.35Å
220	S	78.4	Confident	58.7	Low	0 Å²	0	56.6 Å²	56.6	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	167.6	176.7	50.9	0	0	0	0	111.7	Y171 F172 C181 R194	Y171-S220 WeakPolarHBondContact CA-O 3.13Å; F172-S220 VanDerWaalsContact CD2-OG 3.31Å; F172-S220 WeakPolarHBondContact CD2-OG 3.48Å; F172-S220 PolarHBondContact N-O 3.34Å; C181-S220 WeakPolarHBondContact SG-CB 3.44Å; R194-S220 CarbonylContact O-C 3.45Å; R194-S220 WeakPolarHBondContact O-CA 3.23Å; R194-S220 WeakPolarHBondContact O-CB 3.49Å
221	S	82.4	Confident	58.9	Low	3 Å²	3	49.2 Å²	49.2	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	145.1	175.5	64.7	0	0	0	0	114.1	V170 Y193 R194	V170-S221 CarbonylContact O-C 3.6Å; V170-S221 WeakPolarHBondContact O-CA 3.07Å; V170-S221 WeakPolarHBondContact O-CB 3.19Å; Y193-S221 WeakPolarHBondContact CA-O 3.33Å; R194-S221 PolarHBondContact N-O 3.47Å; R194-S221 PolarHBondContact O-N 2.99Å
222	C	86.2	Confident	58.5	Low	0 Å²	0	52.7 Å²	52.7	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140	166.3	-51.9	0	0	0	0	110.3	F104 V169 V170 F172 C185 A190	F104-C222 HydrophobicContact CE2-CB 3.85Å; F104-C222 HydrophobicContact CZ-CB 4.37Å; V169-C222 CarbonylContact C-O 3.55Å; V169-C222 WeakPolarHBondContact CA-O 3.15Å; V170-C222 HydrophobicContact CB-CB 4.41Å; V170-C222 PolarHBondContact N-O 2.92Å; V170-C222 PolarHBondContact O-N 2.74Å; F172-C222 WeakPolarHBondContact CE2-SG 3.4Å; F172-C222 VanDerWaalsContact CZ-SG 3.53Å; C185-C222 WeakPolarHBondContact CA-SG 3.4Å; C185-C222 HydrophobicContact CB-CB 3.81Å; C185-C222 WeakPolarHBondContact CB-SG 3.45Å; C185-C222 WeakPolarHBondContact SG-CA 3.43Å; C185-C222 WeakPolarHBondContact SG-CB 3.36Å; C185-C222 CovalentContact SG-SG 2.03Å; C185-C222 PolarHBondContact SG-SG 3.45Å; A190-C222 HydrophobicContact CB-CB 3.84Å
223	I	86.3	Confident	59	Low	6 Å²	6	45.7 Å²	45.7	3%	0.031	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	134.5	-175.6	-58.6	151.6	0	0	0	108.9	V169 S191 K192 R194 I234	V169-I223 HydrophobicContact CG1-CG1 4.09Å; V169-I223 HydrophobicContact CG2-CG1 4.18Å; V169-I223 HydrophobicContact CG2-CG2 4.49Å; S191-I223 PolarHBondContact N-O 3.01Å; S191-I223 PolarHBondContact OG-O 3.15Å; K192-I223 HydrophobicContact CB-CB 4.37Å; K192-I223 PolarHBondContact N-O 3.46Å; K192-I223 PolarHBondContact O-N 3.01Å; R194-I223 HydrophobicContact CB-CD1 4.47Å; I223-I234 HydrophobicContact CB-CD1 4.41Å; I223-I234 HydrophobicContact CD1-CD1 3.57Å; I223-I234 HydrophobicContact CG1-CD1 3.75Å; I223-I234 HydrophobicContact CG2-CD1 3.74Å
224	T	81.3	Confident	59.5	Low	14 Å²	14	40.6 Å²	40.6	9%	0.086	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	125.1	164.1	-57.2	0	0	0	0	109.2	P101 F104 T168 A190 S191	P101-T224 HydrophobicContact CB-CG2 4.1Å; F104-T224 HydrophobicContact CD1-CG2 4.21Å; F104-T224 WeakPolarHBondContact CD1-OG1 2.92Å; F104-T224 WeakPolarHBondContact CE1-OG1 3.31Å; F104-T224 WeakPolarHBondContact CG-OG1 3.39Å; T168-T224 PolarHBondContact N-O 3.1Å; T168-T224 PolarHBondContact O-N 2.8Å; A190-T224 WeakPolarHBondContact CA-OG1 3.41Å; S191-T224 PolarHBondContact N-OG1 3.23Å
225	S	70.2	Confident	59.4	Low	20 Å²	20	42.5 Å²	42.5	14%	0.14	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.5	172	65.2	0	0	0	0	109.2	G227	S225-G227 VanDerWaalsContact C-N 3.3Å; S225-G227 WeakPolarHBondContact CB-O 3.39Å; S225-G227 PolarHBondContact OG-O 3.2Å
226	S	57.3	Low	59.3	Low	76 Å²	76	40.1 Å²	40.1	53%	0.531	27%	0.269	S	S	.	.	S	Bend	trans	-75	-19.3	171.8	43.4	0	0	0	0	113.2	E164 M166	E164-S226 WeakPolarHBondContact O-CB 3.39Å; E164-S226 PolarHBondContact O-OG 3.05Å; M166-S226 PolarHBondContact O-OG 2.62Å
227	G	50.9	Low	59	Low	24 Å²	24	43.7 Å²	43.7	25%	0.247	29%	0.288	C	S	.	.	S	Bend	trans	-120.8	132.3	168.8	0	0	0	0	0	110	S225 L229	S225-G227 VanDerWaalsContact C-N 3.3Å; S225-G227 WeakPolarHBondContact CB-O 3.39Å; S225-G227 PolarHBondContact OG-O 3.2Å; G227-L229 PolarHBondContact O-N 3.35Å
228	G	46.8	Very low	59	Low	76 Å²	76	45.1 Å²	45.1	78%	0.784	30%	0.298	S	S	*	.			trans	-57.1	85.5	-166.9	0	0	0	0	0	115.4
229	L	47.5	Very low	58.5	Low	26 Å²	26	47 Å²	47	14%	0.136	31%	0.311	C	S	.	.			trans	-82.2	134.7	172.2	-126	76.4	0	0	0	110.5	F121 V123 K192 G227	F121-L229 HydrophobicContact CE2-CD2 3.77Å; F121-L229 HydrophobicContact CZ-CD2 4.26Å; V123-L229 HydrophobicContact CB-CD1 4.11Å; V123-L229 HydrophobicContact CG1-CD1 3.35Å; V123-L229 HydrophobicContact CG2-CD1 4.04Å; K192-L229 PolarHBondContact NZ-O 3.33Å; G227-L229 PolarHBondContact O-N 3.35Å
230	T	43.8	Very low	57.8	Low	75 Å²	75	49.6 Å²	49.6	46%	0.46	33%	0.328	S	S	.	.			trans	-81.7	141.3	169	56.6	0	0	0	0	109.8	E232 T233	T230-E232 PolarHBondContact O-N 3Å; T230-T233 PolarHBondContact O-N 3.39Å; T230-T233 VanDerWaalsContact O-N 3.15Å
231	S	42.7	Very low	56.6	Low	27 Å²	27	52.5 Å²	52.5	19%	0.189	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-59.7	-19.1	-172.2	-165.5	0	0	0	0	114.4	V93 T233	V93-S231 WeakPolarHBondContact CG1-OG 3.43Å; V93-S231 VanDerWaalsContact CG2-OG 3.32Å; V93-S231 WeakPolarHBondContact CG2-OG 3.27Å; S231-T233 PolarHBondContact O-N 3.05Å
232	E	44	Very low	55	Low	188 Å²	188	55.6 Å²	55.6	88%	0.879	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-69.4	-17.1	178.9	-64.3	-172.8	113.8	0	0	113.4	T230	T230-E232 PolarHBondContact O-N 3Å
233	T	43.1	Very low	52.9	Low	87 Å²	87	59.3 Å²	59.3	53%	0.534	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-93.2	-5.3	-175.4	-43.8	0	0	0	0	113	T230 S231 P235	T230-T233 PolarHBondContact O-N 3.39Å; T230-T233 VanDerWaalsContact O-N 3.15Å; S231-T233 PolarHBondContact O-N 3.05Å; T233-P235 WeakPolarHBondContact O-CD 3.35Å
234	I	48.6	Very low	50.5	Low	13 Å²	13	63.1 Å²	63.1	7%	0.067	42%	0.418	C	S	.	.	S	Bend	trans	-87.7	107.3	178.8	-50	-168.5	0	0	0	108.4	F121 V169 I223 G236	F121-I234 HydrophobicContact CE1-CG2 4.39Å; F121-I234 HydrophobicContact CZ-CD1 4.37Å; F121-I234 HydrophobicContact CZ-CG1 4.13Å; F121-I234 HydrophobicContact CZ-CG2 4.37Å; V169-I234 HydrophobicContact CG2-CD1 4Å; V169-I234 HydrophobicContact CG2-CG2 4.19Å; I223-I234 HydrophobicContact CB-CD1 4.41Å; I223-I234 HydrophobicContact CD1-CD1 3.57Å; I223-I234 HydrophobicContact CG1-CD1 3.75Å; I223-I234 HydrophobicContact CG2-CD1 3.74Å; I234-G236 PolarHBondContact O-N 2.78Å
235	P	40.2	Very low	48.1	Very low	97 Å²	97	66.8 Å²	66.8	63%	0.63	44%	0.444	S	S	*	.			trans	-57	137.4	177.3	23	-31	0	0	0	109.4	T233	T233-P235 WeakPolarHBondContact O-CD 3.35Å
236	G	47.3	Very low	46.3	Very low	35 Å²	35	70.8 Å²	70.8	36%	0.361	47%	0.469	S	S	.	.			trans	-60.2	156.1	163.2	0	0	0	0	0	109.6	I234	I234-G236 PolarHBondContact O-N 2.78Å
237	P	43.6	Very low	45.3	Very low	125 Å²	125	70.3 Å²	70.3	81%	0.812	46%	0.463	S	S	*	.			trans	-54.7	0	169.4	27.5	-36.3	0	0	0	111.9	L218	L218-P237 HydrophobicContact CD1-CB 3.93Å; L218-P237 HydrophobicContact CD1-CG 3.82Å; L218-P237 HydrophobicContact CG-CG 4.3Å

Retrieved 237 of 237 residues in 434.8 ms (Link to these results)

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